1 GLY 5 N 0.0048 -0.0255 -0.0062 2 GLY 5 CA 0.0001 -0.0245 -0.0039 3 GLY 5 C -0.0015 -0.0186 -0.0044 4 GLY 5 O 0.0014 -0.0155 -0.0068 5 LEU 6 N -0.0062 -0.0169 -0.0023 6 LEU 6 CA -0.0082 -0.0114 -0.0025 7 LEU 6 C -0.0106 -0.0093 -0.0017 8 LEU 6 O -0.0132 -0.0122 0.0004 9 LEU 6 CB -0.0119 -0.0108 -0.0006 10 LEU 6 CG -0.0130 -0.0052 -0.0014 11 LEU 6 CD1 -0.0083 -0.0028 -0.0046 12 LEU 6 CD2 -0.0159 -0.0055 0.0002 13 TYR 7 N -0.0047 -0.0059 -0.0032 14 TYR 7 CA -0.0060 -0.0042 -0.0029 15 TYR 7 C -0.0064 -0.0015 -0.0027 16 TYR 7 O -0.0050 -0.0007 -0.0031 17 TYR 7 CB -0.0044 -0.0038 -0.0033 18 TYR 7 CG -0.0046 -0.0062 -0.0033 19 TYR 7 CD1 -0.0031 -0.0084 -0.0037 20 TYR 7 CD2 -0.0061 -0.0061 -0.0029 21 TYR 7 CE1 -0.0032 -0.0106 -0.0037 22 TYR 7 CE2 -0.0062 -0.0083 -0.0029 23 TYR 7 CZ -0.0048 -0.0105 -0.0033 24 TYR 7 OH -0.0049 -0.0127 -0.0033 25 ARG 8 N -0.0084 -0.0000 -0.0023 26 ARG 8 CA -0.0090 0.0026 -0.0021 27 ARG 8 C -0.0093 0.0045 -0.0020 28 ARG 8 O -0.0107 0.0039 -0.0016 29 ARG 8 CB -0.0115 0.0026 -0.0015 30 ARG 8 CG -0.0123 0.0053 -0.0012 31 ARG 8 CD -0.0150 0.0053 -0.0006 32 ARG 8 NE -0.0152 0.0037 -0.0006 33 ARG 8 CZ -0.0171 0.0020 -0.0002 34 ARG 8 NH1 -0.0190 0.0015 0.0003 35 ARG 8 NH2 -0.0171 0.0006 -0.0002 36 MET 9 N -0.0043 0.0098 -0.0021 37 MET 9 CA -0.0041 0.0100 -0.0024 38 MET 9 C -0.0044 0.0102 -0.0026 39 MET 9 O -0.0045 0.0102 -0.0026 40 MET 9 CB -0.0038 0.0101 -0.0024 41 MET 9 CG -0.0037 0.0103 -0.0027 42 MET 9 SD -0.0033 0.0104 -0.0027 43 MET 9 CE -0.0031 0.0103 -0.0026 44 THR 10 N -0.0044 0.0103 -0.0027 45 THR 10 CA -0.0046 0.0104 -0.0030 46 THR 10 C -0.0045 0.0106 -0.0032 47 THR 10 O -0.0043 0.0107 -0.0032 48 THR 10 CB -0.0050 0.0104 -0.0029 49 THR 10 CG2 -0.0049 0.0104 -0.0029 50 THR 10 OG1 -0.0052 0.0106 -0.0032 51 TYR 11 N 0.0012 0.0088 -0.0020 52 TYR 11 CA 0.0005 0.0078 -0.0014 53 TYR 11 C 0.0011 0.0076 -0.0005 54 TYR 11 O 0.0019 0.0083 -0.0006 55 TYR 11 CB -0.0006 0.0075 -0.0021 56 TYR 11 CG -0.0006 0.0077 -0.0024 57 TYR 11 CD1 -0.0004 0.0086 -0.0033 58 TYR 11 CD2 -0.0009 0.0071 -0.0018 59 TYR 11 CE1 -0.0004 0.0088 -0.0035 60 TYR 11 CE2 -0.0009 0.0073 -0.0021 61 TYR 11 CZ -0.0006 0.0081 -0.0029 62 TYR 11 OH -0.0007 0.0083 -0.0032 63 ILE 12 N 0.0007 0.0068 0.0002 64 ILE 12 CA 0.0012 0.0065 0.0011 65 ILE 12 C 0.0003 0.0058 0.0012 66 ILE 12 O -0.0006 0.0055 0.0007 67 ILE 12 CB 0.0017 0.0061 0.0022 68 ILE 12 CG1 0.0009 0.0052 0.0025 69 ILE 12 CG2 0.0026 0.0067 0.0021 70 ILE 12 CD1 0.0013 0.0049 0.0033 71 SER 13 N 0.0036 -0.0034 0.0028 72 SER 13 CA 0.0036 -0.0031 0.0034 73 SER 13 C 0.0041 -0.0022 0.0050 74 SER 13 O 0.0048 -0.0017 0.0055 75 SER 13 CB 0.0047 -0.0031 0.0022 76 SER 13 OG 0.0061 -0.0022 0.0027 77 ARG 14 N 0.0038 -0.0020 0.0058 78 ARG 14 CA 0.0042 -0.0011 0.0074 79 ARG 14 C 0.0055 -0.0005 0.0073 80 ARG 14 O 0.0053 -0.0008 0.0067 81 ARG 14 CB 0.0028 -0.0013 0.0086 82 ARG 14 CG 0.0015 -0.0019 0.0088 83 ARG 14 CD 0.0003 -0.0019 0.0104 84 ARG 14 NE -0.0010 -0.0025 0.0105 85 ARG 14 CZ -0.0011 -0.0022 0.0113 86 ARG 14 NH1 0.0001 -0.0013 0.0120 87 ARG 14 NH2 -0.0023 -0.0028 0.0114 88 ALA 15 N 0.0106 -0.0063 0.0071 89 ALA 15 CA 0.0109 -0.0038 0.0036 90 ALA 15 C 0.0107 -0.0049 0.0033 91 ALA 15 O 0.0106 -0.0064 0.0065 92 ALA 15 CB 0.0117 0.0011 0.0044 93 VAL 16 N 0.0106 -0.0041 -0.0006 94 VAL 16 CA 0.0105 -0.0048 -0.0014 95 VAL 16 C 0.0111 -0.0014 0.0011 96 VAL 16 O 0.0117 0.0022 0.0019 97 VAL 16 CB 0.0103 -0.0046 -0.0064 98 VAL 16 CG1 0.0095 -0.0088 -0.0086 99 VAL 16 CG2 0.0108 -0.0006 -0.0085 100 PRO 17 N 0.0122 -0.0360 0.0160 101 PRO 17 CA 0.0128 -0.0091 0.0330 102 PRO 17 C 0.0158 0.0232 0.0133 103 PRO 17 O 0.0165 0.0503 0.0283 104 PRO 17 CB 0.0116 -0.0239 0.0382 105 PRO 17 CG 0.0110 -0.0551 0.0182 106 PRO 17 CD 0.0109 -0.0658 0.0092 107 GLY 18 N 0.0178 0.0214 -0.0198 108 GLY 18 CA 0.0207 0.0504 -0.0406 109 GLY 18 C 0.0224 0.0684 -0.0512 110 GLY 18 O 0.0250 0.0880 -0.0750 111 LEU 19 N 0.0105 0.0059 -0.0052 112 LEU 19 CA 0.0102 0.0011 -0.0026 113 LEU 19 C 0.0073 -0.0019 -0.0034 114 LEU 19 O 0.0042 -0.0011 -0.0066 115 LEU 19 CB 0.0088 -0.0006 -0.0028 116 LEU 19 CG 0.0094 -0.0050 0.0004 117 LEU 19 CD1 0.0136 -0.0041 0.0036 118 LEU 19 CD2 0.0063 -0.0075 -0.0009 119 GLY 20 N 0.0083 -0.0053 -0.0004 120 GLY 20 CA 0.0058 -0.0084 -0.0008 121 GLY 20 C 0.0050 -0.0134 0.0015 122 GLY 20 O 0.0059 -0.0146 0.0030 123 TYR 21 N 0.0116 -0.0214 0.0010 124 TYR 21 CA 0.0092 -0.0135 0.0045 125 TYR 21 C 0.0043 -0.0114 0.0014 126 TYR 21 O 0.0040 -0.0064 0.0048 127 TYR 21 CB 0.0061 -0.0091 0.0048 128 TYR 21 CG 0.0110 -0.0093 0.0092 129 TYR 21 CD1 0.0130 -0.0148 0.0071 130 TYR 21 CD2 0.0136 -0.0040 0.0155 131 TYR 21 CE1 0.0175 -0.0150 0.0112 132 TYR 21 CE2 0.0181 -0.0042 0.0196 133 TYR 21 CZ 0.0200 -0.0097 0.0174 134 TYR 21 OH 0.0245 -0.0099 0.0214 135 ASN 22 N 0.0003 -0.0149 -0.0049 136 ASN 22 CA -0.0046 -0.0130 -0.0081 137 ASN 22 C -0.0013 -0.0146 -0.0061 138 ASN 22 O -0.0033 -0.0100 -0.0046 139 ASN 22 CB -0.0089 -0.0173 -0.0153 140 ASN 22 CG -0.0125 -0.0158 -0.0175 141 ASN 22 ND2 -0.0145 -0.0209 -0.0231 142 ASN 22 OD1 -0.0134 -0.0102 -0.0143 143 ASP 23 N 0.0073 -0.0092 -0.0043 144 ASP 23 CA 0.0102 -0.0113 -0.0026 145 ASP 23 C 0.0092 -0.0123 0.0013 146 ASP 23 O 0.0107 -0.0139 0.0034 147 ASP 23 CB 0.0125 -0.0117 -0.0042 148 ASP 23 CG 0.0143 -0.0112 -0.0078 149 ASP 23 OD1 0.0168 -0.0122 -0.0080 150 ASP 23 OD2 0.0133 -0.0097 -0.0103 151 LEU 24 N 0.0066 -0.0115 0.0023 152 LEU 24 CA 0.0054 -0.0124 0.0059 153 LEU 24 C 0.0042 -0.0126 0.0079 154 LEU 24 O 0.0051 -0.0141 0.0107 155 LEU 24 CB 0.0026 -0.0112 0.0063 156 LEU 24 CG 0.0037 -0.0115 0.0057 157 LEU 24 CD1 0.0007 -0.0101 0.0058 158 LEU 24 CD2 0.0059 -0.0136 0.0084 159 ARG 25 N 0.0004 -0.0088 0.0056 160 ARG 25 CA -0.0017 -0.0062 0.0064 161 ARG 25 C -0.0008 -0.0077 0.0047 162 ARG 25 O -0.0012 -0.0066 0.0068 163 ARG 25 CB -0.0051 -0.0031 0.0043 164 ARG 25 CG -0.0058 -0.0036 -0.0007 165 ARG 25 CD -0.0093 -0.0002 -0.0024 166 ARG 25 NE -0.0101 -0.0004 -0.0062 167 ARG 25 CZ -0.0119 0.0016 -0.0061 168 ARG 25 NH1 -0.0131 0.0038 -0.0026 169 ARG 25 NH2 -0.0125 0.0013 -0.0098 170 ASP 26 N 0.0005 -0.0100 0.0010 171 ASP 26 CA 0.0017 -0.0117 -0.0004 172 ASP 26 C 0.0044 -0.0137 0.0031 173 ASP 26 O 0.0044 -0.0135 0.0042 174 ASP 26 CB 0.0028 -0.0141 -0.0049 175 ASP 26 CG 0.0038 -0.0156 -0.0068 176 ASP 26 OD1 0.0019 -0.0137 -0.0072 177 ASP 26 OD2 0.0064 -0.0188 -0.0079 178 ILE 27 N 0.0009 -0.0150 -0.0005 179 ILE 27 CA 0.0018 -0.0156 0.0008 180 ILE 27 C 0.0015 -0.0144 0.0022 181 ILE 27 O 0.0018 -0.0145 0.0028 182 ILE 27 CB 0.0028 -0.0166 0.0015 183 ILE 27 CG1 0.0032 -0.0179 0.0001 184 ILE 27 CG2 0.0038 -0.0171 0.0029 185 ILE 27 CD1 0.0038 -0.0186 0.0003 186 MET 28 N 0.0009 -0.0133 0.0027 187 MET 28 CA 0.0006 -0.0121 0.0041 188 MET 28 C -0.0001 -0.0114 0.0036 189 MET 28 O 0.0000 -0.0111 0.0046 190 MET 28 CB 0.0000 -0.0111 0.0045 191 MET 28 CG -0.0002 -0.0100 0.0061 192 MET 28 SD -0.0009 -0.0088 0.0065 193 MET 28 CE -0.0022 -0.0079 0.0048 194 GLY 29 N -0.0038 -0.0120 -0.0047 195 GLY 29 CA -0.0027 -0.0121 -0.0068 196 GLY 29 C -0.0034 -0.0140 -0.0083 197 GLY 29 O -0.0031 -0.0148 -0.0097 198 LYS 30 N -0.0042 -0.0148 -0.0079 199 LYS 30 CA -0.0049 -0.0166 -0.0092 200 LYS 30 C -0.0060 -0.0181 -0.0091 201 LYS 30 O -0.0061 -0.0193 -0.0107 202 LYS 30 CB -0.0056 -0.0171 -0.0086 203 LYS 30 CG -0.0045 -0.0161 -0.0091 204 LYS 30 CD -0.0053 -0.0166 -0.0083 205 LYS 30 CE -0.0042 -0.0155 -0.0088 206 LYS 30 NZ -0.0050 -0.0160 -0.0080 207 SER 31 N -0.0057 -0.0138 -0.0053 208 SER 31 CA -0.0041 -0.0128 -0.0041 209 SER 31 C -0.0044 -0.0102 -0.0037 210 SER 31 O -0.0043 -0.0090 -0.0034 211 SER 31 CB -0.0020 -0.0137 -0.0032 212 SER 31 OG -0.0017 -0.0131 -0.0028 213 GLU 32 N -0.0047 -0.0093 -0.0037 214 GLU 32 CA -0.0051 -0.0068 -0.0033 215 GLU 32 C -0.0069 -0.0058 -0.0041 216 GLU 32 O -0.0067 -0.0041 -0.0036 217 GLU 32 CB -0.0054 -0.0061 -0.0033 218 GLU 32 CG -0.0037 -0.0048 -0.0020 219 GLU 32 CD -0.0036 -0.0048 -0.0020 220 GLU 32 OE1 -0.0052 -0.0052 -0.0030 221 GLU 32 OE2 -0.0020 -0.0044 -0.0010 222 VAL 33 N -0.0138 -0.0066 -0.0070 223 VAL 33 CA -0.0164 -0.0050 -0.0061 224 VAL 33 C -0.0137 -0.0040 -0.0046 225 VAL 33 O -0.0142 -0.0013 -0.0022 226 VAL 33 CB -0.0195 -0.0071 -0.0088 227 VAL 33 CG1 -0.0211 -0.0060 -0.0081 228 VAL 33 CG2 -0.0230 -0.0070 -0.0096 229 ASN 34 N -0.0108 -0.0063 -0.0060 230 ASN 34 CA -0.0084 -0.0056 -0.0048 231 ASN 34 C -0.0056 -0.0032 -0.0019 232 ASN 34 O -0.0054 -0.0010 0.0002 233 ASN 34 CB -0.0058 -0.0086 -0.0070 234 ASN 34 CG -0.0084 -0.0108 -0.0097 235 ASN 34 ND2 -0.0100 -0.0127 -0.0118 236 ASN 34 OD1 -0.0091 -0.0108 -0.0098 237 ASN 35 N -0.0057 -0.0019 -0.0021 238 ASN 35 CA -0.0048 -0.0012 -0.0013 239 ASN 35 C -0.0070 -0.0025 0.0018 240 ASN 35 O -0.0061 -0.0017 0.0039 241 ASN 35 CB -0.0046 -0.0014 -0.0049 242 ASN 35 CG -0.0018 0.0003 -0.0076 243 ASN 35 ND2 0.0002 0.0015 -0.0088 244 ASN 35 OD1 -0.0014 0.0005 -0.0084 245 SER 36 N -0.0100 -0.0045 0.0021 246 SER 36 CA -0.0121 -0.0056 0.0053 247 SER 36 C -0.0108 -0.0045 0.0091 248 SER 36 O -0.0108 -0.0043 0.0120 249 SER 36 CB -0.0155 -0.0080 0.0049 250 SER 36 OG -0.0159 -0.0081 0.0064 251 HIS 37 N -0.0124 -0.0118 0.0107 252 HIS 37 CA -0.0101 -0.0088 0.0184 253 HIS 37 C -0.0074 -0.0029 0.0178 254 HIS 37 O -0.0067 -0.0027 0.0228 255 HIS 37 CB -0.0082 -0.0057 0.0218 256 HIS 37 CG -0.0050 -0.0007 0.0283 257 HIS 37 CD2 -0.0018 0.0061 0.0293 258 HIS 37 ND1 -0.0051 -0.0025 0.0348 259 HIS 37 CE1 -0.0019 0.0030 0.0395 260 HIS 37 NE2 0.0001 0.0082 0.0364 261 VAL 38 N -0.0059 0.0019 0.0116 262 VAL 38 CA -0.0032 0.0079 0.0109 263 VAL 38 C -0.0046 0.0059 0.0068 264 VAL 38 O -0.0031 0.0087 0.0088 265 VAL 38 CB -0.0006 0.0146 0.0066 266 VAL 38 CG1 0.0028 0.0213 0.0087 267 VAL 38 CG2 0.0001 0.0155 0.0089 268 GLY 39 N -0.0024 0.0024 0.0035 269 GLY 39 CA -0.0030 0.0019 0.0033 270 GLY 39 C -0.0023 0.0027 0.0010 271 GLY 39 O -0.0017 0.0032 0.0012 272 LEU 40 N -0.0024 0.0027 -0.0011 273 LEU 40 CA -0.0019 0.0033 -0.0034 274 LEU 40 C -0.0036 0.0019 -0.0051 275 LEU 40 O -0.0048 0.0007 -0.0051 276 LEU 40 CB -0.0005 0.0047 -0.0047 277 LEU 40 CG 0.0012 0.0062 -0.0033 278 LEU 40 CD1 0.0020 0.0070 -0.0044 279 LEU 40 CD2 0.0025 0.0074 -0.0034 280 THR 41 N -0.0034 0.0014 -0.0005 281 THR 41 CA -0.0030 0.0010 -0.0006 282 THR 41 C -0.0033 0.0013 -0.0005 283 THR 41 O -0.0038 0.0017 -0.0004 284 THR 41 CB -0.0027 0.0007 -0.0014 285 THR 41 CG2 -0.0024 0.0005 -0.0015 286 THR 41 OG1 -0.0032 0.0011 -0.0019 287 GLY 42 N -0.0029 0.0010 -0.0005 288 GLY 42 CA -0.0032 0.0012 -0.0004 289 GLY 42 C -0.0027 0.0009 0.0001 290 GLY 42 O -0.0022 0.0005 0.0001 291 LEU 43 N 0.0017 -0.0014 0.0017 292 LEU 43 CA 0.0019 -0.0017 0.0018 293 LEU 43 C 0.0018 -0.0019 0.0020 294 LEU 43 O 0.0017 -0.0018 0.0020 295 LEU 43 CB 0.0022 -0.0017 0.0017 296 LEU 43 CG 0.0025 -0.0019 0.0018 297 LEU 43 CD1 0.0025 -0.0021 0.0019 298 LEU 43 CD2 0.0028 -0.0019 0.0016 299 LEU 44 N 0.0018 -0.0021 0.0022 300 LEU 44 CA 0.0017 -0.0023 0.0024 301 LEU 44 C 0.0020 -0.0026 0.0025 302 LEU 44 O 0.0021 -0.0027 0.0025 303 LEU 44 CB 0.0014 -0.0024 0.0026 304 LEU 44 CG 0.0013 -0.0027 0.0028 305 LEU 44 CD1 0.0012 -0.0027 0.0028 306 LEU 44 CD2 0.0010 -0.0028 0.0029 307 CYS 45 N 0.0074 -0.0036 0.0027 308 CYS 45 CA 0.0078 -0.0039 0.0030 309 CYS 45 C 0.0075 -0.0037 0.0038 310 CYS 45 O 0.0069 -0.0033 0.0039 311 CYS 45 CB 0.0079 -0.0038 0.0023 312 CYS 45 SG 0.0082 -0.0041 0.0025 313 PHE 46 N 0.0079 -0.0041 0.0043 314 PHE 46 CA 0.0077 -0.0040 0.0051 315 PHE 46 C 0.0080 -0.0042 0.0052 316 PHE 46 O 0.0086 -0.0046 0.0049 317 PHE 46 CB 0.0079 -0.0042 0.0059 318 PHE 46 CG 0.0077 -0.0041 0.0067 319 PHE 46 CD1 0.0070 -0.0037 0.0069 320 PHE 46 CD2 0.0081 -0.0045 0.0074 321 PHE 46 CE1 0.0068 -0.0036 0.0077 322 PHE 46 CE2 0.0079 -0.0044 0.0081 323 PHE 46 CZ 0.0072 -0.0040 0.0083 324 GLY 47 N 0.0109 -0.0020 0.0035 325 GLY 47 CA 0.0116 -0.0016 0.0063 326 GLY 47 C 0.0091 -0.0023 0.0086 327 GLY 47 O 0.0065 -0.0031 0.0077 328 ASN 48 N 0.0097 -0.0019 0.0116 329 ASN 48 CA 0.0075 -0.0025 0.0140 330 ASN 48 C 0.0052 -0.0032 0.0136 331 ASN 48 O 0.0025 -0.0039 0.0142 332 ASN 48 CB 0.0059 -0.0029 0.0142 333 ASN 48 CG 0.0046 -0.0032 0.0173 334 ASN 48 ND2 0.0021 -0.0039 0.0174 335 ASN 48 OD1 0.0058 -0.0027 0.0197 336 SER 49 N 0.0089 -0.0025 0.0143 337 SER 49 CA 0.0074 -0.0023 0.0147 338 SER 49 C 0.0057 -0.0020 0.0129 339 SER 49 O 0.0039 -0.0017 0.0134 340 SER 49 CB 0.0064 -0.0021 0.0169 341 SER 49 OG 0.0076 -0.0023 0.0185 342 ILE 50 N 0.0063 -0.0021 0.0109 343 ILE 50 CA 0.0049 -0.0019 0.0091 344 ILE 50 C 0.0060 -0.0021 0.0072 345 ILE 50 O 0.0079 -0.0023 0.0067 346 ILE 50 CB 0.0040 -0.0018 0.0085 347 ILE 50 CG1 0.0020 -0.0015 0.0098 348 ILE 50 CG2 0.0035 -0.0017 0.0061 349 ILE 50 CD1 0.0011 -0.0013 0.0094 350 PHE 51 N 0.0041 -0.0013 0.0036 351 PHE 51 CA 0.0043 -0.0013 0.0032 352 PHE 51 C 0.0041 -0.0009 0.0024 353 PHE 51 O 0.0035 -0.0005 0.0023 354 PHE 51 CB 0.0039 -0.0012 0.0035 355 PHE 51 CG 0.0042 -0.0016 0.0042 356 PHE 51 CD1 0.0048 -0.0020 0.0041 357 PHE 51 CD2 0.0039 -0.0015 0.0050 358 PHE 51 CE1 0.0051 -0.0023 0.0047 359 PHE 51 CE2 0.0041 -0.0019 0.0056 360 PHE 51 CZ 0.0048 -0.0023 0.0055 361 LEU 52 N 0.0045 -0.0010 0.0018 362 LEU 52 CA 0.0043 -0.0007 0.0010 363 LEU 52 C 0.0045 -0.0007 0.0007 364 LEU 52 O 0.0051 -0.0011 0.0005 365 LEU 52 CB 0.0046 -0.0008 0.0005 366 LEU 52 CG 0.0047 -0.0005 -0.0004 367 LEU 52 CD1 0.0040 -0.0000 -0.0007 368 LEU 52 CD2 0.0052 -0.0008 -0.0008 369 GLN 53 N -0.0028 0.0068 -0.0004 370 GLN 53 CA -0.0024 0.0064 -0.0006 371 GLN 53 C -0.0027 0.0057 -0.0006 372 GLN 53 O -0.0028 0.0055 -0.0006 373 GLN 53 CB -0.0017 0.0064 -0.0008 374 GLN 53 CG -0.0013 0.0059 -0.0009 375 GLN 53 CD -0.0006 0.0061 -0.0011 376 GLN 53 NE2 -0.0002 0.0059 -0.0013 377 GLN 53 OE1 -0.0004 0.0064 -0.0012 378 ILE 54 N -0.0027 0.0053 -0.0006 379 ILE 54 CA -0.0028 0.0046 -0.0006 380 ILE 54 C -0.0022 0.0042 -0.0009 381 ILE 54 O -0.0020 0.0043 -0.0009 382 ILE 54 CB -0.0034 0.0044 -0.0005 383 ILE 54 CG1 -0.0035 0.0037 -0.0005 384 ILE 54 CG2 -0.0034 0.0047 -0.0005 385 ILE 54 CD1 -0.0041 0.0035 -0.0004 386 LEU 55 N -0.0064 0.0093 -0.0036 387 LEU 55 CA -0.0049 0.0080 -0.0033 388 LEU 55 C -0.0053 0.0060 -0.0027 389 LEU 55 O -0.0061 0.0056 -0.0025 390 LEU 55 CB -0.0028 0.0085 -0.0037 391 LEU 55 CG -0.0018 0.0103 -0.0043 392 LEU 55 CD1 -0.0009 0.0113 -0.0047 393 LEU 55 CD2 -0.0002 0.0098 -0.0043 394 GLU 56 N -0.0048 0.0047 -0.0023 395 GLU 56 CA -0.0051 0.0027 -0.0017 396 GLU 56 C -0.0033 0.0015 -0.0015 397 GLU 56 O -0.0026 0.0019 -0.0017 398 GLU 56 CB -0.0070 0.0020 -0.0013 399 GLU 56 CG -0.0088 0.0031 -0.0015 400 GLU 56 CD -0.0107 0.0020 -0.0010 401 GLU 56 OE1 -0.0106 0.0010 -0.0007 402 GLU 56 OE2 -0.0122 0.0023 -0.0009 403 GLY 57 N -0.0049 0.0012 -0.0031 404 GLY 57 CA -0.0020 -0.0006 -0.0022 405 GLY 57 C -0.0002 -0.0019 -0.0015 406 GLY 57 O -0.0017 -0.0022 -0.0015 407 SER 58 N 0.0029 -0.0028 -0.0009 408 SER 58 CA 0.0050 -0.0040 -0.0003 409 SER 58 C 0.0061 -0.0014 -0.0013 410 SER 58 O 0.0062 0.0013 -0.0025 411 SER 58 CB 0.0081 -0.0057 0.0006 412 SER 58 OG 0.0104 -0.0035 -0.0002 413 ARG 59 N 0.0062 -0.0043 -0.0025 414 ARG 59 CA 0.0061 -0.0023 -0.0026 415 ARG 59 C 0.0094 -0.0001 -0.0032 416 ARG 59 O 0.0091 0.0030 -0.0034 417 ARG 59 CB 0.0058 -0.0048 -0.0024 418 ARG 59 CG 0.0044 -0.0031 -0.0023 419 ARG 59 CD 0.0034 -0.0058 -0.0020 420 ARG 59 NE 0.0064 -0.0078 -0.0023 421 ARG 59 CZ 0.0062 -0.0106 -0.0020 422 ARG 59 NH1 0.0033 -0.0118 -0.0015 423 ARG 59 NH2 0.0091 -0.0123 -0.0023 424 GLN 60 N 0.0124 -0.0017 -0.0035 425 GLN 60 CA 0.0156 0.0001 -0.0041 426 GLN 60 C 0.0161 0.0030 -0.0044 427 GLN 60 O 0.0172 0.0059 -0.0047 428 GLN 60 CB 0.0187 -0.0024 -0.0043 429 GLN 60 CG 0.0221 -0.0008 -0.0049 430 GLN 60 CD 0.0242 0.0004 -0.0053 431 GLN 60 NE2 0.0260 -0.0021 -0.0053 432 GLN 60 OE1 0.0241 0.0034 -0.0055 433 ALA 61 N 0.0128 0.0047 -0.0021 434 ALA 61 CA 0.0119 0.0066 -0.0032 435 ALA 61 C 0.0102 0.0088 -0.0043 436 ALA 61 O 0.0108 0.0109 -0.0057 437 ALA 61 CB 0.0102 0.0054 -0.0022 438 ILE 62 N 0.0082 0.0084 -0.0038 439 ILE 62 CA 0.0065 0.0104 -0.0049 440 ILE 62 C 0.0086 0.0119 -0.0060 441 ILE 62 O 0.0084 0.0142 -0.0074 442 ILE 62 CB 0.0041 0.0095 -0.0040 443 ILE 62 CG1 0.0018 0.0082 -0.0029 444 ILE 62 CG2 0.0026 0.0117 -0.0051 445 ILE 62 CD1 0.0003 0.0063 -0.0016 446 SER 63 N 0.0066 0.0101 -0.0049 447 SER 63 CA 0.0081 0.0096 -0.0061 448 SER 63 C 0.0098 0.0114 -0.0087 449 SER 63 O 0.0101 0.0128 -0.0097 450 SER 63 CB 0.0093 0.0062 -0.0058 451 SER 63 OG 0.0077 0.0045 -0.0034 452 HIS 64 N 0.0109 0.0115 -0.0099 453 HIS 64 CA 0.0126 0.0131 -0.0124 454 HIS 64 C 0.0115 0.0165 -0.0128 455 HIS 64 O 0.0124 0.0181 -0.0146 456 HIS 64 CB 0.0139 0.0123 -0.0134 457 HIS 64 CG 0.0151 0.0145 -0.0156 458 HIS 64 CD2 0.0147 0.0162 -0.0161 459 HIS 64 ND1 0.0168 0.0152 -0.0177 460 HIS 64 CE1 0.0175 0.0173 -0.0194 461 HIS 64 NE2 0.0163 0.0179 -0.0184 462 THR 65 N 0.0100 0.0125 -0.0152 463 THR 65 CA 0.0101 0.0150 -0.0144 464 THR 65 C 0.0093 0.0149 -0.0128 465 THR 65 O 0.0096 0.0163 -0.0130 466 THR 65 CB 0.0098 0.0165 -0.0132 467 THR 65 CG2 0.0094 0.0186 -0.0116 468 THR 65 OG1 0.0107 0.0176 -0.0149 469 TYR 66 N 0.0084 0.0131 -0.0113 470 TYR 66 CA 0.0077 0.0128 -0.0098 471 TYR 66 C 0.0082 0.0119 -0.0112 472 TYR 66 O 0.0081 0.0128 -0.0107 473 TYR 66 CB 0.0066 0.0109 -0.0080 474 TYR 66 CG 0.0058 0.0106 -0.0062 475 TYR 66 CD1 0.0055 0.0126 -0.0049 476 TYR 66 CD2 0.0052 0.0083 -0.0059 477 TYR 66 CE1 0.0048 0.0123 -0.0033 478 TYR 66 CE2 0.0045 0.0080 -0.0042 479 TYR 66 CZ 0.0043 0.0100 -0.0029 480 TYR 66 OH 0.0035 0.0097 -0.0013 481 HIS 67 N 0.0089 0.0150 -0.0142 482 HIS 67 CA 0.0065 0.0136 -0.0138 483 HIS 67 C 0.0069 0.0132 -0.0130 484 HIS 67 O 0.0060 0.0116 -0.0114 485 HIS 67 CB 0.0042 0.0143 -0.0160 486 HIS 67 CG 0.0019 0.0132 -0.0160 487 HIS 67 CD2 0.0006 0.0113 -0.0143 488 HIS 67 ND1 0.0005 0.0140 -0.0179 489 HIS 67 CE1 -0.0015 0.0127 -0.0173 490 HIS 67 NE2 -0.0015 0.0111 -0.0152 491 ARG 68 N 0.0083 0.0146 -0.0141 492 ARG 68 CA 0.0089 0.0143 -0.0133 493 ARG 68 C 0.0107 0.0133 -0.0108 494 ARG 68 O 0.0104 0.0121 -0.0094 495 ARG 68 CB 0.0101 0.0161 -0.0150 496 ARG 68 CG 0.0081 0.0167 -0.0169 497 ARG 68 CD 0.0095 0.0186 -0.0187 498 ARG 68 NE 0.0122 0.0190 -0.0176 499 ARG 68 CZ 0.0143 0.0206 -0.0185 500 ARG 68 NH1 0.0140 0.0220 -0.0205 501 ARG 68 NH2 0.0167 0.0208 -0.0173 502 ILE 69 N 0.0109 0.0112 -0.0145 503 ILE 69 CA 0.0117 0.0116 -0.0121 504 ILE 69 C 0.0106 0.0100 -0.0105 505 ILE 69 O 0.0110 0.0102 -0.0090 506 ILE 69 CB 0.0126 0.0123 -0.0112 507 ILE 69 CG1 0.0142 0.0143 -0.0120 508 ILE 69 CG2 0.0128 0.0120 -0.0085 509 ILE 69 CD1 0.0152 0.0151 -0.0108 510 LEU 70 N 0.0091 0.0085 -0.0108 511 LEU 70 CA 0.0079 0.0069 -0.0093 512 LEU 70 C 0.0075 0.0065 -0.0095 513 LEU 70 O 0.0070 0.0056 -0.0079 514 LEU 70 CB 0.0063 0.0053 -0.0099 515 LEU 70 CG 0.0063 0.0050 -0.0087 516 LEU 70 CD1 0.0047 0.0035 -0.0096 517 LEU 70 CD2 0.0065 0.0047 -0.0061 518 GLN 71 N 0.0067 0.0036 -0.0149 519 GLN 71 CA 0.0047 0.0020 -0.0132 520 GLN 71 C 0.0067 0.0005 -0.0116 521 GLN 71 O 0.0054 -0.0009 -0.0100 522 GLN 71 CB 0.0022 0.0033 -0.0147 523 GLN 71 CG -0.0004 0.0046 -0.0160 524 GLN 71 CD -0.0024 0.0061 -0.0177 525 GLN 71 NE2 -0.0050 0.0052 -0.0168 526 GLN 71 OE1 -0.0016 0.0081 -0.0199 527 ASP 72 N 0.0100 0.0008 -0.0119 528 ASP 72 CA 0.0121 -0.0006 -0.0103 529 ASP 72 C 0.0121 -0.0030 -0.0077 530 ASP 72 O 0.0124 -0.0033 -0.0075 531 ASP 72 CB 0.0156 0.0003 -0.0113 532 ASP 72 CG 0.0174 -0.0002 -0.0108 533 ASP 72 OD1 0.0179 -0.0021 -0.0087 534 ASP 72 OD2 0.0182 0.0014 -0.0126 535 PRO 73 N 0.0157 -0.0045 -0.0041 536 PRO 73 CA 0.0149 -0.0024 -0.0036 537 PRO 73 C 0.0145 -0.0030 -0.0044 538 PRO 73 O 0.0141 -0.0014 -0.0038 539 PRO 73 CB 0.0165 -0.0016 -0.0011 540 PRO 73 CG 0.0182 -0.0037 -0.0005 541 PRO 73 CD 0.0177 -0.0057 -0.0025 542 ARG 74 N 0.0146 -0.0051 -0.0058 543 ARG 74 CA 0.0143 -0.0057 -0.0066 544 ARG 74 C 0.0122 -0.0053 -0.0087 545 ARG 74 O 0.0118 -0.0058 -0.0096 546 ARG 74 CB 0.0155 -0.0084 -0.0069 547 ARG 74 CG 0.0176 -0.0089 -0.0049 548 ARG 74 CD 0.0187 -0.0114 -0.0053 549 ARG 74 NE 0.0194 -0.0133 -0.0057 550 ARG 74 CZ 0.0209 -0.0137 -0.0042 551 ARG 74 NH1 0.0219 -0.0125 -0.0021 552 ARG 74 NH2 0.0214 -0.0155 -0.0047 553 HIS 75 N 0.0121 -0.0009 -0.0037 554 HIS 75 CA 0.0115 -0.0015 -0.0022 555 HIS 75 C 0.0098 -0.0033 -0.0023 556 HIS 75 O 0.0092 -0.0041 -0.0038 557 HIS 75 CB 0.0121 -0.0008 -0.0027 558 HIS 75 CG 0.0117 -0.0014 -0.0050 559 HIS 75 CD2 0.0111 -0.0022 -0.0067 560 HIS 75 ND1 0.0120 -0.0010 -0.0056 561 HIS 75 CE1 0.0116 -0.0016 -0.0076 562 HIS 75 NE2 0.0110 -0.0023 -0.0083 563 HIS 76 N 0.0090 -0.0041 -0.0007 564 HIS 76 CA 0.0074 -0.0058 -0.0005 565 HIS 76 C 0.0069 -0.0063 0.0007 566 HIS 76 O 0.0078 -0.0053 0.0016 567 HIS 76 CB 0.0069 -0.0064 0.0006 568 HIS 76 CG 0.0073 -0.0058 0.0029 569 HIS 76 CD2 0.0065 -0.0065 0.0048 570 HIS 76 ND1 0.0088 -0.0041 0.0035 571 HIS 76 CE1 0.0088 -0.0039 0.0056 572 HIS 76 NE2 0.0075 -0.0054 0.0065 573 SER 77 N -0.0014 -0.0072 0.0024 574 SER 77 CA -0.0004 -0.0074 0.0035 575 SER 77 C 0.0012 -0.0048 0.0023 576 SER 77 O 0.0034 -0.0042 0.0035 577 SER 77 CB 0.0014 -0.0087 0.0063 578 SER 77 OG -0.0001 -0.0111 0.0075 579 ALA 78 N 0.0001 -0.0034 -0.0002 580 ALA 78 CA 0.0013 -0.0009 -0.0015 581 ALA 78 C 0.0012 -0.0011 -0.0014 582 ALA 78 O -0.0007 -0.0028 -0.0013 583 ALA 78 CB -0.0001 0.0006 -0.0042 584 GLU 79 N -0.0033 0.0016 -0.0010 585 GLU 79 CA -0.0028 0.0018 -0.0007 586 GLU 79 C -0.0022 0.0037 -0.0014 587 GLU 79 O -0.0015 0.0047 -0.0014 588 GLU 79 CB -0.0014 0.0010 0.0007 589 GLU 79 CG -0.0019 -0.0010 0.0013 590 GLU 79 CD -0.0005 -0.0018 0.0027 591 GLU 79 OE1 -0.0005 -0.0030 0.0034 592 GLU 79 OE2 0.0005 -0.0012 0.0032 593 ILE 80 N -0.0026 0.0041 -0.0019 594 ILE 80 CA -0.0021 0.0059 -0.0024 595 ILE 80 C -0.0005 0.0061 -0.0015 596 ILE 80 O -0.0003 0.0052 -0.0009 597 ILE 80 CB -0.0033 0.0063 -0.0035 598 ILE 80 CG1 -0.0050 0.0058 -0.0044 599 ILE 80 CG2 -0.0029 0.0082 -0.0042 600 ILE 80 CD1 -0.0063 0.0057 -0.0053 601 ILE 81 N -0.0061 0.0084 -0.0023 602 ILE 81 CA -0.0054 0.0086 -0.0020 603 ILE 81 C -0.0054 0.0092 -0.0025 604 ILE 81 O -0.0054 0.0090 -0.0024 605 ILE 81 CB -0.0046 0.0089 -0.0018 606 ILE 81 CG1 -0.0043 0.0082 -0.0011 607 ILE 81 CG2 -0.0038 0.0094 -0.0017 608 ILE 81 CD1 -0.0036 0.0084 -0.0008 609 ALA 82 N -0.0056 0.0098 -0.0031 610 ALA 82 CA -0.0056 0.0104 -0.0036 611 ALA 82 C -0.0061 0.0109 -0.0043 612 ALA 82 O -0.0063 0.0110 -0.0045 613 ALA 82 CB -0.0047 0.0109 -0.0035 614 PHE 83 N -0.0119 0.0098 -0.0041 615 PHE 83 CA -0.0098 0.0079 -0.0034 616 PHE 83 C -0.0107 0.0053 -0.0027 617 PHE 83 O -0.0104 0.0048 -0.0025 618 PHE 83 CB -0.0070 0.0088 -0.0036 619 PHE 83 CG -0.0047 0.0069 -0.0030 620 PHE 83 CD1 -0.0042 0.0047 -0.0023 621 PHE 83 CD2 -0.0031 0.0073 -0.0030 622 PHE 83 CE1 -0.0021 0.0030 -0.0017 623 PHE 83 CE2 -0.0010 0.0056 -0.0025 624 PHE 83 CZ -0.0005 0.0035 -0.0018 625 ASP 84 N -0.0118 0.0035 -0.0022 626 ASP 84 CA -0.0129 0.0010 -0.0015 627 ASP 84 C -0.0122 -0.0013 -0.0008 628 ASP 84 O -0.0119 -0.0008 -0.0009 629 ASP 84 CB -0.0160 0.0012 -0.0017 630 ASP 84 CG -0.0174 0.0027 -0.0021 631 ASP 84 OD1 -0.0170 0.0051 -0.0028 632 ASP 84 OD2 -0.0190 0.0014 -0.0018 633 PRO 85 N -0.0152 -0.0108 0.0008 634 PRO 85 CA -0.0144 -0.0120 0.0004 635 PRO 85 C -0.0161 -0.0117 0.0011 636 PRO 85 O -0.0181 -0.0115 0.0021 637 PRO 85 CB -0.0142 -0.0148 0.0002 638 PRO 85 CG -0.0154 -0.0150 0.0008 639 PRO 85 CD -0.0163 -0.0125 0.0012 640 VAL 86 N -0.0151 -0.0117 0.0007 641 VAL 86 CA -0.0165 -0.0112 0.0013 642 VAL 86 C -0.0158 -0.0131 0.0010 643 VAL 86 O -0.0140 -0.0143 0.0002 644 VAL 86 CB -0.0161 -0.0086 0.0012 645 VAL 86 CG1 -0.0177 -0.0068 0.0019 646 VAL 86 CG2 -0.0137 -0.0078 0.0001 647 LEU 87 N 0.0051 0.0122 0.0024 648 LEU 87 CA -0.0000 0.0202 0.0108 649 LEU 87 C -0.0137 0.0140 0.0133 650 LEU 87 O -0.0226 0.0188 0.0215 651 LEU 87 CB 0.0094 0.0249 0.0095 652 LEU 87 CG 0.0097 0.0366 0.0178 653 LEU 87 CD1 0.0199 0.0388 0.0141 654 LEU 87 CD2 -0.0035 0.0369 0.0247 655 GLN 88 N -0.0154 0.0032 0.0065 656 GLN 88 CA -0.0280 -0.0034 0.0082 657 GLN 88 C -0.0306 -0.0164 0.0000 658 GLN 88 O -0.0215 -0.0207 -0.0077 659 GLN 88 CB -0.0286 -0.0023 0.0092 660 GLN 88 CG -0.0173 -0.0053 0.0013 661 GLN 88 CD -0.0180 -0.0040 0.0026 662 GLN 88 NE2 -0.0101 -0.0086 -0.0048 663 GLN 88 OE1 -0.0256 0.0011 0.0101 664 ARG 89 N -0.0132 -0.0047 -0.0005 665 ARG 89 CA -0.0129 -0.0036 0.0002 666 ARG 89 C -0.0132 -0.0031 0.0006 667 ARG 89 O -0.0133 -0.0036 0.0003 668 ARG 89 CB -0.0116 -0.0033 0.0001 669 ARG 89 CG -0.0110 -0.0040 -0.0006 670 ARG 89 CD -0.0097 -0.0037 -0.0007 671 ARG 89 NE -0.0093 -0.0031 -0.0004 672 ARG 89 CZ -0.0088 -0.0035 -0.0008 673 ARG 89 NH1 -0.0087 -0.0044 -0.0015 674 ARG 89 NH2 -0.0084 -0.0029 -0.0004 675 GLU 90 N -0.0133 -0.0022 0.0013 676 GLU 90 CA -0.0134 -0.0016 0.0018 677 GLU 90 C -0.0125 -0.0007 0.0022 678 GLU 90 O -0.0125 -0.0002 0.0026 679 GLU 90 CB -0.0146 -0.0012 0.0024 680 GLU 90 CG -0.0156 -0.0020 0.0021 681 GLU 90 CD -0.0168 -0.0018 0.0026 682 GLU 90 OE1 -0.0173 -0.0012 0.0031 683 GLU 90 OE2 -0.0171 -0.0021 0.0024 684 PHE 91 N -0.0059 -0.0013 0.0007 685 PHE 91 CA -0.0050 -0.0011 0.0014 686 PHE 91 C -0.0043 -0.0014 0.0011 687 PHE 91 O -0.0040 -0.0012 0.0016 688 PHE 91 CB -0.0055 -0.0006 0.0024 689 PHE 91 CG -0.0062 -0.0003 0.0029 690 PHE 91 CD1 -0.0057 -0.0001 0.0035 691 PHE 91 CD2 -0.0072 -0.0003 0.0026 692 PHE 91 CE1 -0.0063 0.0002 0.0039 693 PHE 91 CE2 -0.0079 0.0000 0.0030 694 PHE 91 CZ -0.0074 0.0002 0.0037 695 VAL 92 N -0.0040 -0.0019 0.0001 696 VAL 92 CA -0.0034 -0.0022 -0.0003 697 VAL 92 C -0.0023 -0.0021 0.0002 698 VAL 92 O -0.0019 -0.0021 0.0003 699 VAL 92 CB -0.0033 -0.0027 -0.0014 700 VAL 92 CG1 -0.0030 -0.0028 -0.0015 701 VAL 92 CG2 -0.0025 -0.0030 -0.0019 702 GLN 93 N 0.0000 -0.0024 0.0000 703 GLN 93 CA 0.0013 -0.0015 -0.0000 704 GLN 93 C 0.0016 -0.0011 0.0002 705 GLN 93 O 0.0026 -0.0008 -0.0005 706 GLN 93 CB 0.0016 -0.0006 0.0010 707 GLN 93 CG 0.0009 -0.0009 0.0013 708 GLN 93 CD -0.0003 -0.0012 0.0024 709 GLN 93 NE2 -0.0013 -0.0020 0.0022 710 GLN 93 OE1 -0.0004 -0.0006 0.0034 711 TRP 94 N 0.0007 -0.0012 0.0011 712 TRP 94 CA 0.0010 -0.0007 0.0015 713 TRP 94 C 0.0004 -0.0015 0.0009 714 TRP 94 O -0.0007 -0.0023 0.0011 715 TRP 94 CB 0.0005 -0.0002 0.0030 716 TRP 94 CG 0.0009 0.0005 0.0037 717 TRP 94 CD1 0.0002 0.0004 0.0044 718 TRP 94 CD2 0.0021 0.0015 0.0038 719 TRP 94 CE2 0.0020 0.0019 0.0045 720 TRP 94 CE3 0.0032 0.0021 0.0034 721 TRP 94 NE1 0.0008 0.0012 0.0049 722 TRP 94 CZ2 0.0030 0.0029 0.0048 723 TRP 94 CZ3 0.0042 0.0031 0.0036 724 TRP 94 CH2 0.0041 0.0034 0.0044 725 SER 95 N 0.0002 -0.0021 -0.0005 726 SER 95 CA -0.0006 -0.0019 -0.0002 727 SER 95 C -0.0005 -0.0027 -0.0001 728 SER 95 O -0.0006 -0.0024 -0.0001 729 SER 95 CB -0.0016 -0.0020 0.0002 730 SER 95 OG -0.0020 -0.0011 0.0001 731 MET 96 N -0.0002 -0.0037 0.0001 732 MET 96 CA 0.0002 -0.0045 0.0001 733 MET 96 C 0.0006 -0.0054 0.0002 734 MET 96 O 0.0002 -0.0058 0.0004 735 MET 96 CB -0.0006 -0.0048 0.0005 736 MET 96 CG -0.0002 -0.0050 0.0004 737 MET 96 SD -0.0001 -0.0038 0.0000 738 MET 96 CE -0.0013 -0.0033 0.0004 739 LYS 97 N 0.0025 -0.0042 0.0038 740 LYS 97 CA 0.0033 -0.0043 0.0044 741 LYS 97 C 0.0035 -0.0054 0.0052 742 LYS 97 O 0.0033 -0.0059 0.0054 743 LYS 97 CB 0.0044 -0.0034 0.0045 744 LYS 97 CG 0.0051 -0.0032 0.0049 745 LYS 97 CD 0.0045 -0.0033 0.0046 746 LYS 97 CE 0.0053 -0.0028 0.0048 747 LYS 97 NZ 0.0048 -0.0029 0.0045 748 LEU 98 N 0.0037 -0.0059 0.0056 749 LEU 98 CA 0.0039 -0.0069 0.0064 750 LEU 98 C 0.0052 -0.0068 0.0071 751 LEU 98 O 0.0057 -0.0061 0.0070 752 LEU 98 CB 0.0033 -0.0077 0.0065 753 LEU 98 CG 0.0030 -0.0089 0.0071 754 LEU 98 CD1 0.0041 -0.0093 0.0080 755 LEU 98 CD2 0.0025 -0.0094 0.0071 756 VAL 99 N 0.0072 -0.0047 0.0051 757 VAL 99 CA 0.0072 -0.0049 0.0046 758 VAL 99 C 0.0071 -0.0046 0.0047 759 VAL 99 O 0.0068 -0.0040 0.0047 760 VAL 99 CB 0.0071 -0.0049 0.0039 761 VAL 99 CG1 0.0071 -0.0051 0.0034 762 VAL 99 CG2 0.0073 -0.0054 0.0038 763 GLN 100 N 0.0072 -0.0049 0.0049 764 GLN 100 CA 0.0071 -0.0046 0.0050 765 GLN 100 C 0.0071 -0.0047 0.0044 766 GLN 100 O 0.0072 -0.0052 0.0040 767 GLN 100 CB 0.0073 -0.0048 0.0056 768 GLN 100 CG 0.0072 -0.0046 0.0057 769 GLN 100 CD 0.0072 -0.0043 0.0064 770 GLN 100 NE2 0.0071 -0.0040 0.0064 771 GLN 100 OE1 0.0074 -0.0044 0.0069 772 ILE 101 N 0.0061 -0.0022 0.0018 773 ILE 101 CA 0.0049 -0.0020 0.0012 774 ILE 101 C 0.0037 -0.0011 -0.0028 775 ILE 101 O 0.0041 -0.0009 -0.0042 776 ILE 101 CB 0.0078 -0.0024 0.0024 777 ILE 101 CG1 0.0116 -0.0022 0.0006 778 ILE 101 CG2 0.0082 -0.0033 0.0066 779 ILE 101 CD1 0.0126 -0.0016 -0.0026 780 ASP 102 N 0.0023 -0.0007 -0.0046 781 ASP 102 CA 0.0012 0.0001 -0.0085 782 ASP 102 C -0.0014 0.0004 -0.0093 783 ASP 102 O -0.0003 0.0008 -0.0113 784 ASP 102 CB -0.0006 0.0005 -0.0096 785 ASP 102 CG -0.0034 -0.0000 -0.0067 786 ASP 102 OD1 -0.0041 -0.0006 -0.0040 787 ASP 102 OD2 -0.0049 0.0001 -0.0072 788 SER 105 N -0.0063 0.0064 -0.0083 789 SER 105 CA -0.0058 0.0089 -0.0085 790 SER 105 C -0.0029 0.0107 -0.0062 791 SER 105 O -0.0011 0.0091 -0.0040 792 SER 105 CB -0.0065 0.0069 -0.0087 793 SER 105 OG -0.0045 0.0052 -0.0062 794 PRO 106 N -0.0023 0.0140 -0.0066 795 PRO 106 CA 0.0004 0.0159 -0.0045 796 PRO 106 C 0.0019 0.0140 -0.0026 797 PRO 106 O 0.0006 0.0124 -0.0033 798 PRO 106 CB 0.0002 0.0196 -0.0058 799 PRO 106 CG -0.0026 0.0193 -0.0084 800 PRO 106 CD -0.0042 0.0164 -0.0091 801 GLU 107 N 0.0000 0.0211 -0.0051 802 GLU 107 CA -0.0010 0.0179 -0.0015 803 GLU 107 C -0.0012 0.0145 -0.0008 804 GLU 107 O -0.0018 0.0110 0.0014 805 GLU 107 CB -0.0022 0.0205 0.0028 806 GLU 107 CG -0.0027 0.0235 0.0044 807 GLU 107 CD -0.0036 0.0210 0.0075 808 GLU 107 OE1 -0.0044 0.0184 0.0104 809 GLU 107 OE2 -0.0035 0.0216 0.0072 810 LYS 108 N -0.0007 0.0155 -0.0025 811 LYS 108 CA -0.0009 0.0122 -0.0021 812 LYS 108 C -0.0001 0.0078 -0.0046 813 LYS 108 O -0.0005 0.0041 -0.0033 814 LYS 108 CB -0.0004 0.0144 -0.0035 815 LYS 108 CG -0.0013 0.0180 -0.0003 816 LYS 108 CD -0.0026 0.0159 0.0041 817 LYS 108 CE -0.0025 0.0116 0.0036 818 LYS 108 NZ -0.0020 0.0128 0.0018 819 MET 109 N 0.0005 0.0029 -0.0017 820 MET 109 CA 0.0023 0.0022 -0.0022 821 MET 109 C 0.0025 0.0022 -0.0023 822 MET 109 O 0.0035 0.0012 -0.0018 823 MET 109 CB 0.0034 0.0030 -0.0035 824 MET 109 CG 0.0043 0.0022 -0.0033 825 MET 109 SD 0.0053 0.0032 -0.0049 826 MET 109 CE 0.0058 0.0022 -0.0042 827 ARG 110 N 0.0016 0.0034 -0.0030 828 ARG 110 CA 0.0017 0.0035 -0.0031 829 ARG 110 C 0.0008 0.0026 -0.0016 830 ARG 110 O 0.0013 0.0020 -0.0014 831 ARG 110 CB 0.0009 0.0051 -0.0041 832 ARG 110 CG 0.0017 0.0061 -0.0055 833 ARG 110 CD 0.0009 0.0076 -0.0065 834 ARG 110 NE -0.0001 0.0086 -0.0069 835 ARG 110 CZ -0.0018 0.0092 -0.0065 836 ARG 110 NH1 -0.0028 0.0091 -0.0058 837 ARG 110 NH2 -0.0025 0.0101 -0.0069 838 ARG 111 N -0.0019 0.0063 -0.0037 839 ARG 111 CA -0.0037 0.0040 -0.0004 840 ARG 111 C -0.0019 -0.0002 -0.0002 841 ARG 111 O -0.0023 -0.0028 0.0018 842 ARG 111 CB -0.0059 0.0056 0.0013 843 ARG 111 CG -0.0081 0.0039 0.0049 844 ARG 111 CD -0.0100 0.0048 0.0066 845 ARG 111 NE -0.0126 0.0082 0.0077 846 ARG 111 CZ -0.0149 0.0083 0.0104 847 ARG 111 NH1 -0.0151 0.0052 0.0123 848 ARG 111 NH2 -0.0171 0.0116 0.0111 849 LEU 112 N 0.0002 -0.0008 -0.0022 850 LEU 112 CA 0.0022 -0.0047 -0.0023 851 LEU 112 C 0.0040 -0.0065 -0.0035 852 LEU 112 O 0.0047 -0.0099 -0.0023 853 LEU 112 CB 0.0040 -0.0048 -0.0045 854 LEU 112 CG 0.0024 -0.0034 -0.0034 855 LEU 112 CD1 0.0043 -0.0024 -0.0061 856 LEU 112 CD2 0.0014 -0.0064 -0.0005 857 TYR 113 N 0.0054 -0.0046 -0.0034 858 TYR 113 CA 0.0048 -0.0040 -0.0030 859 TYR 113 C 0.0042 -0.0037 -0.0034 860 TYR 113 O 0.0036 -0.0034 -0.0036 861 TYR 113 CB 0.0051 -0.0037 -0.0021 862 TYR 113 CG 0.0054 -0.0037 -0.0016 863 TYR 113 CD1 0.0051 -0.0035 -0.0017 864 TYR 113 CD2 0.0060 -0.0038 -0.0010 865 TYR 113 CE1 0.0054 -0.0034 -0.0012 866 TYR 113 CE2 0.0063 -0.0038 -0.0005 867 TYR 113 CZ 0.0060 -0.0036 -0.0006 868 TYR 113 OH 0.0062 -0.0035 -0.0001 869 LEU 114 N 0.0043 -0.0039 -0.0036 870 LEU 114 CA 0.0037 -0.0037 -0.0040 871 LEU 114 C 0.0033 -0.0038 -0.0048 872 LEU 114 O 0.0026 -0.0035 -0.0050 873 LEU 114 CB 0.0039 -0.0039 -0.0040 874 LEU 114 CG 0.0034 -0.0035 -0.0040 875 LEU 114 CD1 0.0034 -0.0031 -0.0032 876 LEU 114 CD2 0.0037 -0.0039 -0.0044 877 LYS 115 N 0.0004 -0.0019 -0.0076 878 LYS 115 CA 0.0003 -0.0020 -0.0079 879 LYS 115 C 0.0003 -0.0017 -0.0078 880 LYS 115 O 0.0001 -0.0016 -0.0081 881 LYS 115 CB 0.0004 -0.0025 -0.0079 882 LYS 115 CG 0.0004 -0.0026 -0.0081 883 LYS 115 CD 0.0003 -0.0030 -0.0084 884 LYS 115 CE 0.0005 -0.0034 -0.0082 885 LYS 115 NZ 0.0007 -0.0034 -0.0078 886 TYR 116 N 0.0005 -0.0016 -0.0074 887 TYR 116 CA 0.0005 -0.0013 -0.0073 888 TYR 116 C 0.0005 -0.0008 -0.0072 889 TYR 116 O 0.0005 -0.0006 -0.0070 890 TYR 116 CB 0.0007 -0.0015 -0.0070 891 TYR 116 CG 0.0008 -0.0020 -0.0072 892 TYR 116 CD1 0.0006 -0.0020 -0.0074 893 TYR 116 CD2 0.0009 -0.0023 -0.0070 894 TYR 116 CE1 0.0006 -0.0024 -0.0075 895 TYR 116 CE2 0.0010 -0.0027 -0.0071 896 TYR 116 CZ 0.0008 -0.0028 -0.0074 897 TYR 116 OH 0.0008 -0.0032 -0.0075 898 SER 117 N 0.0023 -0.0013 -0.0072 899 SER 117 CA 0.0022 -0.0005 -0.0069 900 SER 117 C 0.0028 -0.0011 -0.0086 901 SER 117 O 0.0032 -0.0026 -0.0096 902 SER 117 CB 0.0014 -0.0011 -0.0051 903 SER 117 OG 0.0013 -0.0033 -0.0048 904 GLY 118 N 0.0030 0.0000 -0.0089 905 GLY 118 CA 0.0035 -0.0004 -0.0104 906 GLY 118 C 0.0033 -0.0015 -0.0098 907 GLY 118 O 0.0037 -0.0020 -0.0110 908 GLU 119 N 0.0032 0.0003 -0.0083 909 GLU 119 CA 0.0027 -0.0019 -0.0055 910 GLU 119 C 0.0041 -0.0047 -0.0045 911 GLU 119 O 0.0043 -0.0046 -0.0049 912 GLU 119 CB -0.0002 -0.0006 -0.0030 913 GLU 119 CG -0.0015 0.0008 -0.0026 914 GLU 119 CD -0.0026 0.0041 -0.0044 915 GLU 119 OE1 -0.0024 0.0054 -0.0060 916 GLU 119 OE2 -0.0037 0.0055 -0.0043 917 VAL 120 N 0.0051 -0.0074 -0.0033 918 VAL 120 CA 0.0065 -0.0102 -0.0024 919 VAL 120 C 0.0048 -0.0106 0.0002 920 VAL 120 O 0.0055 -0.0117 0.0004 921 VAL 120 CB 0.0080 -0.0129 -0.0017 922 VAL 120 CG1 0.0105 -0.0133 -0.0046 923 VAL 120 CG2 0.0063 -0.0123 -0.0001 924 ALA 121 N 0.0073 -0.0056 0.0075 925 ALA 121 CA 0.0070 -0.0057 0.0090 926 ALA 121 C 0.0058 -0.0047 0.0070 927 ALA 121 O 0.0049 -0.0038 0.0046 928 ALA 121 CB 0.0052 -0.0055 0.0118 929 PHE 122 N 0.0058 -0.0049 0.0079 930 PHE 122 CA 0.0047 -0.0041 0.0062 931 PHE 122 C 0.0016 -0.0028 0.0067 932 PHE 122 O 0.0005 -0.0027 0.0089 933 PHE 122 CB 0.0059 -0.0048 0.0070 934 PHE 122 CG 0.0052 -0.0041 0.0051 935 PHE 122 CD1 0.0050 -0.0034 0.0022 936 PHE 122 CD2 0.0047 -0.0041 0.0064 937 PHE 122 CE1 0.0044 -0.0027 0.0005 938 PHE 122 CE2 0.0040 -0.0034 0.0046 939 PHE 122 CZ 0.0039 -0.0027 0.0017 940 MET 123 N 0.0015 -0.0005 0.0062 941 MET 123 CA -0.0013 0.0014 0.0064 942 MET 123 C -0.0022 0.0022 0.0035 943 MET 123 O -0.0028 0.0028 0.0012 944 MET 123 CB -0.0027 0.0023 0.0068 945 MET 123 CG -0.0016 0.0014 0.0093 946 MET 123 SD -0.0040 0.0029 0.0107 947 MET 123 CE -0.0024 0.0015 0.0141 948 PRO 124 N -0.0021 0.0022 0.0035 949 PRO 124 CA -0.0028 0.0028 0.0007 950 PRO 124 C -0.0057 0.0049 0.0002 951 PRO 124 O -0.0064 0.0056 -0.0023 952 PRO 124 CB -0.0016 0.0020 0.0012 953 PRO 124 CG -0.0009 0.0012 0.0045 954 PRO 124 CD -0.0016 0.0016 0.0061 955 GLU 125 N -0.0054 0.0054 0.0038 956 GLU 125 CA -0.0074 0.0074 0.0035 957 GLU 125 C -0.0084 0.0081 0.0013 958 GLU 125 O -0.0101 0.0097 0.0005 959 GLU 125 CB -0.0083 0.0086 0.0061 960 GLU 125 CG -0.0085 0.0089 0.0067 961 GLU 125 CD -0.0068 0.0074 0.0083 962 GLU 125 OE1 -0.0057 0.0064 0.0094 963 GLU 125 OE2 -0.0066 0.0072 0.0083 964 THR 126 N -0.0075 0.0071 0.0002 965 THR 126 CA -0.0083 0.0077 -0.0019 966 THR 126 C -0.0077 0.0068 -0.0046 967 THR 126 O -0.0083 0.0071 -0.0065 968 THR 126 CB -0.0078 0.0072 -0.0013 969 THR 126 CG2 -0.0086 0.0083 0.0012 970 THR 126 OG1 -0.0058 0.0053 -0.0011 971 MET 127 N -0.0071 0.0080 -0.0024 972 MET 127 CA -0.0061 0.0079 -0.0046 973 MET 127 C -0.0072 0.0100 -0.0048 974 MET 127 O -0.0085 0.0108 -0.0028 975 MET 127 CB -0.0048 0.0053 -0.0043 976 MET 127 CG -0.0054 0.0047 -0.0020 977 MET 127 SD -0.0040 0.0013 -0.0008 978 MET 127 CE -0.0025 0.0005 -0.0032 979 THR 128 N -0.0066 0.0108 -0.0072 980 THR 128 CA -0.0075 0.0129 -0.0078 981 THR 128 C -0.0076 0.0122 -0.0067 982 THR 128 O -0.0065 0.0099 -0.0062 983 THR 128 CB -0.0068 0.0139 -0.0109 984 THR 128 CG2 -0.0063 0.0139 -0.0121 985 THR 128 OG1 -0.0054 0.0122 -0.0120 986 PRO 129 N -0.0078 0.0119 -0.0052 987 PRO 129 CA -0.0084 0.0116 -0.0042 988 PRO 129 C -0.0078 0.0109 -0.0050 989 PRO 129 O -0.0081 0.0098 -0.0042 990 PRO 129 CB -0.0090 0.0136 -0.0037 991 PRO 129 CG -0.0086 0.0148 -0.0046 992 PRO 129 CD -0.0081 0.0137 -0.0051 993 ALA 130 N -0.0070 0.0114 -0.0065 994 ALA 130 CA -0.0064 0.0107 -0.0073 995 ALA 130 C -0.0060 0.0086 -0.0074 996 ALA 130 O -0.0059 0.0076 -0.0072 997 ALA 130 CB -0.0055 0.0117 -0.0089 998 GLN 131 N -0.0046 0.0073 -0.0080 999 GLN 131 CA -0.0044 0.0056 -0.0081 1000 GLN 131 C -0.0044 0.0046 -0.0060 1001 GLN 131 O -0.0042 0.0027 -0.0058 1002 GLN 131 CB -0.0044 0.0062 -0.0089 1003 GLN 131 CG -0.0042 0.0064 -0.0112 1004 GLN 131 CD -0.0043 0.0077 -0.0119 1005 GLN 131 NE2 -0.0044 0.0091 -0.0133 1006 GLN 131 OE1 -0.0044 0.0074 -0.0111 1007 CYS 132 N -0.0047 0.0058 -0.0044 1008 CYS 132 CA -0.0048 0.0050 -0.0023 1009 CYS 132 C -0.0046 0.0037 -0.0018 1010 CYS 132 O -0.0045 0.0021 -0.0010 1011 CYS 132 CB -0.0051 0.0067 -0.0008 1012 CYS 132 SG -0.0053 0.0079 -0.0006 1013 LEU 133 N -0.0084 0.0041 -0.0004 1014 LEU 133 CA -0.0076 0.0033 -0.0010 1015 LEU 133 C -0.0059 0.0016 -0.0021 1016 LEU 133 O -0.0049 0.0002 -0.0016 1017 LEU 133 CB -0.0084 0.0047 -0.0027 1018 LEU 133 CG -0.0076 0.0040 -0.0037 1019 LEU 133 CD1 -0.0074 0.0032 -0.0017 1020 LEU 133 CD2 -0.0084 0.0055 -0.0053 1021 GLN 134 N -0.0055 0.0016 -0.0037 1022 GLN 134 CA -0.0039 -0.0000 -0.0048 1023 GLN 134 C -0.0030 -0.0016 -0.0031 1024 GLN 134 O -0.0017 -0.0032 -0.0031 1025 GLN 134 CB -0.0039 0.0004 -0.0067 1026 GLN 134 CG -0.0042 0.0015 -0.0090 1027 GLN 134 CD -0.0030 0.0004 -0.0101 1028 GLN 134 NE2 -0.0035 0.0013 -0.0114 1029 GLN 134 OE1 -0.0016 -0.0013 -0.0099 1030 PHE 135 N 0.0015 -0.0011 -0.0011 1031 PHE 135 CA 0.0014 -0.0020 -0.0008 1032 PHE 135 C 0.0011 -0.0023 0.0001 1033 PHE 135 O 0.0010 -0.0031 0.0003 1034 PHE 135 CB 0.0015 -0.0017 -0.0009 1035 PHE 135 CG 0.0013 -0.0024 -0.0004 1036 PHE 135 CD1 0.0013 -0.0034 -0.0004 1037 PHE 135 CD2 0.0011 -0.0021 0.0002 1038 PHE 135 CE1 0.0011 -0.0040 0.0000 1039 PHE 135 CE2 0.0009 -0.0027 0.0006 1040 PHE 135 CZ 0.0009 -0.0036 0.0006 1041 MET 136 N 0.0009 -0.0016 0.0007 1042 MET 136 CA 0.0006 -0.0018 0.0016 1043 MET 136 C 0.0006 -0.0024 0.0016 1044 MET 136 O 0.0004 -0.0030 0.0021 1045 MET 136 CB 0.0004 -0.0009 0.0021 1046 MET 136 CG 0.0002 -0.0006 0.0026 1047 MET 136 SD 0.0001 -0.0015 0.0030 1048 MET 136 CE -0.0002 -0.0023 0.0036 1049 ILE 137 N -0.0022 -0.0016 0.0043 1050 ILE 137 CA -0.0014 -0.0028 0.0034 1051 ILE 137 C -0.0004 -0.0042 0.0032 1052 ILE 137 O 0.0004 -0.0055 0.0037 1053 ILE 137 CB -0.0017 -0.0022 0.0016 1054 ILE 137 CG1 -0.0025 -0.0010 0.0018 1055 ILE 137 CG2 -0.0008 -0.0034 0.0005 1056 ILE 137 CD1 -0.0029 -0.0002 0.0001 1057 ASP 138 N -0.0004 -0.0041 0.0026 1058 ASP 138 CA 0.0005 -0.0055 0.0021 1059 ASP 138 C 0.0011 -0.0066 0.0036 1060 ASP 138 O 0.0020 -0.0079 0.0033 1061 ASP 138 CB 0.0003 -0.0050 0.0011 1062 ASP 138 CG -0.0001 -0.0043 -0.0007 1063 ASP 138 OD1 -0.0003 -0.0040 -0.0012 1064 ASP 138 OD2 -0.0002 -0.0041 -0.0017 1065 ILE 139 N 0.0033 -0.0034 0.0048 1066 ILE 139 CA 0.0021 -0.0036 0.0038 1067 ILE 139 C 0.0011 -0.0031 0.0039 1068 ILE 139 O 0.0001 -0.0033 0.0030 1069 ILE 139 CB 0.0026 -0.0046 0.0025 1070 ILE 139 CG1 0.0030 -0.0049 0.0022 1071 ILE 139 CG2 0.0038 -0.0050 0.0025 1072 ILE 139 CD1 0.0031 -0.0058 0.0009 1073 ASP 140 N 0.0012 -0.0025 0.0049 1074 ASP 140 CA 0.0002 -0.0020 0.0051 1075 ASP 140 C -0.0012 -0.0015 0.0050 1076 ASP 140 O -0.0014 -0.0010 0.0056 1077 ASP 140 CB 0.0006 -0.0014 0.0064 1078 ASP 140 CG -0.0000 -0.0010 0.0065 1079 ASP 140 OD1 -0.0007 -0.0014 0.0055 1080 ASP 140 OD2 0.0001 -0.0004 0.0075 1081 PRO 141 N -0.0002 0.0005 0.0067 1082 PRO 141 CA -0.0012 0.0039 0.0062 1083 PRO 141 C -0.0017 0.0060 0.0072 1084 PRO 141 O -0.0024 0.0088 0.0082 1085 PRO 141 CB -0.0018 0.0040 0.0025 1086 PRO 141 CG -0.0010 0.0008 0.0016 1087 PRO 141 CD -0.0000 -0.0015 0.0038 1088 ALA 142 N -0.0013 0.0046 0.0071 1089 ALA 142 CA -0.0017 0.0064 0.0081 1090 ALA 142 C -0.0013 0.0067 0.0118 1091 ALA 142 O -0.0015 0.0079 0.0130 1092 ALA 142 CB -0.0015 0.0049 0.0065 1093 ARG 143 N -0.0049 0.0088 0.0100 1094 ARG 143 CA -0.0066 0.0082 0.0127 1095 ARG 143 C -0.0078 0.0110 0.0143 1096 ARG 143 O -0.0092 0.0109 0.0165 1097 ARG 143 CB -0.0073 0.0056 0.0138 1098 ARG 143 CG -0.0069 0.0025 0.0135 1099 ARG 143 CD -0.0082 0.0002 0.0154 1100 ARG 143 NE -0.0077 -0.0029 0.0149 1101 ARG 143 CZ -0.0063 -0.0044 0.0129 1102 ARG 143 NH1 -0.0052 -0.0032 0.0112 1103 ARG 143 NH2 -0.0060 -0.0073 0.0126 1104 SER 144 N -0.0072 0.0135 0.0132 1105 SER 144 CA -0.0082 0.0164 0.0146 1106 SER 144 C -0.0098 0.0158 0.0171 1107 SER 144 O -0.0111 0.0170 0.0191 1108 SER 144 CB -0.0085 0.0180 0.0150 1109 SER 144 OG -0.0090 0.0160 0.0159 1110 GLY 5 N 0.0175 -0.0155 0.0072 1111 GLY 5 CA 0.0177 -0.0124 0.0053 1112 GLY 5 C 0.0128 -0.0101 0.0044 1113 GLY 5 O 0.0090 -0.0121 0.0058 1114 LEU 6 N 0.0128 -0.0060 0.0019 1115 LEU 6 CA 0.0084 -0.0034 0.0007 1116 LEU 6 C 0.0076 -0.0004 -0.0010 1117 LEU 6 O 0.0111 0.0013 -0.0022 1118 LEU 6 CB 0.0088 -0.0009 -0.0007 1119 LEU 6 CG 0.0039 0.0003 -0.0011 1120 LEU 6 CD1 0.0009 -0.0035 0.0014 1121 LEU 6 CD2 0.0048 0.0025 -0.0025 1122 TYR 7 N 0.0034 -0.0009 0.0001 1123 TYR 7 CA 0.0029 0.0004 -0.0007 1124 TYR 7 C 0.0011 0.0008 -0.0014 1125 TYR 7 O 0.0000 -0.0001 -0.0011 1126 TYR 7 CB 0.0029 -0.0001 -0.0005 1127 TYR 7 CG 0.0047 -0.0001 -0.0001 1128 TYR 7 CD1 0.0055 0.0013 -0.0008 1129 TYR 7 CD2 0.0057 -0.0014 0.0009 1130 TYR 7 CE1 0.0071 0.0014 -0.0004 1131 TYR 7 CE2 0.0073 -0.0013 0.0012 1132 TYR 7 CZ 0.0081 0.0001 0.0005 1133 TYR 7 OH 0.0097 0.0001 0.0009 1134 ARG 8 N 0.0008 0.0023 -0.0023 1135 ARG 8 CA -0.0009 0.0029 -0.0031 1136 ARG 8 C -0.0016 0.0037 -0.0037 1137 ARG 8 O -0.0005 0.0048 -0.0041 1138 ARG 8 CB -0.0008 0.0041 -0.0037 1139 ARG 8 CG -0.0025 0.0048 -0.0045 1140 ARG 8 CD -0.0022 0.0062 -0.0052 1141 ARG 8 NE -0.0016 0.0056 -0.0048 1142 ARG 8 CZ -0.0004 0.0064 -0.0049 1143 ARG 8 NH1 0.0005 0.0078 -0.0056 1144 ARG 8 NH2 0.0001 0.0058 -0.0045 1145 MET 9 N -0.0038 0.0051 -0.0019 1146 MET 9 CA -0.0039 0.0049 -0.0016 1147 MET 9 C -0.0036 0.0050 -0.0012 1148 MET 9 O -0.0034 0.0053 -0.0012 1149 MET 9 CB -0.0039 0.0048 -0.0016 1150 MET 9 CG -0.0039 0.0046 -0.0013 1151 MET 9 SD -0.0040 0.0045 -0.0014 1152 MET 9 CE -0.0041 0.0041 -0.0010 1153 THR 10 N -0.0037 0.0048 -0.0009 1154 THR 10 CA -0.0035 0.0049 -0.0006 1155 THR 10 C -0.0035 0.0046 -0.0002 1156 THR 10 O -0.0037 0.0043 -0.0002 1157 THR 10 CB -0.0034 0.0048 -0.0005 1158 THR 10 CG2 -0.0037 0.0045 -0.0006 1159 THR 10 OG1 -0.0033 0.0049 -0.0001 1160 TYR 11 N -0.0040 0.0060 0.0034 1161 TYR 11 CA -0.0038 0.0054 0.0043 1162 TYR 11 C -0.0027 0.0058 0.0055 1163 TYR 11 O -0.0020 0.0067 0.0054 1164 TYR 11 CB -0.0041 0.0056 0.0038 1165 TYR 11 CG -0.0031 0.0067 0.0038 1166 TYR 11 CD1 -0.0025 0.0067 0.0048 1167 TYR 11 CD2 -0.0028 0.0078 0.0028 1168 TYR 11 CE1 -0.0016 0.0077 0.0048 1169 TYR 11 CE2 -0.0020 0.0088 0.0028 1170 TYR 11 CZ -0.0014 0.0087 0.0038 1171 TYR 11 OH -0.0005 0.0097 0.0038 1172 ILE 12 N -0.0026 0.0052 0.0065 1173 ILE 12 CA -0.0015 0.0054 0.0077 1174 ILE 12 C -0.0012 0.0054 0.0081 1175 ILE 12 O -0.0019 0.0050 0.0077 1176 ILE 12 CB -0.0015 0.0046 0.0088 1177 ILE 12 CG1 -0.0023 0.0033 0.0092 1178 ILE 12 CG2 -0.0018 0.0046 0.0083 1179 ILE 12 CD1 -0.0024 0.0024 0.0102 1180 SER 13 N -0.0115 0.0118 0.0118 1181 SER 13 CA -0.0099 0.0125 0.0121 1182 SER 13 C -0.0056 0.0120 0.0160 1183 SER 13 O -0.0033 0.0121 0.0178 1184 SER 13 CB -0.0088 0.0162 0.0080 1185 SER 13 OG -0.0056 0.0174 0.0089 1186 ARG 14 N -0.0045 0.0117 0.0174 1187 ARG 14 CA -0.0005 0.0112 0.0211 1188 ARG 14 C 0.0032 0.0143 0.0197 1189 ARG 14 O 0.0020 0.0157 0.0170 1190 ARG 14 CB -0.0021 0.0078 0.0244 1191 ARG 14 CG -0.0050 0.0044 0.0267 1192 ARG 14 CD -0.0062 0.0012 0.0302 1193 ARG 14 NE -0.0087 -0.0021 0.0325 1194 ARG 14 CZ -0.0067 -0.0034 0.0359 1195 ARG 14 NH1 -0.0021 -0.0018 0.0373 1196 ARG 14 NH2 -0.0093 -0.0063 0.0378 1197 ALA 15 N 0.0043 0.0240 0.0127 1198 ALA 15 CA 0.0020 0.0210 0.0128 1199 ALA 15 C 0.0037 0.0225 0.0064 1200 ALA 15 O 0.0061 0.0249 0.0011 1201 ALA 15 CB -0.0032 0.0146 0.0125 1202 VAL 16 N 0.0026 0.0211 0.0071 1203 VAL 16 CA 0.0035 0.0216 0.0011 1204 VAL 16 C -0.0003 0.0163 -0.0040 1205 VAL 16 O -0.0042 0.0118 -0.0016 1206 VAL 16 CB 0.0038 0.0223 0.0041 1207 VAL 16 CG1 0.0082 0.0282 0.0076 1208 VAL 16 CG2 -0.0004 0.0177 0.0094 1209 PRO 17 N 0.0616 0.0007 -0.0847 1210 PRO 17 CA -0.0033 0.0141 -0.1241 1211 PRO 17 C -0.0757 0.0256 -0.0747 1212 PRO 17 O -0.1379 0.0382 -0.1072 1213 PRO 17 CB 0.0277 0.0091 -0.1447 1214 PRO 17 CG 0.1011 -0.0059 -0.1030 1215 PRO 17 CD 0.1286 -0.0120 -0.0756 1216 GLY 18 N -0.0704 0.0219 0.0023 1217 GLY 18 CA -0.1359 0.0322 0.0528 1218 GLY 18 C -0.1816 0.0397 0.0765 1219 GLY 18 O -0.2228 0.0452 0.1353 1220 LEU 19 N -0.0251 0.0114 -0.0013 1221 LEU 19 CA -0.0083 0.0038 -0.0028 1222 LEU 19 C 0.0013 0.0021 -0.0018 1223 LEU 19 O 0.0008 0.0118 0.0050 1224 LEU 19 CB 0.0015 0.0111 0.0047 1225 LEU 19 CG -0.0016 0.0055 0.0000 1226 LEU 19 CD1 0.0122 0.0079 0.0049 1227 LEU 19 CD2 -0.0039 -0.0099 -0.0116 1228 GLY 20 N 0.0102 -0.0104 -0.0087 1229 GLY 20 CA 0.0201 -0.0135 -0.0085 1230 GLY 20 C 0.0380 -0.0202 -0.0091 1231 GLY 20 O 0.0438 -0.0211 -0.0084 1232 TYR 21 N 0.0564 -0.0443 0.0016 1233 TYR 21 CA 0.0326 -0.0264 -0.0128 1234 TYR 21 C 0.0286 -0.0036 -0.0089 1235 TYR 21 O 0.0089 0.0033 -0.0233 1236 TYR 21 CB 0.0280 -0.0112 -0.0118 1237 TYR 21 CG 0.0250 -0.0317 -0.0208 1238 TYR 21 CD1 0.0444 -0.0458 -0.0089 1239 TYR 21 CD2 0.0029 -0.0368 -0.0411 1240 TYR 21 CE1 0.0418 -0.0645 -0.0171 1241 TYR 21 CE2 0.0001 -0.0555 -0.0494 1242 TYR 21 CZ 0.0196 -0.0693 -0.0374 1243 TYR 21 OH 0.0169 -0.0879 -0.0456 1244 ASN 22 N 0.0468 0.0086 0.0103 1245 ASN 22 CA 0.0441 0.0308 0.0151 1246 ASN 22 C 0.0383 0.0179 0.0061 1247 ASN 22 O 0.0230 0.0319 -0.0023 1248 ASN 22 CB 0.0665 0.0436 0.0381 1249 ASN 22 CG 0.0706 0.0613 0.0471 1250 ASN 22 ND2 0.0927 0.0639 0.0666 1251 ASN 22 OD1 0.0540 0.0727 0.0368 1252 ASP 23 N 0.0174 -0.0016 -0.0035 1253 ASP 23 CA 0.0132 -0.0059 -0.0066 1254 ASP 23 C 0.0121 -0.0059 -0.0106 1255 ASP 23 O 0.0098 -0.0071 -0.0157 1256 ASP 23 CB 0.0106 -0.0106 -0.0019 1257 ASP 23 CG 0.0106 -0.0116 0.0008 1258 ASP 23 OD1 0.0084 -0.0133 -0.0023 1259 ASP 23 OD2 0.0127 -0.0107 0.0061 1260 LEU 24 N 0.0138 -0.0045 -0.0083 1261 LEU 24 CA 0.0130 -0.0044 -0.0118 1262 LEU 24 C 0.0145 -0.0006 -0.0176 1263 LEU 24 O 0.0125 -0.0015 -0.0225 1264 LEU 24 CB 0.0149 -0.0033 -0.0079 1265 LEU 24 CG 0.0127 -0.0077 -0.0032 1266 LEU 24 CD1 0.0147 -0.0064 0.0004 1267 LEU 24 CD2 0.0083 -0.0122 -0.0063 1268 ARG 25 N -0.0006 0.0146 -0.0160 1269 ARG 25 CA -0.0051 0.0203 -0.0157 1270 ARG 25 C -0.0016 0.0168 -0.0109 1271 ARG 25 O -0.0032 0.0181 -0.0144 1272 ARG 25 CB -0.0107 0.0283 -0.0098 1273 ARG 25 CG -0.0166 0.0343 -0.0166 1274 ARG 25 CD -0.0215 0.0415 -0.0103 1275 ARG 25 NE -0.0252 0.0451 -0.0160 1276 ARG 25 CZ -0.0252 0.0457 -0.0129 1277 ARG 25 NH1 -0.0218 0.0431 -0.0041 1278 ARG 25 NH2 -0.0289 0.0491 -0.0187 1279 ASP 26 N 0.0032 0.0124 -0.0030 1280 ASP 26 CA 0.0071 0.0084 0.0013 1281 ASP 26 C 0.0109 0.0021 -0.0066 1282 ASP 26 O 0.0112 0.0015 -0.0075 1283 ASP 26 CB 0.0117 0.0044 0.0109 1284 ASP 26 CG 0.0151 0.0013 0.0167 1285 ASP 26 OD1 0.0117 0.0060 0.0190 1286 ASP 26 OD2 0.0212 -0.0058 0.0190 1287 ILE 27 N 0.0111 0.0027 -0.0072 1288 ILE 27 CA 0.0110 0.0015 -0.0086 1289 ILE 27 C 0.0078 0.0021 -0.0096 1290 ILE 27 O 0.0072 0.0025 -0.0094 1291 ILE 27 CB 0.0124 -0.0010 -0.0107 1292 ILE 27 CG1 0.0158 -0.0016 -0.0098 1293 ILE 27 CG2 0.0118 -0.0023 -0.0124 1294 ILE 27 CD1 0.0171 -0.0039 -0.0117 1295 MET 28 N 0.0058 0.0021 -0.0105 1296 MET 28 CA 0.0027 0.0027 -0.0114 1297 MET 28 C 0.0016 0.0050 -0.0094 1298 MET 28 O 0.0003 0.0052 -0.0098 1299 MET 28 CB 0.0008 0.0027 -0.0122 1300 MET 28 CG -0.0019 0.0021 -0.0143 1301 MET 28 SD -0.0013 -0.0008 -0.0172 1302 MET 28 CE -0.0031 -0.0008 -0.0181 1303 GLY 29 N -0.0009 0.0023 0.0082 1304 GLY 29 CA -0.0025 0.0046 0.0124 1305 GLY 29 C 0.0015 0.0030 0.0142 1306 GLY 29 O 0.0002 0.0037 0.0143 1307 LYS 30 N 0.0065 0.0007 0.0155 1308 LYS 30 CA 0.0106 -0.0009 0.0175 1309 LYS 30 C 0.0112 -0.0027 0.0128 1310 LYS 30 O 0.0116 -0.0026 0.0139 1311 LYS 30 CB 0.0158 -0.0030 0.0195 1312 LYS 30 CG 0.0160 -0.0012 0.0251 1313 LYS 30 CD 0.0212 -0.0035 0.0268 1314 LYS 30 CE 0.0214 -0.0017 0.0325 1315 LYS 30 NZ 0.0264 -0.0039 0.0341 1316 SER 31 N 0.0008 0.0014 0.0074 1317 SER 31 CA 0.0017 0.0014 0.0067 1318 SER 31 C 0.0005 0.0013 0.0073 1319 SER 31 O 0.0013 0.0014 0.0079 1320 SER 31 CB 0.0018 0.0015 0.0046 1321 SER 31 OG 0.0001 0.0014 0.0037 1322 GLU 32 N -0.0013 0.0012 0.0071 1323 GLU 32 CA -0.0025 0.0011 0.0077 1324 GLU 32 C -0.0023 0.0011 0.0097 1325 GLU 32 O -0.0020 0.0011 0.0102 1326 GLU 32 CB -0.0046 0.0010 0.0072 1327 GLU 32 CG -0.0053 0.0010 0.0055 1328 GLU 32 CD -0.0070 0.0009 0.0047 1329 GLU 32 OE1 -0.0080 0.0008 0.0057 1330 GLU 32 OE2 -0.0074 0.0009 0.0030 1331 VAL 33 N -0.0035 -0.0031 0.0141 1332 VAL 33 CA -0.0035 -0.0026 0.0146 1333 VAL 33 C -0.0027 -0.0053 0.0134 1334 VAL 33 O -0.0032 -0.0051 0.0117 1335 VAL 33 CB -0.0031 -0.0017 0.0179 1336 VAL 33 CG1 -0.0027 -0.0022 0.0186 1337 VAL 33 CG2 -0.0042 0.0014 0.0187 1338 ASN 34 N -0.0014 -0.0077 0.0143 1339 ASN 34 CA -0.0005 -0.0103 0.0135 1340 ASN 34 C -0.0011 -0.0111 0.0101 1341 ASN 34 O -0.0011 -0.0119 0.0088 1342 ASN 34 CB 0.0009 -0.0128 0.0150 1343 ASN 34 CG 0.0016 -0.0126 0.0183 1344 ASN 34 ND2 0.0014 -0.0109 0.0201 1345 ASN 34 OD1 0.0024 -0.0139 0.0193 1346 ASN 35 N -0.0033 -0.0067 0.0094 1347 ASN 35 CA -0.0018 -0.0065 0.0068 1348 ASN 35 C -0.0020 -0.0057 0.0059 1349 ASN 35 O -0.0004 -0.0063 0.0043 1350 ASN 35 CB -0.0021 -0.0049 0.0050 1351 ASN 35 CG -0.0014 -0.0060 0.0054 1352 ASN 35 ND2 -0.0001 -0.0060 0.0034 1353 ASN 35 OD1 -0.0020 -0.0069 0.0076 1354 SER 36 N -0.0039 -0.0043 0.0069 1355 SER 36 CA -0.0041 -0.0038 0.0064 1356 SER 36 C -0.0029 -0.0059 0.0075 1357 SER 36 O -0.0018 -0.0061 0.0063 1358 SER 36 CB -0.0064 -0.0020 0.0075 1359 SER 36 OG -0.0067 -0.0008 0.0062 1360 HIS 37 N -0.0041 -0.0064 0.0140 1361 HIS 37 CA -0.0020 -0.0124 0.0147 1362 HIS 37 C 0.0022 -0.0173 0.0103 1363 HIS 37 O 0.0049 -0.0203 0.0075 1364 HIS 37 CB -0.0041 -0.0158 0.0219 1365 HIS 37 CG -0.0023 -0.0217 0.0232 1366 HIS 37 CD2 0.0009 -0.0281 0.0221 1367 HIS 37 ND1 -0.0038 -0.0213 0.0259 1368 HIS 37 CE1 -0.0017 -0.0272 0.0265 1369 HIS 37 NE2 0.0012 -0.0315 0.0242 1370 VAL 38 N 0.0029 -0.0182 0.0096 1371 VAL 38 CA 0.0068 -0.0234 0.0062 1372 VAL 38 C 0.0094 -0.0209 -0.0011 1373 VAL 38 O 0.0129 -0.0248 -0.0050 1374 VAL 38 CB 0.0064 -0.0261 0.0093 1375 VAL 38 CG1 0.0099 -0.0286 0.0043 1376 VAL 38 CG2 0.0059 -0.0317 0.0150 1377 GLY 39 N 0.0022 -0.0149 -0.0008 1378 GLY 39 CA 0.0049 -0.0129 -0.0026 1379 GLY 39 C 0.0045 -0.0106 -0.0023 1380 GLY 39 O 0.0065 -0.0106 -0.0036 1381 LEU 40 N 0.0021 -0.0087 -0.0005 1382 LEU 40 CA 0.0015 -0.0064 -0.0001 1383 LEU 40 C 0.0013 -0.0025 0.0002 1384 LEU 40 O 0.0005 -0.0018 0.0007 1385 LEU 40 CB -0.0013 -0.0075 0.0019 1386 LEU 40 CG -0.0014 -0.0104 0.0018 1387 LEU 40 CD1 -0.0045 -0.0111 0.0040 1388 LEU 40 CD2 0.0005 -0.0091 0.0006 1389 THR 41 N -0.0021 0.0003 -0.0008 1390 THR 41 CA -0.0023 0.0020 -0.0007 1391 THR 41 C -0.0027 0.0021 -0.0000 1392 THR 41 O -0.0028 0.0009 0.0002 1393 THR 41 CB -0.0015 0.0028 -0.0020 1394 THR 41 CG2 -0.0011 0.0028 -0.0027 1395 THR 41 OG1 -0.0010 0.0021 -0.0029 1396 GLY 42 N -0.0030 0.0035 0.0002 1397 GLY 42 CA -0.0033 0.0037 0.0008 1398 GLY 42 C -0.0040 0.0051 0.0017 1399 GLY 42 O -0.0040 0.0060 0.0016 1400 LEU 43 N -0.0043 0.0054 0.0031 1401 LEU 43 CA -0.0031 0.0055 0.0043 1402 LEU 43 C -0.0028 0.0046 0.0054 1403 LEU 43 O -0.0036 0.0036 0.0055 1404 LEU 43 CB -0.0031 0.0051 0.0046 1405 LEU 43 CG -0.0018 0.0053 0.0057 1406 LEU 43 CD1 -0.0008 0.0068 0.0053 1407 LEU 43 CD2 -0.0021 0.0047 0.0060 1408 LEU 44 N -0.0015 0.0050 0.0064 1409 LEU 44 CA -0.0010 0.0043 0.0076 1410 LEU 44 C 0.0000 0.0040 0.0089 1411 LEU 44 O 0.0009 0.0050 0.0088 1412 LEU 44 CB -0.0003 0.0051 0.0075 1413 LEU 44 CG 0.0004 0.0046 0.0087 1414 LEU 44 CD1 -0.0005 0.0033 0.0090 1415 LEU 44 CD2 0.0013 0.0057 0.0085 1416 CYS 45 N -0.0024 0.0071 0.0150 1417 CYS 45 CA -0.0008 0.0059 0.0168 1418 CYS 45 C 0.0003 0.0054 0.0177 1419 CYS 45 O -0.0009 0.0046 0.0179 1420 CYS 45 CB -0.0021 0.0041 0.0179 1421 CYS 45 SG -0.0004 0.0023 0.0202 1422 PHE 46 N 0.0027 0.0058 0.0184 1423 PHE 46 CA 0.0040 0.0054 0.0193 1424 PHE 46 C 0.0053 0.0039 0.0212 1425 PHE 46 O 0.0064 0.0040 0.0216 1426 PHE 46 CB 0.0059 0.0072 0.0184 1427 PHE 46 CG 0.0074 0.0069 0.0194 1428 PHE 46 CD1 0.0064 0.0057 0.0201 1429 PHE 46 CD2 0.0098 0.0078 0.0197 1430 PHE 46 CE1 0.0078 0.0054 0.0210 1431 PHE 46 CE2 0.0113 0.0075 0.0206 1432 PHE 46 CZ 0.0103 0.0063 0.0212 1433 GLY 47 N 0.0058 0.0101 0.0208 1434 GLY 47 CA 0.0063 0.0115 0.0253 1435 GLY 47 C 0.0037 0.0082 0.0289 1436 GLY 47 O 0.0015 0.0047 0.0275 1437 ASN 48 N 0.0041 0.0093 0.0336 1438 ASN 48 CA 0.0018 0.0064 0.0376 1439 ASN 48 C -0.0006 0.0028 0.0366 1440 ASN 48 O -0.0030 -0.0007 0.0374 1441 ASN 48 CB 0.0008 0.0051 0.0382 1442 ASN 48 CG -0.0011 0.0028 0.0429 1443 ASN 48 ND2 -0.0027 0.0005 0.0431 1444 ASN 48 OD1 -0.0012 0.0032 0.0463 1445 SER 49 N 0.0063 0.0073 0.0334 1446 SER 49 CA 0.0057 0.0068 0.0329 1447 SER 49 C 0.0039 0.0056 0.0312 1448 SER 49 O 0.0031 0.0042 0.0313 1449 SER 49 CB 0.0062 0.0057 0.0349 1450 SER 49 OG 0.0050 0.0034 0.0352 1451 ILE 50 N 0.0033 0.0060 0.0297 1452 ILE 50 CA 0.0016 0.0050 0.0279 1453 ILE 50 C 0.0014 0.0068 0.0258 1454 ILE 50 O 0.0022 0.0081 0.0257 1455 ILE 50 CB 0.0007 0.0034 0.0282 1456 ILE 50 CG1 0.0010 0.0017 0.0304 1457 ILE 50 CG2 -0.0011 0.0023 0.0264 1458 ILE 50 CD1 -0.0003 -0.0002 0.0305 1459 PHE 51 N 0.0022 0.0052 0.0166 1460 PHE 51 CA 0.0017 0.0065 0.0146 1461 PHE 51 C 0.0000 0.0053 0.0136 1462 PHE 51 O -0.0011 0.0038 0.0137 1463 PHE 51 CB 0.0017 0.0075 0.0135 1464 PHE 51 CG 0.0034 0.0088 0.0143 1465 PHE 51 CD1 0.0039 0.0081 0.0158 1466 PHE 51 CD2 0.0044 0.0106 0.0136 1467 PHE 51 CE1 0.0054 0.0093 0.0165 1468 PHE 51 CE2 0.0059 0.0118 0.0144 1469 PHE 51 CZ 0.0064 0.0112 0.0158 1470 LEU 52 N -0.0001 0.0060 0.0126 1471 LEU 52 CA -0.0017 0.0052 0.0112 1472 LEU 52 C -0.0019 0.0067 0.0092 1473 LEU 52 O -0.0010 0.0081 0.0090 1474 LEU 52 CB -0.0019 0.0044 0.0119 1475 LEU 52 CG -0.0032 0.0040 0.0105 1476 LEU 52 CD1 -0.0049 0.0026 0.0097 1477 LEU 52 CD2 -0.0031 0.0033 0.0114 1478 GLN 53 N -0.0044 0.0049 0.0060 1479 GLN 53 CA -0.0043 0.0052 0.0053 1480 GLN 53 C -0.0042 0.0047 0.0041 1481 GLN 53 O -0.0043 0.0036 0.0040 1482 GLN 53 CB -0.0043 0.0049 0.0058 1483 GLN 53 CG -0.0042 0.0051 0.0050 1484 GLN 53 CD -0.0043 0.0052 0.0056 1485 GLN 53 NE2 -0.0042 0.0058 0.0051 1486 GLN 53 OE1 -0.0044 0.0047 0.0066 1487 ILE 54 N -0.0040 0.0054 0.0032 1488 ILE 54 CA -0.0040 0.0050 0.0020 1489 ILE 54 C -0.0039 0.0051 0.0015 1490 ILE 54 O -0.0038 0.0061 0.0015 1491 ILE 54 CB -0.0038 0.0056 0.0012 1492 ILE 54 CG1 -0.0039 0.0054 0.0017 1493 ILE 54 CG2 -0.0037 0.0053 -0.0000 1494 ILE 54 CD1 -0.0038 0.0055 0.0008 1495 LEU 55 N -0.0044 0.0021 -0.0004 1496 LEU 55 CA -0.0042 0.0012 0.0002 1497 LEU 55 C -0.0030 0.0011 -0.0004 1498 LEU 55 O -0.0021 0.0012 -0.0010 1499 LEU 55 CB -0.0041 0.0002 0.0011 1500 LEU 55 CG -0.0053 0.0000 0.0020 1501 LEU 55 CD1 -0.0052 -0.0006 0.0025 1502 LEU 55 CD2 -0.0056 -0.0005 0.0027 1503 GLU 56 N -0.0029 0.0008 -0.0002 1504 GLU 56 CA -0.0018 0.0006 -0.0007 1505 GLU 56 C -0.0016 -0.0004 0.0000 1506 GLU 56 O -0.0024 -0.0004 0.0006 1507 GLU 56 CB -0.0019 0.0016 -0.0015 1508 GLU 56 CG -0.0014 0.0023 -0.0025 1509 GLU 56 CD -0.0018 0.0034 -0.0032 1510 GLU 56 OE1 -0.0026 0.0036 -0.0029 1511 GLU 56 OE2 -0.0014 0.0041 -0.0041 1512 GLY 57 N -0.0009 -0.0039 0.0005 1513 GLY 57 CA 0.0002 -0.0073 0.0012 1514 GLY 57 C 0.0019 -0.0081 0.0014 1515 GLY 57 O 0.0030 -0.0059 0.0010 1516 SER 58 N 0.0022 -0.0113 0.0020 1517 SER 58 CA 0.0038 -0.0124 0.0022 1518 SER 58 C 0.0017 -0.0116 0.0020 1519 SER 58 O -0.0013 -0.0111 0.0018 1520 SER 58 CB 0.0044 -0.0161 0.0029 1521 SER 58 OG 0.0013 -0.0179 0.0031 1522 ARG 59 N -0.0011 -0.0103 0.0035 1523 ARG 59 CA -0.0014 -0.0085 0.0022 1524 ARG 59 C -0.0026 -0.0094 0.0014 1525 ARG 59 O -0.0038 -0.0087 -0.0003 1526 ARG 59 CB 0.0003 -0.0069 0.0031 1527 ARG 59 CG 0.0002 -0.0046 0.0019 1528 ARG 59 CD 0.0019 -0.0031 0.0029 1529 ARG 59 NE 0.0025 -0.0038 0.0039 1530 ARG 59 CZ 0.0040 -0.0029 0.0050 1531 ARG 59 NH1 0.0051 -0.0012 0.0053 1532 ARG 59 NH2 0.0043 -0.0038 0.0058 1533 GLN 60 N -0.0023 -0.0109 0.0025 1534 GLN 60 CA -0.0034 -0.0118 0.0018 1535 GLN 60 C -0.0052 -0.0130 0.0005 1536 GLN 60 O -0.0064 -0.0128 -0.0009 1537 GLN 60 CB -0.0027 -0.0133 0.0034 1538 GLN 60 CG -0.0038 -0.0145 0.0028 1539 GLN 60 CD -0.0041 -0.0131 0.0017 1540 GLN 60 NE2 -0.0053 -0.0141 0.0010 1541 GLN 60 OE1 -0.0033 -0.0111 0.0016 1542 ALA 61 N -0.0013 -0.0147 0.0042 1543 ALA 61 CA -0.0037 -0.0150 0.0038 1544 ALA 61 C -0.0053 -0.0127 0.0026 1545 ALA 61 O -0.0076 -0.0129 0.0022 1546 ALA 61 CB -0.0032 -0.0156 0.0041 1547 ILE 62 N -0.0039 -0.0105 0.0021 1548 ILE 62 CA -0.0052 -0.0082 0.0009 1549 ILE 62 C -0.0064 -0.0081 0.0007 1550 ILE 62 O -0.0086 -0.0074 -0.0000 1551 ILE 62 CB -0.0034 -0.0060 0.0005 1552 ILE 62 CG1 -0.0030 -0.0056 0.0004 1553 ILE 62 CG2 -0.0043 -0.0036 -0.0006 1554 ILE 62 CD1 -0.0016 -0.0032 -0.0002 1555 SER 63 N -0.0043 -0.0074 -0.0002 1556 SER 63 CA -0.0038 -0.0068 -0.0006 1557 SER 63 C -0.0055 -0.0080 -0.0002 1558 SER 63 O -0.0063 -0.0075 -0.0014 1559 SER 63 CB -0.0013 -0.0064 0.0006 1560 SER 63 OG 0.0004 -0.0051 0.0000 1561 HIS 64 N -0.0061 -0.0097 0.0016 1562 HIS 64 CA -0.0077 -0.0110 0.0021 1563 HIS 64 C -0.0102 -0.0111 0.0006 1564 HIS 64 O -0.0114 -0.0113 0.0000 1565 HIS 64 CB -0.0078 -0.0128 0.0044 1566 HIS 64 CG -0.0089 -0.0140 0.0053 1567 HIS 64 CD2 -0.0083 -0.0139 0.0054 1568 HIS 64 ND1 -0.0107 -0.0156 0.0061 1569 HIS 64 CE1 -0.0113 -0.0164 0.0067 1570 HIS 64 NE2 -0.0099 -0.0154 0.0064 1571 THR 65 N -0.0053 -0.0100 0.0039 1572 THR 65 CA -0.0073 -0.0106 0.0021 1573 THR 65 C -0.0079 -0.0083 -0.0001 1574 THR 65 O -0.0098 -0.0086 -0.0018 1575 THR 65 CB -0.0072 -0.0113 0.0027 1576 THR 65 CG2 -0.0092 -0.0116 0.0008 1577 THR 65 OG1 -0.0070 -0.0137 0.0046 1578 TYR 66 N -0.0064 -0.0059 -0.0000 1579 TYR 66 CA -0.0069 -0.0037 -0.0021 1580 TYR 66 C -0.0076 -0.0035 -0.0029 1581 TYR 66 O -0.0091 -0.0029 -0.0049 1582 TYR 66 CB -0.0050 -0.0013 -0.0017 1583 TYR 66 CG -0.0054 0.0011 -0.0037 1584 TYR 66 CD1 -0.0067 0.0014 -0.0053 1585 TYR 66 CD2 -0.0046 0.0030 -0.0041 1586 TYR 66 CE1 -0.0071 0.0036 -0.0072 1587 TYR 66 CE2 -0.0050 0.0052 -0.0060 1588 TYR 66 CZ -0.0063 0.0055 -0.0075 1589 TYR 66 OH -0.0067 0.0076 -0.0094 1590 HIS 67 N -0.0065 -0.0057 -0.0030 1591 HIS 67 CA -0.0062 -0.0050 -0.0036 1592 HIS 67 C -0.0086 -0.0071 -0.0046 1593 HIS 67 O -0.0091 -0.0065 -0.0067 1594 HIS 67 CB -0.0043 -0.0047 -0.0005 1595 HIS 67 CG -0.0041 -0.0044 -0.0006 1596 HIS 67 CD2 -0.0040 -0.0031 -0.0029 1597 HIS 67 ND1 -0.0039 -0.0057 0.0020 1598 HIS 67 CE1 -0.0038 -0.0051 0.0013 1599 HIS 67 NE2 -0.0039 -0.0035 -0.0017 1600 ARG 68 N -0.0102 -0.0097 -0.0031 1601 ARG 68 CA -0.0127 -0.0118 -0.0041 1602 ARG 68 C -0.0144 -0.0118 -0.0075 1603 ARG 68 O -0.0159 -0.0124 -0.0093 1604 ARG 68 CB -0.0139 -0.0146 -0.0017 1605 ARG 68 CG -0.0164 -0.0169 -0.0024 1606 ARG 68 CD -0.0177 -0.0196 -0.0000 1607 ARG 68 NE -0.0160 -0.0193 0.0027 1608 ARG 68 CZ -0.0168 -0.0211 0.0043 1609 ARG 68 NH1 -0.0192 -0.0232 0.0035 1610 ARG 68 NH2 -0.0151 -0.0207 0.0068 1611 ILE 69 N -0.0100 -0.0065 -0.0068 1612 ILE 69 CA -0.0115 -0.0056 -0.0086 1613 ILE 69 C -0.0122 -0.0035 -0.0104 1614 ILE 69 O -0.0142 -0.0035 -0.0121 1615 ILE 69 CB -0.0104 -0.0045 -0.0082 1616 ILE 69 CG1 -0.0107 -0.0067 -0.0073 1617 ILE 69 CG2 -0.0113 -0.0024 -0.0102 1618 ILE 69 CD1 -0.0097 -0.0058 -0.0069 1619 LEU 70 N -0.0107 -0.0018 -0.0100 1620 LEU 70 CA -0.0112 0.0004 -0.0116 1621 LEU 70 C -0.0131 -0.0005 -0.0128 1622 LEU 70 O -0.0142 0.0009 -0.0145 1623 LEU 70 CB -0.0091 0.0022 -0.0107 1624 LEU 70 CG -0.0079 0.0047 -0.0110 1625 LEU 70 CD1 -0.0058 0.0063 -0.0100 1626 LEU 70 CD2 -0.0095 0.0063 -0.0132 1627 GLN 71 N -0.0091 -0.0009 -0.0114 1628 GLN 71 CA -0.0130 -0.0029 -0.0159 1629 GLN 71 C -0.0135 -0.0042 -0.0173 1630 GLN 71 O -0.0174 -0.0049 -0.0207 1631 GLN 71 CB -0.0117 -0.0074 -0.0191 1632 GLN 71 CG -0.0103 -0.0069 -0.0176 1633 GLN 71 CD -0.0146 -0.0032 -0.0172 1634 GLN 71 NE2 -0.0171 -0.0047 -0.0203 1635 GLN 71 OE1 -0.0157 0.0011 -0.0141 1636 ASP 72 N -0.0096 -0.0043 -0.0148 1637 ASP 72 CA -0.0094 -0.0061 -0.0162 1638 ASP 72 C -0.0135 -0.0025 -0.0158 1639 ASP 72 O -0.0137 0.0016 -0.0122 1640 ASP 72 CB -0.0040 -0.0071 -0.0134 1641 ASP 72 CG -0.0024 -0.0112 -0.0161 1642 ASP 72 OD1 -0.0055 -0.0111 -0.0180 1643 ASP 72 OD2 0.0018 -0.0146 -0.0162 1644 PRO 73 N -0.0137 0.0004 -0.0152 1645 PRO 73 CA -0.0195 0.0050 -0.0149 1646 PRO 73 C -0.0157 0.0069 -0.0109 1647 PRO 73 O -0.0202 0.0113 -0.0100 1648 PRO 73 CB -0.0242 -0.0002 -0.0222 1649 PRO 73 CG -0.0207 -0.0027 -0.0222 1650 PRO 73 CD -0.0167 -0.0057 -0.0222 1651 ARG 74 N -0.0079 0.0035 -0.0089 1652 ARG 74 CA -0.0039 0.0050 -0.0052 1653 ARG 74 C -0.0033 0.0126 0.0016 1654 ARG 74 O -0.0021 0.0153 0.0046 1655 ARG 74 CB 0.0045 -0.0009 -0.0050 1656 ARG 74 CG 0.0099 0.0003 -0.0006 1657 ARG 74 CD 0.0159 -0.0066 -0.0028 1658 ARG 74 NE 0.0197 -0.0123 -0.0052 1659 ARG 74 CZ 0.0168 -0.0174 -0.0114 1660 ARG 74 NH1 0.0100 -0.0178 -0.0159 1661 ARG 74 NH2 0.0208 -0.0223 -0.0130 1662 HIS 75 N -0.0072 0.0103 -0.0018 1663 HIS 75 CA -0.0075 0.0127 0.0014 1664 HIS 75 C -0.0107 0.0146 0.0014 1665 HIS 75 O -0.0123 0.0140 -0.0010 1666 HIS 75 CB -0.0045 0.0125 0.0039 1667 HIS 75 CG -0.0039 0.0118 0.0034 1668 HIS 75 CD2 -0.0013 0.0099 0.0030 1669 HIS 75 ND1 -0.0063 0.0131 0.0032 1670 HIS 75 CE1 -0.0051 0.0121 0.0028 1671 HIS 75 NE2 -0.0020 0.0101 0.0026 1672 HIS 76 N -0.0116 0.0169 0.0041 1673 HIS 76 CA -0.0146 0.0190 0.0043 1674 HIS 76 C -0.0143 0.0211 0.0078 1675 HIS 76 O -0.0121 0.0212 0.0100 1676 HIS 76 CB -0.0176 0.0198 0.0029 1677 HIS 76 CG -0.0175 0.0210 0.0048 1678 HIS 76 CD2 -0.0199 0.0232 0.0060 1679 HIS 76 ND1 -0.0148 0.0200 0.0058 1680 HIS 76 CE1 -0.0155 0.0215 0.0074 1681 HIS 76 NE2 -0.0186 0.0235 0.0076 1682 SER 77 N -0.0125 0.0097 0.0073 1683 SER 77 CA -0.0114 0.0112 0.0072 1684 SER 77 C -0.0078 0.0124 0.0052 1685 SER 77 O -0.0065 0.0153 0.0056 1686 SER 77 CB -0.0130 0.0142 0.0096 1687 SER 77 OG -0.0164 0.0130 0.0114 1688 ALA 78 N -0.0061 0.0101 0.0031 1689 ALA 78 CA -0.0027 0.0109 0.0011 1690 ALA 78 C -0.0016 0.0110 0.0004 1691 ALA 78 O -0.0032 0.0091 0.0007 1692 ALA 78 CB -0.0013 0.0082 -0.0011 1693 GLU 79 N 0.0047 0.0064 0.0018 1694 GLU 79 CA 0.0040 0.0049 0.0008 1695 GLU 79 C 0.0019 0.0054 0.0000 1696 GLU 79 O 0.0009 0.0062 -0.0001 1697 GLU 79 CB 0.0044 0.0030 0.0002 1698 GLU 79 CG 0.0049 0.0012 -0.0003 1699 GLU 79 CD 0.0053 -0.0006 -0.0008 1700 GLU 79 OE1 0.0067 -0.0007 -0.0002 1701 GLU 79 OE2 0.0043 -0.0019 -0.0018 1702 ILE 80 N 0.0012 0.0050 -0.0005 1703 ILE 80 CA -0.0008 0.0055 -0.0012 1704 ILE 80 C -0.0018 0.0037 -0.0024 1705 ILE 80 O -0.0012 0.0022 -0.0027 1706 ILE 80 CB -0.0012 0.0062 -0.0011 1707 ILE 80 CG1 -0.0000 0.0078 0.0001 1708 ILE 80 CG2 -0.0033 0.0069 -0.0018 1709 ILE 80 CD1 0.0002 0.0080 0.0003 1710 ILE 81 N 0.0024 0.0030 -0.0016 1711 ILE 81 CA 0.0012 0.0012 -0.0019 1712 ILE 81 C -0.0010 0.0014 -0.0022 1713 ILE 81 O -0.0017 0.0001 -0.0024 1714 ILE 81 CB 0.0013 0.0006 -0.0018 1715 ILE 81 CG1 0.0033 -0.0006 -0.0015 1716 ILE 81 CG2 -0.0005 -0.0007 -0.0022 1717 ILE 81 CD1 0.0036 -0.0009 -0.0015 1718 ALA 82 N -0.0020 0.0031 -0.0024 1719 ALA 82 CA -0.0041 0.0033 -0.0027 1720 ALA 82 C -0.0047 0.0055 -0.0028 1721 ALA 82 O -0.0038 0.0068 -0.0026 1722 ALA 82 CB -0.0055 0.0020 -0.0030 1723 PHE 83 N -0.0038 0.0086 -0.0040 1724 PHE 83 CA -0.0031 0.0069 -0.0038 1725 PHE 83 C -0.0012 0.0070 -0.0039 1726 PHE 83 O -0.0005 0.0071 -0.0039 1727 PHE 83 CB -0.0038 0.0056 -0.0036 1728 PHE 83 CG -0.0032 0.0038 -0.0034 1729 PHE 83 CD1 -0.0016 0.0033 -0.0034 1730 PHE 83 CD2 -0.0042 0.0027 -0.0032 1731 PHE 83 CE1 -0.0011 0.0017 -0.0032 1732 PHE 83 CE2 -0.0036 0.0011 -0.0030 1733 PHE 83 CZ -0.0021 0.0006 -0.0030 1734 ASP 84 N -0.0003 0.0071 -0.0040 1735 ASP 84 CA 0.0015 0.0074 -0.0041 1736 ASP 84 C 0.0024 0.0063 -0.0040 1737 ASP 84 O 0.0017 0.0059 -0.0039 1738 ASP 84 CB 0.0019 0.0093 -0.0044 1739 ASP 84 CG 0.0014 0.0098 -0.0044 1740 ASP 84 OD1 -0.0002 0.0099 -0.0044 1741 ASP 84 OD2 0.0025 0.0101 -0.0045 1742 PRO 85 N 0.0102 0.0063 -0.0046 1743 PRO 85 CA 0.0101 0.0052 -0.0033 1744 PRO 85 C 0.0096 0.0054 -0.0039 1745 PRO 85 O 0.0100 0.0067 -0.0051 1746 PRO 85 CB 0.0122 0.0052 -0.0022 1747 PRO 85 CG 0.0133 0.0066 -0.0030 1748 PRO 85 CD 0.0121 0.0074 -0.0047 1749 VAL 86 N 0.0088 0.0042 -0.0031 1750 VAL 86 CA 0.0080 0.0043 -0.0035 1751 VAL 86 C 0.0086 0.0033 -0.0021 1752 VAL 86 O 0.0090 0.0023 -0.0007 1753 VAL 86 CB 0.0059 0.0038 -0.0043 1754 VAL 86 CG1 0.0053 0.0051 -0.0060 1755 VAL 86 CG2 0.0050 0.0026 -0.0034 1756 LEU 87 N -0.0274 -0.0050 0.0047 1757 LEU 87 CA -0.0245 -0.0025 -0.0026 1758 LEU 87 C -0.0113 0.0014 -0.0099 1759 LEU 87 O -0.0108 0.0049 -0.0215 1760 LEU 87 CB -0.0239 -0.0052 0.0067 1761 LEU 87 CG -0.0211 -0.0031 0.0008 1762 LEU 87 CD1 -0.0288 -0.0003 -0.0123 1763 LEU 87 CD2 -0.0247 -0.0064 0.0105 1764 GLN 88 N -0.0005 0.0010 -0.0033 1765 GLN 88 CA 0.0125 0.0046 -0.0094 1766 GLN 88 C 0.0200 0.0040 -0.0039 1767 GLN 88 O 0.0175 0.0005 0.0070 1768 GLN 88 CB 0.0213 0.0052 -0.0073 1769 GLN 88 CG 0.0215 0.0011 0.0067 1770 GLN 88 CD 0.0305 0.0018 0.0085 1771 GLN 88 NE2 0.0437 0.0042 0.0065 1772 GLN 88 OE1 0.0257 0.0003 0.0116 1773 ARG 89 N 0.0005 0.0007 -0.0042 1774 ARG 89 CA -0.0009 0.0011 -0.0037 1775 ARG 89 C -0.0015 0.0026 -0.0042 1776 ARG 89 O -0.0008 0.0032 -0.0048 1777 ARG 89 CB -0.0018 0.0002 -0.0028 1778 ARG 89 CG -0.0012 -0.0013 -0.0023 1779 ARG 89 CD -0.0023 -0.0020 -0.0013 1780 ARG 89 NE -0.0018 -0.0034 -0.0009 1781 ARG 89 CZ -0.0024 -0.0045 -0.0000 1782 ARG 89 NH1 -0.0036 -0.0043 0.0005 1783 ARG 89 NH2 -0.0018 -0.0057 0.0003 1784 GLU 90 N -0.0027 0.0032 -0.0038 1785 GLU 90 CA -0.0034 0.0045 -0.0042 1786 GLU 90 C -0.0048 0.0046 -0.0035 1787 GLU 90 O -0.0054 0.0057 -0.0037 1788 GLU 90 CB -0.0034 0.0055 -0.0047 1789 GLU 90 CG -0.0020 0.0056 -0.0055 1790 GLU 90 CD -0.0018 0.0070 -0.0063 1791 GLU 90 OE1 -0.0023 0.0077 -0.0064 1792 GLU 90 OE2 -0.0011 0.0075 -0.0069 1793 PHE 91 N -0.0070 0.0066 -0.0033 1794 PHE 91 CA -0.0066 0.0070 -0.0030 1795 PHE 91 C -0.0066 0.0076 -0.0033 1796 PHE 91 O -0.0063 0.0078 -0.0031 1797 PHE 91 CB -0.0062 0.0067 -0.0026 1798 PHE 91 CG -0.0062 0.0061 -0.0024 1799 PHE 91 CD1 -0.0060 0.0059 -0.0022 1800 PHE 91 CD2 -0.0065 0.0056 -0.0025 1801 PHE 91 CE1 -0.0059 0.0054 -0.0019 1802 PHE 91 CE2 -0.0064 0.0051 -0.0023 1803 PHE 91 CZ -0.0062 0.0049 -0.0020 1804 VAL 92 N -0.0070 0.0078 -0.0037 1805 VAL 92 CA -0.0071 0.0083 -0.0039 1806 VAL 92 C -0.0067 0.0088 -0.0038 1807 VAL 92 O -0.0066 0.0092 -0.0039 1808 VAL 92 CB -0.0076 0.0084 -0.0044 1809 VAL 92 CG1 -0.0076 0.0083 -0.0044 1810 VAL 92 CG2 -0.0076 0.0090 -0.0047 1811 GLN 93 N -0.0078 0.0098 -0.0070 1812 GLN 93 CA -0.0056 0.0123 -0.0069 1813 GLN 93 C -0.0031 0.0133 -0.0059 1814 GLN 93 O -0.0021 0.0160 -0.0066 1815 GLN 93 CB -0.0044 0.0113 -0.0058 1816 GLN 93 CG -0.0066 0.0090 -0.0060 1817 GLN 93 CD -0.0062 0.0057 -0.0043 1818 GLN 93 NE2 -0.0082 0.0036 -0.0044 1819 GLN 93 OE1 -0.0042 0.0051 -0.0029 1820 TRP 94 N -0.0021 0.0111 -0.0044 1821 TRP 94 CA 0.0005 0.0118 -0.0033 1822 TRP 94 C -0.0003 0.0119 -0.0038 1823 TRP 94 O -0.0020 0.0098 -0.0038 1824 TRP 94 CB 0.0025 0.0094 -0.0012 1825 TRP 94 CG 0.0031 0.0088 -0.0005 1826 TRP 94 CD1 0.0021 0.0062 0.0000 1827 TRP 94 CD2 0.0050 0.0108 -0.0004 1828 TRP 94 CE2 0.0050 0.0092 0.0003 1829 TRP 94 CE3 0.0067 0.0137 -0.0008 1830 TRP 94 NE1 0.0032 0.0064 0.0005 1831 TRP 94 CZ2 0.0066 0.0106 0.0006 1832 TRP 94 CZ3 0.0083 0.0150 -0.0005 1833 TRP 94 CH2 0.0082 0.0135 0.0002 1834 SER 95 N -0.0018 0.0062 0.0007 1835 SER 95 CA -0.0018 0.0054 0.0010 1836 SER 95 C -0.0018 0.0050 0.0017 1837 SER 95 O -0.0018 0.0042 0.0018 1838 SER 95 CB -0.0018 0.0057 0.0013 1839 SER 95 OG -0.0018 0.0057 0.0006 1840 MET 96 N -0.0018 0.0055 0.0023 1841 MET 96 CA -0.0018 0.0053 0.0030 1842 MET 96 C -0.0018 0.0061 0.0033 1843 MET 96 O -0.0018 0.0067 0.0035 1844 MET 96 CB -0.0018 0.0048 0.0037 1845 MET 96 CG -0.0017 0.0040 0.0040 1846 MET 96 SD -0.0017 0.0031 0.0033 1847 MET 96 CE -0.0017 0.0028 0.0032 1848 LYS 97 N -0.0010 0.0055 0.0011 1849 LYS 97 CA 0.0020 0.0049 0.0030 1850 LYS 97 C 0.0018 0.0036 0.0055 1851 LYS 97 O -0.0009 0.0027 0.0065 1852 LYS 97 CB 0.0025 0.0044 0.0043 1853 LYS 97 CG 0.0060 0.0044 0.0052 1854 LYS 97 CD 0.0084 0.0059 0.0031 1855 LYS 97 CE 0.0117 0.0061 0.0035 1856 LYS 97 NZ 0.0141 0.0076 0.0014 1857 LEU 98 N 0.0046 0.0035 0.0064 1858 LEU 98 CA 0.0048 0.0023 0.0088 1859 LEU 98 C 0.0068 0.0012 0.0115 1860 LEU 98 O 0.0094 0.0018 0.0112 1861 LEU 98 CB 0.0064 0.0031 0.0078 1862 LEU 98 CG 0.0065 0.0021 0.0098 1863 LEU 98 CD1 0.0034 0.0008 0.0114 1864 LEU 98 CD2 0.0072 0.0031 0.0080 1865 VAL 99 N 0.0053 -0.0093 0.0170 1866 VAL 99 CA 0.0065 -0.0096 0.0191 1867 VAL 99 C 0.0056 -0.0093 0.0199 1868 VAL 99 O 0.0036 -0.0088 0.0205 1869 VAL 99 CB 0.0063 -0.0095 0.0211 1870 VAL 99 CG1 0.0038 -0.0088 0.0215 1871 VAL 99 CG2 0.0074 -0.0097 0.0233 1872 GLN 100 N 0.0070 -0.0097 0.0197 1873 GLN 100 CA 0.0064 -0.0095 0.0205 1874 GLN 100 C 0.0070 -0.0096 0.0231 1875 GLN 100 O 0.0084 -0.0099 0.0241 1876 GLN 100 CB 0.0076 -0.0099 0.0190 1877 GLN 100 CG 0.0065 -0.0096 0.0166 1878 GLN 100 CD 0.0082 -0.0101 0.0147 1879 GLN 100 NE2 0.0077 -0.0100 0.0130 1880 GLN 100 OE1 0.0100 -0.0106 0.0147 1881 ILE 101 N 0.0018 -0.0181 0.0141 1882 ILE 101 CA 0.0024 -0.0136 0.0169 1883 ILE 101 C -0.0020 -0.0149 0.0093 1884 ILE 101 O -0.0038 -0.0086 0.0089 1885 ILE 101 CB 0.0020 -0.0024 0.0207 1886 ILE 101 CG1 -0.0040 0.0039 0.0135 1887 ILE 101 CG2 0.0066 -0.0013 0.0286 1888 ILE 101 CD1 -0.0058 0.0150 0.0152 1889 ASP 102 N -0.0037 -0.0232 0.0032 1890 ASP 102 CA -0.0080 -0.0250 -0.0046 1891 ASP 102 C -0.0064 -0.0251 -0.0020 1892 ASP 102 O -0.0090 -0.0179 -0.0032 1893 ASP 102 CB -0.0090 -0.0351 -0.0102 1894 ASP 102 CG -0.0034 -0.0438 -0.0046 1895 ASP 102 OD1 0.0011 -0.0435 0.0026 1896 ASP 102 OD2 -0.0034 -0.0510 -0.0075 1897 SER 105 N -0.0131 -0.0206 0.0026 1898 SER 105 CA -0.0051 -0.0209 -0.0001 1899 SER 105 C 0.0001 -0.0123 0.0027 1900 SER 105 O -0.0038 -0.0061 0.0071 1901 SER 105 CB -0.0077 -0.0248 -0.0013 1902 SER 105 OG -0.0098 -0.0187 0.0025 1903 PRO 106 N 0.0090 -0.0118 0.0001 1904 PRO 106 CA 0.0146 -0.0038 0.0025 1905 PRO 106 C 0.0127 -0.0002 0.0049 1906 PRO 106 O 0.0099 -0.0048 0.0035 1907 PRO 106 CB 0.0242 -0.0059 -0.0016 1908 PRO 106 CG 0.0234 -0.0151 -0.0061 1909 PRO 106 CD 0.0144 -0.0186 -0.0051 1910 GLU 107 N 0.0151 0.0078 0.0109 1911 GLU 107 CA 0.0113 0.0087 0.0149 1912 GLU 107 C 0.0119 0.0077 0.0126 1913 GLU 107 O 0.0083 0.0079 0.0151 1914 GLU 107 CB 0.0133 0.0126 0.0212 1915 GLU 107 CG 0.0203 0.0148 0.0216 1916 GLU 107 CD 0.0208 0.0159 0.0234 1917 GLU 107 OE1 0.0166 0.0167 0.0273 1918 GLU 107 OE2 0.0253 0.0159 0.0208 1919 LYS 108 N 0.0164 0.0067 0.0080 1920 LYS 108 CA 0.0169 0.0055 0.0055 1921 LYS 108 C 0.0109 0.0023 0.0026 1922 LYS 108 O 0.0087 0.0019 0.0031 1923 LYS 108 CB 0.0229 0.0049 0.0008 1924 LYS 108 CG 0.0239 0.0036 -0.0023 1925 LYS 108 CD 0.0243 0.0003 -0.0090 1926 LYS 108 CE 0.0259 -0.0008 -0.0121 1927 LYS 108 NZ 0.0285 -0.0034 -0.0185 1928 MET 109 N 0.0031 0.0002 0.0015 1929 MET 109 CA 0.0014 -0.0035 0.0012 1930 MET 109 C -0.0007 -0.0031 0.0030 1931 MET 109 O -0.0009 -0.0052 0.0022 1932 MET 109 CB -0.0007 -0.0060 0.0018 1933 MET 109 CG 0.0009 -0.0088 -0.0008 1934 MET 109 SD -0.0018 -0.0119 -0.0001 1935 MET 109 CE 0.0010 -0.0119 -0.0023 1936 ARG 110 N -0.0023 -0.0003 0.0055 1937 ARG 110 CA -0.0042 0.0005 0.0073 1938 ARG 110 C -0.0019 0.0021 0.0062 1939 ARG 110 O -0.0028 0.0013 0.0066 1940 ARG 110 CB -0.0062 0.0032 0.0102 1941 ARG 110 CG -0.0091 0.0015 0.0117 1942 ARG 110 CD -0.0104 0.0045 0.0141 1943 ARG 110 NE -0.0102 0.0045 0.0139 1944 ARG 110 CZ -0.0093 0.0077 0.0147 1945 ARG 110 NH1 -0.0087 0.0111 0.0157 1946 ARG 110 NH2 -0.0092 0.0073 0.0144 1947 ARG 111 N 0.0014 -0.0002 0.0026 1948 ARG 111 CA 0.0012 -0.0000 0.0038 1949 ARG 111 C -0.0007 -0.0008 0.0019 1950 ARG 111 O -0.0024 -0.0010 0.0031 1951 ARG 111 CB 0.0043 0.0007 0.0039 1952 ARG 111 CG 0.0044 0.0009 0.0054 1953 ARG 111 CD 0.0040 0.0013 0.0087 1954 ARG 111 NE 0.0067 0.0021 0.0102 1955 ARG 111 CZ 0.0084 0.0026 0.0107 1956 ARG 111 NH1 0.0078 0.0023 0.0099 1957 ARG 111 NH2 0.0109 0.0034 0.0121 1958 LEU 112 N -0.0004 -0.0011 -0.0010 1959 LEU 112 CA -0.0023 -0.0018 -0.0030 1960 LEU 112 C -0.0054 -0.0025 -0.0026 1961 LEU 112 O -0.0074 -0.0030 -0.0026 1962 LEU 112 CB -0.0013 -0.0020 -0.0061 1963 LEU 112 CG 0.0018 -0.0013 -0.0069 1964 LEU 112 CD1 0.0022 -0.0017 -0.0101 1965 LEU 112 CD2 0.0024 -0.0009 -0.0051 1966 TYR 113 N -0.0082 -0.0005 -0.0003 1967 TYR 113 CA -0.0064 -0.0013 -0.0001 1968 TYR 113 C -0.0050 -0.0007 -0.0028 1969 TYR 113 O -0.0025 -0.0015 -0.0032 1970 TYR 113 CB -0.0081 -0.0012 0.0012 1971 TYR 113 CG -0.0083 -0.0023 0.0041 1972 TYR 113 CD1 -0.0060 -0.0037 0.0054 1973 TYR 113 CD2 -0.0107 -0.0020 0.0057 1974 TYR 113 CE1 -0.0062 -0.0047 0.0081 1975 TYR 113 CE2 -0.0110 -0.0030 0.0084 1976 TYR 113 CZ -0.0087 -0.0044 0.0096 1977 TYR 113 OH -0.0089 -0.0055 0.0124 1978 LEU 114 N -0.0065 0.0006 -0.0048 1979 LEU 114 CA -0.0053 0.0013 -0.0074 1980 LEU 114 C -0.0035 0.0011 -0.0087 1981 LEU 114 O -0.0015 0.0009 -0.0103 1982 LEU 114 CB -0.0076 0.0028 -0.0091 1983 LEU 114 CG -0.0069 0.0035 -0.0115 1984 LEU 114 CD1 -0.0070 0.0032 -0.0106 1985 LEU 114 CD2 -0.0089 0.0051 -0.0135 1986 LYS 115 N -0.0019 -0.0045 -0.0077 1987 LYS 115 CA -0.0027 -0.0048 -0.0086 1988 LYS 115 C -0.0024 -0.0053 -0.0086 1989 LYS 115 O -0.0026 -0.0062 -0.0093 1990 LYS 115 CB -0.0035 -0.0036 -0.0090 1991 LYS 115 CG -0.0045 -0.0039 -0.0101 1992 LYS 115 CD -0.0052 -0.0028 -0.0104 1993 LYS 115 CE -0.0060 -0.0021 -0.0108 1994 LYS 115 NZ -0.0068 -0.0012 -0.0112 1995 TYR 116 N -0.0019 -0.0047 -0.0078 1996 TYR 116 CA -0.0017 -0.0050 -0.0078 1997 TYR 116 C -0.0007 -0.0057 -0.0070 1998 TYR 116 O -0.0004 -0.0056 -0.0066 1999 TYR 116 CB -0.0021 -0.0039 -0.0076 2000 TYR 116 CG -0.0032 -0.0032 -0.0084 2001 TYR 116 CD1 -0.0038 -0.0037 -0.0093 2002 TYR 116 CD2 -0.0035 -0.0020 -0.0081 2003 TYR 116 CE1 -0.0048 -0.0030 -0.0100 2004 TYR 116 CE2 -0.0044 -0.0014 -0.0088 2005 TYR 116 CZ -0.0051 -0.0019 -0.0098 2006 TYR 116 OH -0.0061 -0.0013 -0.0105 2007 SER 117 N 0.0017 0.0028 -0.0018 2008 SER 117 CA 0.0048 0.0082 -0.0077 2009 SER 117 C 0.0044 0.0124 -0.0186 2010 SER 117 O 0.0002 0.0102 -0.0220 2011 SER 117 CB -0.0003 0.0040 -0.0086 2012 SER 117 OG -0.0085 -0.0004 -0.0155 2013 GLY 118 N 0.0088 0.0187 -0.0239 2014 GLY 118 CA 0.0086 0.0231 -0.0346 2015 GLY 118 C 0.0034 0.0219 -0.0428 2016 GLY 118 O 0.0035 0.0260 -0.0520 2017 GLU 119 N 0.0093 0.0221 -0.0454 2018 GLU 119 CA 0.0005 0.0220 -0.0437 2019 GLU 119 C -0.0114 0.0215 -0.0408 2020 GLU 119 O -0.0122 0.0184 -0.0363 2021 GLU 119 CB 0.0039 0.0159 -0.0358 2022 GLU 119 CG 0.0167 0.0149 -0.0367 2023 GLU 119 CD 0.0187 0.0172 -0.0403 2024 GLU 119 OE1 0.0119 0.0221 -0.0460 2025 GLU 119 OE2 0.0272 0.0140 -0.0375 2026 VAL 120 N -0.0207 0.0246 -0.0434 2027 VAL 120 CA -0.0325 0.0250 -0.0417 2028 VAL 120 C -0.0364 0.0178 -0.0310 2029 VAL 120 O -0.0414 0.0157 -0.0271 2030 VAL 120 CB -0.0411 0.0304 -0.0477 2031 VAL 120 CG1 -0.0399 0.0376 -0.0580 2032 VAL 120 CG2 -0.0387 0.0297 -0.0472 2033 ALA 121 N -0.0146 0.0183 -0.0085 2034 ALA 121 CA -0.0166 0.0157 -0.0004 2035 ALA 121 C -0.0117 0.0115 0.0006 2036 ALA 121 O -0.0060 0.0097 -0.0042 2037 ALA 121 CB -0.0165 0.0128 0.0052 2038 PHE 122 N -0.0139 0.0099 0.0071 2039 PHE 122 CA -0.0097 0.0057 0.0089 2040 PHE 122 C -0.0033 -0.0000 0.0110 2041 PHE 122 O -0.0040 -0.0026 0.0170 2042 PHE 122 CB -0.0140 0.0055 0.0156 2043 PHE 122 CG -0.0101 0.0017 0.0174 2044 PHE 122 CD1 -0.0049 0.0009 0.0116 2045 PHE 122 CD2 -0.0117 -0.0009 0.0249 2046 PHE 122 CE1 -0.0014 -0.0026 0.0132 2047 PHE 122 CE2 -0.0082 -0.0043 0.0265 2048 PHE 122 CZ -0.0030 -0.0052 0.0206 2049 MET 123 N -0.0018 -0.0024 0.0089 2050 MET 123 CA 0.0034 -0.0061 0.0097 2051 MET 123 C 0.0043 -0.0073 0.0074 2052 MET 123 O 0.0051 -0.0090 0.0022 2053 MET 123 CB 0.0060 -0.0087 0.0066 2054 MET 123 CG 0.0103 -0.0112 0.0104 2055 MET 123 SD 0.0135 -0.0145 0.0063 2056 MET 123 CE 0.0088 -0.0115 0.0037 2057 PRO 124 N 0.0043 -0.0065 0.0111 2058 PRO 124 CA 0.0046 -0.0072 0.0089 2059 PRO 124 C 0.0097 -0.0111 0.0085 2060 PRO 124 O 0.0103 -0.0122 0.0057 2061 PRO 124 CB 0.0022 -0.0045 0.0134 2062 PRO 124 CG 0.0017 -0.0030 0.0185 2063 PRO 124 CD 0.0038 -0.0048 0.0174 2064 GLU 125 N 0.0135 -0.0133 0.0094 2065 GLU 125 CA 0.0190 -0.0173 0.0091 2066 GLU 125 C 0.0210 -0.0190 0.0025 2067 GLU 125 O 0.0253 -0.0223 0.0012 2068 GLU 125 CB 0.0220 -0.0194 0.0139 2069 GLU 125 CG 0.0226 -0.0199 0.0122 2070 GLU 125 CD 0.0186 -0.0169 0.0151 2071 GLU 125 OE1 0.0161 -0.0149 0.0196 2072 GLU 125 OE2 0.0180 -0.0165 0.0129 2073 THR 126 N 0.0180 -0.0170 -0.0017 2074 THR 126 CA 0.0194 -0.0182 -0.0083 2075 THR 126 C 0.0172 -0.0167 -0.0126 2076 THR 126 O 0.0178 -0.0173 -0.0183 2077 THR 126 CB 0.0176 -0.0169 -0.0107 2078 THR 126 CG2 0.0198 -0.0185 -0.0066 2079 THR 126 OG1 0.0122 -0.0129 -0.0106 2080 MET 127 N 0.0124 -0.0200 -0.0017 2081 MET 127 CA 0.0075 -0.0184 -0.0050 2082 MET 127 C 0.0062 -0.0189 -0.0064 2083 MET 127 O 0.0084 -0.0181 -0.0039 2084 MET 127 CB 0.0052 -0.0128 -0.0034 2085 MET 127 CG 0.0040 -0.0121 -0.0041 2086 MET 127 SD 0.0013 -0.0054 -0.0021 2087 MET 127 CE 0.0017 -0.0055 -0.0019 2088 THR 128 N 0.0026 -0.0203 -0.0105 2089 THR 128 CA 0.0007 -0.0202 -0.0122 2090 THR 128 C -0.0022 -0.0147 -0.0112 2091 THR 128 O -0.0036 -0.0114 -0.0104 2092 THR 128 CB -0.0022 -0.0235 -0.0169 2093 THR 128 CG2 0.0001 -0.0284 -0.0180 2094 THR 128 OG1 -0.0066 -0.0207 -0.0190 2095 PRO 129 N -0.0038 -0.0126 -0.0096 2096 PRO 129 CA -0.0052 -0.0079 -0.0105 2097 PRO 129 C -0.0077 -0.0075 -0.0116 2098 PRO 129 O -0.0073 -0.0040 -0.0116 2099 PRO 129 CB -0.0078 -0.0067 -0.0117 2100 PRO 129 CG -0.0081 -0.0109 -0.0115 2101 PRO 129 CD -0.0046 -0.0139 -0.0099 2102 ALA 130 N -0.0104 -0.0109 -0.0124 2103 ALA 130 CA -0.0130 -0.0107 -0.0135 2104 ALA 130 C -0.0102 -0.0107 -0.0123 2105 ALA 130 O -0.0109 -0.0080 -0.0128 2106 ALA 130 CB -0.0162 -0.0147 -0.0145 2107 GLN 131 N -0.0040 -0.0093 -0.0138 2108 GLN 131 CA -0.0047 -0.0085 -0.0134 2109 GLN 131 C -0.0047 -0.0063 -0.0107 2110 GLN 131 O -0.0064 -0.0047 -0.0104 2111 GLN 131 CB -0.0028 -0.0104 -0.0138 2112 GLN 131 CG -0.0031 -0.0123 -0.0166 2113 GLN 131 CD -0.0009 -0.0144 -0.0169 2114 GLN 131 NE2 -0.0011 -0.0161 -0.0193 2115 GLN 131 OE1 0.0009 -0.0144 -0.0149 2116 CYS 132 N -0.0029 -0.0063 -0.0087 2117 CYS 132 CA -0.0030 -0.0042 -0.0060 2118 CYS 132 C -0.0054 -0.0021 -0.0060 2119 CYS 132 O -0.0066 -0.0002 -0.0049 2120 CYS 132 CB -0.0007 -0.0046 -0.0040 2121 CYS 132 SG 0.0023 -0.0065 -0.0031 2122 LEU 133 N -0.0032 -0.0023 -0.0087 2123 LEU 133 CA -0.0047 -0.0008 -0.0090 2124 LEU 133 C -0.0056 -0.0008 -0.0095 2125 LEU 133 O -0.0061 0.0007 -0.0093 2126 LEU 133 CB -0.0060 -0.0010 -0.0098 2127 LEU 133 CG -0.0078 0.0004 -0.0103 2128 LEU 133 CD1 -0.0074 0.0024 -0.0095 2129 LEU 133 CD2 -0.0090 -0.0001 -0.0111 2130 GLN 134 N -0.0059 -0.0026 -0.0102 2131 GLN 134 CA -0.0068 -0.0027 -0.0107 2132 GLN 134 C -0.0057 -0.0020 -0.0099 2133 GLN 134 O -0.0064 -0.0009 -0.0100 2134 GLN 134 CB -0.0071 -0.0048 -0.0116 2135 GLN 134 CG -0.0088 -0.0053 -0.0127 2136 GLN 134 CD -0.0105 -0.0040 -0.0132 2137 GLN 134 NE2 -0.0118 -0.0037 -0.0138 2138 GLN 134 OE1 -0.0106 -0.0033 -0.0130 2139 PHE 135 N -0.0050 -0.0028 -0.0075 2140 PHE 135 CA -0.0050 -0.0014 -0.0057 2141 PHE 135 C -0.0053 0.0004 -0.0044 2142 PHE 135 O -0.0060 0.0023 -0.0038 2143 PHE 135 CB -0.0037 -0.0029 -0.0040 2144 PHE 135 CG -0.0034 -0.0017 -0.0018 2145 PHE 135 CD1 -0.0043 -0.0000 -0.0020 2146 PHE 135 CD2 -0.0024 -0.0022 0.0003 2147 PHE 135 CE1 -0.0040 0.0011 0.0000 2148 PHE 135 CE2 -0.0022 -0.0010 0.0023 2149 PHE 135 CZ -0.0030 0.0006 0.0021 2150 MET 136 N -0.0049 -0.0002 -0.0039 2151 MET 136 CA -0.0051 0.0014 -0.0026 2152 MET 136 C -0.0065 0.0031 -0.0040 2153 MET 136 O -0.0069 0.0049 -0.0030 2154 MET 136 CB -0.0042 0.0000 -0.0016 2155 MET 136 CG -0.0029 -0.0010 0.0005 2156 MET 136 SD -0.0027 0.0007 0.0032 2157 MET 136 CE -0.0034 0.0020 0.0028 2158 ILE 137 N -0.0032 0.0021 -0.0060 2159 ILE 137 CA -0.0044 0.0022 -0.0059 2160 ILE 137 C -0.0042 0.0013 -0.0059 2161 ILE 137 O -0.0044 0.0018 -0.0059 2162 ILE 137 CB -0.0057 0.0019 -0.0057 2163 ILE 137 CG1 -0.0062 0.0031 -0.0056 2164 ILE 137 CG2 -0.0068 0.0014 -0.0056 2165 ILE 137 CD1 -0.0074 0.0028 -0.0055 2166 ASP 138 N -0.0038 0.0000 -0.0061 2167 ASP 138 CA -0.0038 -0.0009 -0.0061 2168 ASP 138 C -0.0027 -0.0006 -0.0062 2169 ASP 138 O -0.0027 -0.0012 -0.0063 2170 ASP 138 CB -0.0036 -0.0024 -0.0062 2171 ASP 138 CG -0.0048 -0.0029 -0.0061 2172 ASP 138 OD1 -0.0058 -0.0022 -0.0060 2173 ASP 138 OD2 -0.0048 -0.0041 -0.0062 2174 ILE 139 N 0.0001 -0.0047 -0.0023 2175 ILE 139 CA 0.0013 -0.0050 -0.0034 2176 ILE 139 C 0.0014 -0.0042 -0.0041 2177 ILE 139 O 0.0024 -0.0041 -0.0052 2178 ILE 139 CB 0.0019 -0.0048 -0.0042 2179 ILE 139 CG1 0.0015 -0.0032 -0.0049 2180 ILE 139 CG2 0.0017 -0.0055 -0.0035 2181 ILE 139 CD1 0.0023 -0.0029 -0.0061 2182 ASP 140 N 0.0005 -0.0036 -0.0036 2183 ASP 140 CA 0.0006 -0.0029 -0.0042 2184 ASP 140 C 0.0014 -0.0039 -0.0044 2185 ASP 140 O 0.0013 -0.0049 -0.0035 2186 ASP 140 CB -0.0007 -0.0021 -0.0035 2187 ASP 140 CG -0.0008 -0.0010 -0.0042 2188 ASP 140 OD1 0.0001 -0.0008 -0.0053 2189 ASP 140 OD2 -0.0018 -0.0002 -0.0038 2190 PRO 141 N 0.0056 -0.0066 -0.0012 2191 PRO 141 CA 0.0110 -0.0082 -0.0020 2192 PRO 141 C 0.0111 -0.0085 -0.0017 2193 PRO 141 O 0.0150 -0.0106 -0.0005 2194 PRO 141 CB 0.0133 -0.0066 -0.0074 2195 PRO 141 CG 0.0100 -0.0047 -0.0085 2196 PRO 141 CD 0.0050 -0.0045 -0.0048 2197 ALA 142 N 0.0070 -0.0063 -0.0028 2198 ALA 142 CA 0.0067 -0.0064 -0.0024 2199 ALA 142 C 0.0052 -0.0085 0.0030 2200 ALA 142 O 0.0040 -0.0084 0.0037 2201 ALA 142 CB 0.0029 -0.0033 -0.0057 2202 ARG 143 N 0.0128 -0.0182 0.0013 2203 ARG 143 CA 0.0092 -0.0235 0.0076 2204 ARG 143 C 0.0142 -0.0312 0.0091 2205 ARG 143 O 0.0118 -0.0362 0.0143 2206 ARG 143 CB 0.0048 -0.0221 0.0100 2207 ARG 143 CG -0.0024 -0.0164 0.0114 2208 ARG 143 CD -0.0066 -0.0151 0.0137 2209 ARG 143 NE -0.0138 -0.0103 0.0158 2210 ARG 143 CZ -0.0158 -0.0032 0.0124 2211 ARG 143 NH1 -0.0112 0.0002 0.0068 2212 ARG 143 NH2 -0.0224 0.0006 0.0148 2213 SER 144 N 0.0211 -0.0324 0.0048 2214 SER 144 CA 0.0264 -0.0396 0.0057 2215 SER 144 C 0.0249 -0.0446 0.0102 2216 SER 144 O 0.0245 -0.0504 0.0145 2217 SER 144 CB 0.0271 -0.0430 0.0076 2218 SER 144 OG 0.0205 -0.0423 0.0120