1 GLY 5 N -0.0222 0.0267 0.0104 2 GLY 5 CA -0.0156 0.0263 0.0085 3 GLY 5 C -0.0143 0.0177 0.0081 4 GLY 5 O -0.0199 0.0133 0.0098 5 LEU 6 N -0.0068 0.0153 0.0059 6 LEU 6 CA -0.0045 0.0072 0.0053 7 LEU 6 C 0.0006 0.0027 0.0038 8 LEU 6 O 0.0059 0.0064 0.0022 9 LEU 6 CB -0.0001 0.0081 0.0040 10 LEU 6 CG 0.0000 0.0005 0.0040 11 LEU 6 CD1 -0.0082 -0.0031 0.0065 12 LEU 6 CD2 0.0032 0.0027 0.0030 13 TYR 7 N -0.0022 -0.0002 -0.0009 14 TYR 7 CA -0.0009 -0.0024 -0.0008 15 TYR 7 C -0.0006 -0.0042 -0.0009 16 TYR 7 O -0.0020 -0.0043 -0.0011 17 TYR 7 CB -0.0022 -0.0035 -0.0011 18 TYR 7 CG -0.0020 -0.0021 -0.0010 19 TYR 7 CD1 -0.0033 -0.0000 -0.0010 20 TYR 7 CD2 -0.0004 -0.0030 -0.0008 21 TYR 7 CE1 -0.0031 0.0013 -0.0009 22 TYR 7 CE2 -0.0002 -0.0017 -0.0007 23 TYR 7 CZ -0.0016 0.0004 -0.0007 24 TYR 7 OH -0.0014 0.0017 -0.0006 25 ARG 8 N 0.0013 -0.0058 -0.0007 26 ARG 8 CA 0.0018 -0.0077 -0.0008 27 ARG 8 C 0.0021 -0.0101 -0.0009 28 ARG 8 O 0.0036 -0.0103 -0.0007 29 ARG 8 CB 0.0041 -0.0072 -0.0004 30 ARG 8 CG 0.0047 -0.0091 -0.0005 31 ARG 8 CD 0.0072 -0.0088 -0.0001 32 ARG 8 NE 0.0073 -0.0066 0.0001 33 ARG 8 CZ 0.0091 -0.0050 0.0004 34 ARG 8 NH1 0.0109 -0.0052 0.0007 35 ARG 8 NH2 0.0090 -0.0030 0.0005 36 MET 9 N 0.0025 -0.0037 -0.0042 37 MET 9 CA 0.0019 -0.0032 -0.0033 38 MET 9 C 0.0024 -0.0025 -0.0024 39 MET 9 O 0.0035 -0.0022 -0.0023 40 MET 9 CB 0.0021 -0.0032 -0.0033 41 MET 9 CG 0.0022 -0.0025 -0.0023 42 MET 9 SD 0.0023 -0.0025 -0.0023 43 MET 9 CE 0.0010 -0.0031 -0.0027 44 THR 10 N 0.0016 -0.0023 -0.0016 45 THR 10 CA 0.0020 -0.0016 -0.0007 46 THR 10 C 0.0014 -0.0012 0.0002 47 THR 10 O 0.0003 -0.0014 0.0002 48 THR 10 CB 0.0018 -0.0016 -0.0006 49 THR 10 CG2 0.0005 -0.0019 -0.0007 50 THR 10 OG1 0.0020 -0.0009 0.0004 51 TYR 11 N -0.0009 0.0029 0.0000 52 TYR 11 CA -0.0005 0.0024 -0.0008 53 TYR 11 C -0.0011 0.0016 -0.0017 54 TYR 11 O -0.0019 0.0015 -0.0017 55 TYR 11 CB -0.0007 0.0025 -0.0006 56 TYR 11 CG -0.0020 0.0022 -0.0008 57 TYR 11 CD1 -0.0029 0.0026 -0.0001 58 TYR 11 CD2 -0.0022 0.0015 -0.0017 59 TYR 11 CE1 -0.0041 0.0023 -0.0002 60 TYR 11 CE2 -0.0034 0.0012 -0.0018 61 TYR 11 CZ -0.0043 0.0016 -0.0011 62 TYR 11 OH -0.0055 0.0014 -0.0013 63 ILE 12 N -0.0006 0.0010 -0.0026 64 ILE 12 CA -0.0010 0.0002 -0.0035 65 ILE 12 C -0.0012 -0.0003 -0.0041 66 ILE 12 O -0.0009 -0.0000 -0.0038 67 ILE 12 CB -0.0001 -0.0002 -0.0041 68 ILE 12 CG1 0.0011 -0.0002 -0.0044 69 ILE 12 CG2 0.0001 0.0003 -0.0036 70 ILE 12 CD1 0.0021 -0.0003 -0.0047 71 SER 13 N -0.0092 -0.0024 -0.0116 72 SER 13 CA -0.0094 -0.0034 -0.0138 73 SER 13 C -0.0098 -0.0033 -0.0145 74 SER 13 O -0.0103 -0.0020 -0.0136 75 SER 13 CB -0.0105 -0.0027 -0.0153 76 SER 13 OG -0.0118 -0.0014 -0.0164 77 ARG 14 N -0.0096 -0.0045 -0.0163 78 ARG 14 CA -0.0099 -0.0046 -0.0172 79 ARG 14 C -0.0112 -0.0040 -0.0193 80 ARG 14 O -0.0112 -0.0048 -0.0208 81 ARG 14 CB -0.0086 -0.0066 -0.0175 82 ARG 14 CG -0.0073 -0.0073 -0.0155 83 ARG 14 CD -0.0062 -0.0090 -0.0157 84 ARG 14 NE -0.0049 -0.0098 -0.0138 85 ARG 14 CZ -0.0046 -0.0092 -0.0122 86 ARG 14 NH1 -0.0056 -0.0079 -0.0123 87 ARG 14 NH2 -0.0034 -0.0100 -0.0105 88 ALA 15 N -0.0105 -0.0026 -0.0195 89 ALA 15 CA -0.0091 -0.0024 -0.0190 90 ALA 15 C -0.0100 -0.0034 -0.0153 91 ALA 15 O -0.0106 -0.0041 -0.0128 92 ALA 15 CB -0.0051 -0.0015 -0.0194 93 VAL 16 N -0.0100 -0.0035 -0.0151 94 VAL 16 CA -0.0107 -0.0044 -0.0118 95 VAL 16 C -0.0075 -0.0043 -0.0092 96 VAL 16 O -0.0045 -0.0034 -0.0103 97 VAL 16 CB -0.0114 -0.0044 -0.0125 98 VAL 16 CG1 -0.0151 -0.0048 -0.0141 99 VAL 16 CG2 -0.0086 -0.0033 -0.0148 100 PRO 17 N -0.0090 0.0032 0.0022 101 PRO 17 CA -0.0049 0.0046 0.0065 102 PRO 17 C 0.0028 0.0048 0.0069 103 PRO 17 O 0.0072 0.0051 0.0075 104 PRO 17 CB -0.0085 0.0067 0.0133 105 PRO 17 CG -0.0134 0.0065 0.0130 106 PRO 17 CD -0.0147 0.0042 0.0059 107 GLY 18 N 0.0045 0.0048 0.0066 108 GLY 18 CA 0.0116 0.0052 0.0076 109 GLY 18 C 0.0161 0.0033 0.0015 110 GLY 18 O 0.0216 0.0035 0.0016 111 LEU 19 N 0.0054 -0.0099 0.0058 112 LEU 19 CA 0.0055 -0.0076 0.0045 113 LEU 19 C 0.0072 -0.0069 0.0047 114 LEU 19 O 0.0091 -0.0077 0.0059 115 LEU 19 CB 0.0064 -0.0061 0.0039 116 LEU 19 CG 0.0060 -0.0036 0.0024 117 LEU 19 CD1 0.0035 -0.0035 0.0013 118 LEU 19 CD2 0.0079 -0.0021 0.0023 119 GLY 20 N 0.0066 -0.0054 0.0036 120 GLY 20 CA 0.0081 -0.0046 0.0038 121 GLY 20 C 0.0085 -0.0021 0.0025 122 GLY 20 O 0.0080 -0.0009 0.0016 123 TYR 21 N -0.0107 0.0157 0.0163 124 TYR 21 CA -0.0101 0.0123 0.0155 125 TYR 21 C -0.0060 0.0100 0.0141 126 TYR 21 O -0.0058 0.0062 0.0134 127 TYR 21 CB -0.0101 0.0142 0.0159 128 TYR 21 CG -0.0144 0.0155 0.0172 129 TYR 21 CD1 -0.0159 0.0195 0.0183 130 TYR 21 CD2 -0.0170 0.0126 0.0173 131 TYR 21 CE1 -0.0199 0.0206 0.0195 132 TYR 21 CE2 -0.0210 0.0137 0.0184 133 TYR 21 CZ -0.0224 0.0178 0.0195 134 TYR 21 OH -0.0263 0.0189 0.0207 135 ASN 22 N -0.0027 0.0123 0.0138 136 ASN 22 CA 0.0014 0.0104 0.0125 137 ASN 22 C 0.0010 0.0069 0.0119 138 ASN 22 O 0.0025 0.0034 0.0109 139 ASN 22 CB 0.0047 0.0138 0.0124 140 ASN 22 CG 0.0054 0.0173 0.0129 141 ASN 22 ND2 0.0070 0.0211 0.0132 142 ASN 22 OD1 0.0044 0.0167 0.0130 143 ASP 23 N -0.0019 -0.0039 0.0101 144 ASP 23 CA -0.0000 -0.0040 0.0113 145 ASP 23 C 0.0007 -0.0028 0.0138 146 ASP 23 O 0.0011 -0.0021 0.0152 147 ASP 23 CB 0.0022 -0.0056 0.0102 148 ASP 23 CG 0.0018 -0.0069 0.0079 149 ASP 23 OD1 0.0018 -0.0070 0.0078 150 ASP 23 OD2 0.0014 -0.0078 0.0062 151 LEU 24 N 0.0008 -0.0024 0.0144 152 LEU 24 CA 0.0014 -0.0013 0.0167 153 LEU 24 C -0.0004 0.0003 0.0180 154 LEU 24 O 0.0003 0.0012 0.0199 155 LEU 24 CB 0.0016 -0.0012 0.0169 156 LEU 24 CG 0.0039 -0.0025 0.0165 157 LEU 24 CD1 0.0038 -0.0025 0.0165 158 LEU 24 CD2 0.0061 -0.0024 0.0182 159 ARG 25 N 0.0023 0.0039 0.0220 160 ARG 25 CA 0.0014 0.0087 0.0192 161 ARG 25 C -0.0016 0.0075 0.0147 162 ARG 25 O -0.0021 0.0105 0.0130 163 ARG 25 CB 0.0015 0.0124 0.0182 164 ARG 25 CG -0.0007 0.0102 0.0154 165 ARG 25 CD -0.0008 0.0145 0.0139 166 ARG 25 NE -0.0010 0.0125 0.0141 167 ARG 25 CZ 0.0009 0.0143 0.0167 168 ARG 25 NH1 0.0033 0.0180 0.0194 169 ARG 25 NH2 0.0004 0.0122 0.0166 170 ASP 26 N -0.0036 0.0033 0.0128 171 ASP 26 CA -0.0065 0.0017 0.0088 172 ASP 26 C -0.0060 0.0003 0.0099 173 ASP 26 O -0.0073 0.0020 0.0073 174 ASP 26 CB -0.0085 -0.0030 0.0069 175 ASP 26 CG -0.0116 -0.0045 0.0025 176 ASP 26 OD1 -0.0129 -0.0009 -0.0007 177 ASP 26 OD2 -0.0127 -0.0093 0.0022 178 ILE 27 N -0.0047 -0.0027 0.0113 179 ILE 27 CA -0.0034 0.0010 0.0102 180 ILE 27 C -0.0015 0.0044 0.0089 181 ILE 27 O -0.0025 0.0083 0.0083 182 ILE 27 CB -0.0003 -0.0006 0.0097 183 ILE 27 CG1 -0.0025 -0.0037 0.0110 184 ILE 27 CG2 0.0014 0.0032 0.0084 185 ILE 27 CD1 0.0007 -0.0069 0.0108 186 MET 28 N 0.0013 0.0030 0.0085 187 MET 28 CA 0.0034 0.0060 0.0072 188 MET 28 C 0.0001 0.0087 0.0075 189 MET 28 O 0.0003 0.0127 0.0065 190 MET 28 CB 0.0068 0.0035 0.0069 191 MET 28 CG 0.0100 0.0061 0.0054 192 MET 28 SD 0.0081 0.0104 0.0050 193 MET 28 CE 0.0052 0.0073 0.0064 194 GLY 29 N 0.0026 0.0123 0.0070 195 GLY 29 CA -0.0026 0.0165 0.0060 196 GLY 29 C -0.0062 0.0192 0.0054 197 GLY 29 O -0.0076 0.0250 0.0047 198 LYS 30 N -0.0080 0.0150 0.0056 199 LYS 30 CA -0.0114 0.0172 0.0050 200 LYS 30 C -0.0074 0.0220 0.0050 201 LYS 30 O -0.0099 0.0269 0.0042 202 LYS 30 CB -0.0134 0.0115 0.0053 203 LYS 30 CG -0.0187 0.0072 0.0051 204 LYS 30 CD -0.0202 0.0015 0.0054 205 LYS 30 CE -0.0254 -0.0028 0.0052 206 LYS 30 NZ -0.0267 -0.0085 0.0056 207 SER 31 N -0.0059 0.0157 0.0076 208 SER 31 CA -0.0050 0.0187 0.0039 209 SER 31 C -0.0037 0.0189 0.0019 210 SER 31 O -0.0047 0.0222 0.0004 211 SER 31 CB -0.0026 0.0177 0.0015 212 SER 31 OG 0.0003 0.0141 0.0007 213 GLU 32 N -0.0016 0.0155 0.0020 214 GLU 32 CA -0.0003 0.0156 0.0002 215 GLU 32 C -0.0029 0.0175 0.0020 216 GLU 32 O -0.0031 0.0202 -0.0000 217 GLU 32 CB 0.0022 0.0114 0.0005 218 GLU 32 CG 0.0055 0.0107 -0.0034 219 GLU 32 CD 0.0081 0.0064 -0.0030 220 GLU 32 OE1 0.0073 0.0038 0.0001 221 GLU 32 OE2 0.0108 0.0054 -0.0059 222 VAL 33 N -0.0087 0.0246 0.0000 223 VAL 33 CA -0.0076 0.0241 0.0012 224 VAL 33 C -0.0067 0.0243 0.0017 225 VAL 33 O -0.0065 0.0233 0.0025 226 VAL 33 CB -0.0067 0.0248 0.0015 227 VAL 33 CG1 -0.0053 0.0246 0.0026 228 VAL 33 CG2 -0.0073 0.0241 0.0014 229 ASN 34 N -0.0063 0.0256 0.0011 230 ASN 34 CA -0.0055 0.0260 0.0016 231 ASN 34 C -0.0062 0.0251 0.0016 232 ASN 34 O -0.0056 0.0246 0.0024 233 ASN 34 CB -0.0050 0.0275 0.0009 234 ASN 34 CG -0.0040 0.0284 0.0010 235 ASN 34 ND2 -0.0045 0.0287 0.0004 236 ASN 34 OD1 -0.0028 0.0287 0.0018 237 ASN 35 N -0.0072 0.0149 -0.0015 238 ASN 35 CA -0.0078 0.0137 0.0003 239 ASN 35 C -0.0082 0.0140 0.0007 240 ASN 35 O -0.0083 0.0127 0.0018 241 ASN 35 CB -0.0089 0.0142 0.0019 242 ASN 35 CG -0.0086 0.0134 0.0017 243 ASN 35 ND2 -0.0090 0.0122 0.0033 244 ASN 35 OD1 -0.0078 0.0138 0.0002 245 SER 36 N -0.0084 0.0158 -0.0000 246 SER 36 CA -0.0086 0.0161 0.0000 247 SER 36 C -0.0074 0.0146 -0.0010 248 SER 36 O -0.0074 0.0137 -0.0004 249 SER 36 CB -0.0089 0.0183 -0.0007 250 SER 36 OG -0.0079 0.0186 -0.0027 251 HIS 37 N -0.0075 0.0103 -0.0010 252 HIS 37 CA 0.0008 0.0077 0.0037 253 HIS 37 C -0.0014 0.0062 0.0028 254 HIS 37 O 0.0016 -0.0011 0.0055 255 HIS 37 CB 0.0088 0.0160 0.0064 256 HIS 37 CG 0.0164 0.0156 0.0104 257 HIS 37 CD2 0.0207 0.0231 0.0113 258 HIS 37 ND1 0.0206 0.0066 0.0140 259 HIS 37 CE1 0.0271 0.0086 0.0170 260 HIS 37 NE2 0.0273 0.0185 0.0154 261 VAL 38 N -0.0065 0.0131 -0.0009 262 VAL 38 CA -0.0083 0.0125 -0.0018 263 VAL 38 C -0.0169 0.0053 -0.0050 264 VAL 38 O -0.0170 0.0004 -0.0042 265 VAL 38 CB -0.0094 0.0232 -0.0041 266 VAL 38 CG1 -0.0075 0.0230 -0.0031 267 VAL 38 CG2 -0.0027 0.0313 -0.0020 268 GLY 39 N -0.0123 0.0072 -0.0053 269 GLY 39 CA -0.0112 0.0080 -0.0053 270 GLY 39 C -0.0105 0.0074 -0.0042 271 GLY 39 O -0.0103 0.0077 -0.0044 272 LEU 40 N -0.0103 0.0063 -0.0031 273 LEU 40 CA -0.0096 0.0056 -0.0019 274 LEU 40 C -0.0081 0.0059 -0.0011 275 LEU 40 O -0.0078 0.0060 -0.0010 276 LEU 40 CB -0.0105 0.0041 -0.0011 277 LEU 40 CG -0.0121 0.0036 -0.0018 278 LEU 40 CD1 -0.0130 0.0023 -0.0012 279 LEU 40 CD2 -0.0122 0.0036 -0.0019 280 THR 41 N -0.0005 -0.0010 0.0034 281 THR 41 CA 0.0011 -0.0024 0.0030 282 THR 41 C 0.0017 -0.0031 0.0030 283 THR 41 O 0.0009 -0.0023 0.0032 284 THR 41 CB 0.0025 -0.0018 0.0016 285 THR 41 CG2 0.0019 -0.0012 0.0016 286 THR 41 OG1 0.0026 -0.0003 0.0005 287 GLY 42 N 0.0032 -0.0045 0.0029 288 GLY 42 CA 0.0038 -0.0051 0.0028 289 GLY 42 C 0.0048 -0.0071 0.0034 290 GLY 42 O 0.0053 -0.0079 0.0036 291 LEU 43 N 0.0062 -0.0056 0.0021 292 LEU 43 CA 0.0055 -0.0057 0.0012 293 LEU 43 C 0.0059 -0.0046 0.0003 294 LEU 43 O 0.0065 -0.0038 0.0000 295 LEU 43 CB 0.0045 -0.0063 0.0005 296 LEU 43 CG 0.0036 -0.0066 -0.0005 297 LEU 43 CD1 0.0033 -0.0073 0.0001 298 LEU 43 CD2 0.0027 -0.0072 -0.0011 299 LEU 44 N 0.0057 -0.0046 -0.0001 300 LEU 44 CA 0.0061 -0.0036 -0.0009 301 LEU 44 C 0.0053 -0.0037 -0.0020 302 LEU 44 O 0.0046 -0.0045 -0.0020 303 LEU 44 CB 0.0068 -0.0032 -0.0002 304 LEU 44 CG 0.0071 -0.0024 -0.0010 305 LEU 44 CD1 0.0077 -0.0013 -0.0016 306 LEU 44 CD2 0.0078 -0.0023 -0.0002 307 CYS 45 N 0.0003 0.0009 -0.0062 308 CYS 45 CA -0.0006 0.0016 -0.0067 309 CYS 45 C 0.0001 0.0017 -0.0080 310 CYS 45 O 0.0012 0.0011 -0.0082 311 CYS 45 CB -0.0010 0.0014 -0.0056 312 CYS 45 SG -0.0018 0.0021 -0.0063 313 PHE 46 N -0.0007 0.0025 -0.0090 314 PHE 46 CA -0.0002 0.0027 -0.0103 315 PHE 46 C -0.0009 0.0032 -0.0105 316 PHE 46 O -0.0021 0.0038 -0.0101 317 PHE 46 CB -0.0003 0.0032 -0.0114 318 PHE 46 CG 0.0002 0.0034 -0.0128 319 PHE 46 CD1 0.0014 0.0029 -0.0131 320 PHE 46 CD2 -0.0005 0.0042 -0.0139 321 PHE 46 CE1 0.0018 0.0031 -0.0144 322 PHE 46 CE2 -0.0000 0.0045 -0.0152 323 PHE 46 CZ 0.0011 0.0039 -0.0154 324 GLY 47 N -0.0072 0.0041 -0.0118 325 GLY 47 CA -0.0072 0.0037 -0.0128 326 GLY 47 C -0.0047 0.0020 -0.0142 327 GLY 47 O -0.0024 0.0013 -0.0134 328 ASN 48 N -0.0050 0.0014 -0.0163 329 ASN 48 CA -0.0028 -0.0002 -0.0179 330 ASN 48 C -0.0015 -0.0012 -0.0192 331 ASN 48 O 0.0011 -0.0024 -0.0192 332 ASN 48 CB -0.0006 -0.0005 -0.0161 333 ASN 48 CG 0.0010 -0.0018 -0.0179 334 ASN 48 ND2 0.0036 -0.0027 -0.0169 335 ASN 48 OD1 -0.0001 -0.0021 -0.0201 336 SER 49 N -0.0044 0.0011 -0.0166 337 SER 49 CA -0.0043 0.0003 -0.0176 338 SER 49 C -0.0039 -0.0004 -0.0172 339 SER 49 O -0.0036 -0.0015 -0.0176 340 SER 49 CB -0.0041 -0.0005 -0.0183 341 SER 49 OG -0.0046 -0.0000 -0.0193 342 ILE 50 N -0.0040 0.0002 -0.0163 343 ILE 50 CA -0.0036 -0.0004 -0.0158 344 ILE 50 C -0.0040 0.0005 -0.0157 345 ILE 50 O -0.0043 0.0015 -0.0153 346 ILE 50 CB -0.0031 -0.0009 -0.0145 347 ILE 50 CG1 -0.0026 -0.0022 -0.0146 348 ILE 50 CG2 -0.0029 -0.0009 -0.0137 349 ILE 50 CD1 -0.0021 -0.0026 -0.0134 350 PHE 51 N -0.0013 0.0023 -0.0113 351 PHE 51 CA -0.0017 0.0024 -0.0105 352 PHE 51 C -0.0013 0.0015 -0.0087 353 PHE 51 O -0.0002 0.0004 -0.0085 354 PHE 51 CB -0.0011 0.0021 -0.0116 355 PHE 51 CG -0.0017 0.0031 -0.0132 356 PHE 51 CD1 -0.0029 0.0043 -0.0131 357 PHE 51 CD2 -0.0010 0.0029 -0.0149 358 PHE 51 CE1 -0.0034 0.0052 -0.0145 359 PHE 51 CE2 -0.0015 0.0038 -0.0164 360 PHE 51 CZ -0.0027 0.0049 -0.0162 361 LEU 52 N -0.0020 0.0020 -0.0074 362 LEU 52 CA -0.0017 0.0011 -0.0057 363 LEU 52 C -0.0021 0.0014 -0.0052 364 LEU 52 O -0.0032 0.0025 -0.0050 365 LEU 52 CB -0.0023 0.0014 -0.0043 366 LEU 52 CG -0.0024 0.0010 -0.0024 367 LEU 52 CD1 -0.0011 -0.0005 -0.0018 368 LEU 52 CD2 -0.0034 0.0016 -0.0012 369 GLN 53 N 0.0033 -0.0011 -0.0017 370 GLN 53 CA 0.0033 -0.0016 -0.0010 371 GLN 53 C 0.0035 -0.0021 -0.0004 372 GLN 53 O 0.0040 -0.0019 -0.0004 373 GLN 53 CB 0.0040 -0.0015 -0.0009 374 GLN 53 CG 0.0042 -0.0021 -0.0001 375 GLN 53 CD 0.0047 -0.0020 -0.0001 376 GLN 53 NE2 0.0045 -0.0024 0.0004 377 GLN 53 OE1 0.0053 -0.0015 -0.0004 378 ILE 54 N 0.0031 -0.0026 0.0001 379 ILE 54 CA 0.0032 -0.0031 0.0007 380 ILE 54 C 0.0035 -0.0035 0.0014 381 ILE 54 O 0.0031 -0.0037 0.0015 382 ILE 54 CB 0.0024 -0.0034 0.0008 383 ILE 54 CG1 0.0025 -0.0040 0.0015 384 ILE 54 CG2 0.0016 -0.0035 0.0006 385 ILE 54 CD1 0.0017 -0.0042 0.0016 386 LEU 55 N -0.0001 -0.0037 0.0006 387 LEU 55 CA -0.0000 -0.0039 0.0012 388 LEU 55 C 0.0000 -0.0038 0.0013 389 LEU 55 O 0.0002 -0.0035 0.0010 390 LEU 55 CB 0.0003 -0.0035 0.0016 391 LEU 55 CG 0.0003 -0.0035 0.0017 392 LEU 55 CD1 0.0005 -0.0030 0.0016 393 LEU 55 CD2 0.0003 -0.0038 0.0023 394 GLU 56 N -0.0001 -0.0042 0.0018 395 GLU 56 CA -0.0000 -0.0042 0.0019 396 GLU 56 C 0.0001 -0.0043 0.0026 397 GLU 56 O -0.0000 -0.0046 0.0029 398 GLU 56 CB -0.0003 -0.0046 0.0016 399 GLU 56 CG -0.0004 -0.0046 0.0010 400 GLU 56 CD -0.0006 -0.0049 0.0007 401 GLU 56 OE1 -0.0008 -0.0053 0.0010 402 GLU 56 OE2 -0.0007 -0.0047 0.0002 403 GLY 57 N -0.0096 -0.0016 -0.0006 404 GLY 57 CA -0.0127 0.0003 -0.0027 405 GLY 57 C -0.0131 -0.0004 -0.0029 406 GLY 57 O -0.0105 -0.0013 -0.0012 407 SER 58 N -0.0162 0.0001 -0.0050 408 SER 58 CA -0.0169 -0.0006 -0.0055 409 SER 58 C -0.0168 -0.0052 -0.0056 410 SER 58 O -0.0173 -0.0079 -0.0060 411 SER 58 CB -0.0204 0.0013 -0.0078 412 SER 58 OG -0.0231 -0.0010 -0.0097 413 ARG 59 N -0.0126 -0.0113 -0.0128 414 ARG 59 CA -0.0126 -0.0112 -0.0128 415 ARG 59 C -0.0109 -0.0102 -0.0143 416 ARG 59 O -0.0110 -0.0086 -0.0143 417 ARG 59 CB -0.0127 -0.0137 -0.0124 418 ARG 59 CG -0.0134 -0.0138 -0.0119 419 ARG 59 CD -0.0139 -0.0162 -0.0113 420 ARG 59 NE -0.0123 -0.0178 -0.0124 421 ARG 59 CZ -0.0123 -0.0201 -0.0121 422 ARG 59 NH1 -0.0139 -0.0211 -0.0108 423 ARG 59 NH2 -0.0107 -0.0214 -0.0132 424 GLN 60 N -0.0092 -0.0110 -0.0154 425 GLN 60 CA -0.0075 -0.0103 -0.0168 426 GLN 60 C -0.0073 -0.0077 -0.0173 427 GLN 60 O -0.0067 -0.0064 -0.0179 428 GLN 60 CB -0.0059 -0.0118 -0.0179 429 GLN 60 CG -0.0040 -0.0113 -0.0194 430 GLN 60 CD -0.0030 -0.0096 -0.0204 431 GLN 60 NE2 -0.0020 -0.0105 -0.0211 432 GLN 60 OE1 -0.0030 -0.0075 -0.0206 433 ALA 61 N -0.0053 -0.0068 -0.0098 434 ALA 61 CA -0.0046 -0.0050 -0.0097 435 ALA 61 C -0.0053 -0.0041 -0.0083 436 ALA 61 O -0.0049 -0.0030 -0.0083 437 ALA 61 CB -0.0042 -0.0043 -0.0098 438 ILE 62 N -0.0064 -0.0045 -0.0071 439 ILE 62 CA -0.0072 -0.0037 -0.0058 440 ILE 62 C -0.0073 -0.0041 -0.0058 441 ILE 62 O -0.0072 -0.0030 -0.0054 442 ILE 62 CB -0.0083 -0.0043 -0.0045 443 ILE 62 CG1 -0.0083 -0.0037 -0.0043 444 ILE 62 CG2 -0.0091 -0.0036 -0.0031 445 ILE 62 CD1 -0.0092 -0.0049 -0.0036 446 SER 63 N -0.0063 -0.0051 -0.0081 447 SER 63 CA -0.0077 -0.0050 -0.0071 448 SER 63 C -0.0035 -0.0021 -0.0079 449 SER 63 O -0.0040 0.0006 -0.0054 450 SER 63 CB -0.0097 -0.0099 -0.0094 451 SER 63 OG -0.0135 -0.0126 -0.0087 452 HIS 64 N 0.0006 -0.0026 -0.0112 453 HIS 64 CA 0.0047 0.0000 -0.0121 454 HIS 64 C 0.0063 0.0051 -0.0094 455 HIS 64 O 0.0077 0.0080 -0.0082 456 HIS 64 CB 0.0086 -0.0018 -0.0164 457 HIS 64 CG 0.0134 0.0015 -0.0173 458 HIS 64 CD2 0.0171 0.0034 -0.0186 459 HIS 64 ND1 0.0147 0.0031 -0.0170 460 HIS 64 CE1 0.0191 0.0059 -0.0181 461 HIS 64 NE2 0.0206 0.0061 -0.0190 462 THR 65 N 0.0019 0.0082 -0.0012 463 THR 65 CA 0.0022 0.0107 -0.0002 464 THR 65 C 0.0013 0.0106 0.0018 465 THR 65 O 0.0017 0.0120 0.0019 466 THR 65 CB 0.0021 0.0122 0.0009 467 THR 65 CG2 0.0019 0.0143 0.0028 468 THR 65 OG1 0.0033 0.0133 -0.0010 469 TYR 66 N 0.0001 0.0088 0.0033 470 TYR 66 CA -0.0008 0.0084 0.0050 471 TYR 66 C -0.0005 0.0076 0.0037 472 TYR 66 O -0.0006 0.0084 0.0046 473 TYR 66 CB -0.0021 0.0065 0.0067 474 TYR 66 CG -0.0031 0.0062 0.0088 475 TYR 66 CD1 -0.0032 0.0083 0.0104 476 TYR 66 CD2 -0.0040 0.0039 0.0091 477 TYR 66 CE1 -0.0041 0.0080 0.0122 478 TYR 66 CE2 -0.0049 0.0036 0.0110 479 TYR 66 CZ -0.0050 0.0057 0.0126 480 TYR 66 OH -0.0059 0.0054 0.0144 481 HIS 67 N 0.0008 0.0097 0.0075 482 HIS 67 CA 0.0027 0.0091 0.0051 483 HIS 67 C 0.0060 0.0145 0.0034 484 HIS 67 O 0.0064 0.0164 0.0038 485 HIS 67 CB 0.0042 0.0040 0.0010 486 HIS 67 CG 0.0069 0.0037 -0.0023 487 HIS 67 CD2 0.0067 0.0047 -0.0016 488 HIS 67 ND1 0.0103 0.0022 -0.0070 489 HIS 67 CE1 0.0121 0.0024 -0.0091 490 HIS 67 NE2 0.0099 0.0039 -0.0059 491 ARG 68 N 0.0085 0.0169 0.0015 492 ARG 68 CA 0.0117 0.0222 0.0000 493 ARG 68 C 0.0100 0.0271 0.0041 494 ARG 68 O 0.0116 0.0307 0.0038 495 ARG 68 CB 0.0145 0.0237 -0.0027 496 ARG 68 CG 0.0179 0.0212 -0.0078 497 ARG 68 CD 0.0203 0.0224 -0.0101 498 ARG 68 NE 0.0202 0.0276 -0.0076 499 ARG 68 CZ 0.0198 0.0283 -0.0069 500 ARG 68 NH1 0.0194 0.0241 -0.0083 501 ARG 68 NH2 0.0197 0.0333 -0.0046 502 ILE 69 N 0.0047 0.0165 0.0100 503 ILE 69 CA 0.0032 0.0186 0.0104 504 ILE 69 C 0.0037 0.0187 0.0099 505 ILE 69 O 0.0033 0.0208 0.0091 506 ILE 69 CB 0.0011 0.0184 0.0128 507 ILE 69 CG1 0.0002 0.0196 0.0131 508 ILE 69 CG2 -0.0004 0.0196 0.0136 509 ILE 69 CD1 -0.0020 0.0197 0.0153 510 LEU 70 N 0.0045 0.0165 0.0103 511 LEU 70 CA 0.0050 0.0164 0.0098 512 LEU 70 C 0.0065 0.0176 0.0075 513 LEU 70 O 0.0066 0.0184 0.0070 514 LEU 70 CB 0.0058 0.0136 0.0105 515 LEU 70 CG 0.0042 0.0125 0.0129 516 LEU 70 CD1 0.0052 0.0097 0.0134 517 LEU 70 CD2 0.0030 0.0140 0.0133 518 GLN 71 N 0.0022 0.0172 0.0009 519 GLN 71 CA 0.0037 0.0186 0.0022 520 GLN 71 C 0.0005 0.0156 -0.0000 521 GLN 71 O 0.0015 0.0165 0.0006 522 GLN 71 CB 0.0058 0.0181 0.0087 523 GLN 71 CG 0.0096 0.0216 0.0112 524 GLN 71 CD 0.0112 0.0205 0.0178 525 GLN 71 NE2 0.0137 0.0225 0.0202 526 GLN 71 OE1 0.0102 0.0179 0.0207 527 ASP 72 N -0.0033 0.0121 -0.0025 528 ASP 72 CA -0.0066 0.0092 -0.0049 529 ASP 72 C -0.0060 0.0124 -0.0102 530 ASP 72 O -0.0053 0.0150 -0.0140 531 ASP 72 CB -0.0107 0.0049 -0.0065 532 ASP 72 CG -0.0140 0.0005 -0.0056 533 ASP 72 OD1 -0.0149 0.0007 -0.0086 534 ASP 72 OD2 -0.0157 -0.0032 -0.0020 535 PRO 73 N -0.0135 0.0003 -0.0028 536 PRO 73 CA -0.0140 0.0019 -0.0024 537 PRO 73 C -0.0128 -0.0019 -0.0055 538 PRO 73 O -0.0130 -0.0012 -0.0049 539 PRO 73 CB -0.0139 0.0018 0.0040 540 PRO 73 CG -0.0127 -0.0015 0.0066 541 PRO 73 CD -0.0123 -0.0031 0.0020 542 ARG 74 N -0.0116 -0.0058 -0.0089 543 ARG 74 CA -0.0103 -0.0096 -0.0119 544 ARG 74 C -0.0111 -0.0078 -0.0179 545 ARG 74 O -0.0101 -0.0107 -0.0209 546 ARG 74 CB -0.0085 -0.0152 -0.0122 547 ARG 74 CG -0.0074 -0.0180 -0.0064 548 ARG 74 CD -0.0054 -0.0239 -0.0072 549 ARG 74 NE -0.0051 -0.0248 -0.0071 550 ARG 74 CZ -0.0049 -0.0251 -0.0023 551 ARG 74 NH1 -0.0050 -0.0246 0.0028 552 ARG 74 NH2 -0.0047 -0.0259 -0.0027 553 HIS 75 N -0.0165 0.0005 -0.0288 554 HIS 75 CA -0.0156 -0.0002 -0.0267 555 HIS 75 C -0.0159 -0.0026 -0.0267 556 HIS 75 O -0.0168 -0.0034 -0.0285 557 HIS 75 CB -0.0150 0.0017 -0.0258 558 HIS 75 CG -0.0155 0.0021 -0.0270 559 HIS 75 CD2 -0.0165 0.0013 -0.0289 560 HIS 75 ND1 -0.0150 0.0035 -0.0264 561 HIS 75 CE1 -0.0157 0.0035 -0.0278 562 HIS 75 NE2 -0.0166 0.0022 -0.0294 563 HIS 76 N -0.0151 -0.0037 -0.0249 564 HIS 76 CA -0.0153 -0.0060 -0.0247 565 HIS 76 C -0.0143 -0.0063 -0.0225 566 HIS 76 O -0.0135 -0.0048 -0.0211 567 HIS 76 CB -0.0156 -0.0079 -0.0250 568 HIS 76 CG -0.0148 -0.0080 -0.0233 569 HIS 76 CD2 -0.0144 -0.0098 -0.0220 570 HIS 76 ND1 -0.0144 -0.0060 -0.0228 571 HIS 76 CE1 -0.0138 -0.0066 -0.0213 572 HIS 76 NE2 -0.0137 -0.0089 -0.0208 573 SER 77 N -0.0088 -0.0172 -0.0134 574 SER 77 CA -0.0044 -0.0177 -0.0093 575 SER 77 C -0.0042 -0.0129 -0.0054 576 SER 77 O -0.0020 -0.0117 -0.0022 577 SER 77 CB -0.0023 -0.0200 -0.0090 578 SER 77 OG -0.0022 -0.0246 -0.0124 579 ALA 78 N -0.0066 -0.0103 -0.0057 580 ALA 78 CA -0.0065 -0.0057 -0.0022 581 ALA 78 C -0.0023 -0.0065 0.0016 582 ALA 78 O -0.0002 -0.0101 0.0010 583 ALA 78 CB -0.0101 -0.0029 -0.0037 584 GLU 79 N -0.0007 -0.0100 0.0009 585 GLU 79 CA 0.0006 -0.0089 0.0008 586 GLU 79 C 0.0008 -0.0072 0.0009 587 GLU 79 O 0.0008 -0.0071 0.0009 588 GLU 79 CB 0.0023 -0.0099 0.0006 589 GLU 79 CG 0.0024 -0.0113 0.0005 590 GLU 79 CD 0.0041 -0.0124 0.0003 591 GLU 79 OE1 0.0040 -0.0140 0.0003 592 GLU 79 OE2 0.0055 -0.0115 0.0003 593 ILE 80 N 0.0010 -0.0058 0.0009 594 ILE 80 CA 0.0013 -0.0041 0.0010 595 ILE 80 C 0.0032 -0.0038 0.0008 596 ILE 80 O 0.0042 -0.0040 0.0007 597 ILE 80 CB 0.0004 -0.0027 0.0011 598 ILE 80 CG1 -0.0015 -0.0031 0.0012 599 ILE 80 CG2 0.0006 -0.0009 0.0012 600 ILE 80 CD1 -0.0023 -0.0021 0.0013 601 ILE 81 N 0.0035 0.0027 -0.0035 602 ILE 81 CA 0.0018 0.0023 -0.0036 603 ILE 81 C 0.0017 0.0006 -0.0033 604 ILE 81 O 0.0009 0.0004 -0.0033 605 ILE 81 CB 0.0009 0.0024 -0.0037 606 ILE 81 CG1 0.0005 0.0042 -0.0040 607 ILE 81 CG2 -0.0006 0.0014 -0.0036 608 ILE 81 CD1 -0.0002 0.0044 -0.0041 609 ALA 82 N 0.0024 -0.0006 -0.0030 610 ALA 82 CA 0.0022 -0.0022 -0.0027 611 ALA 82 C 0.0036 -0.0032 -0.0024 612 ALA 82 O 0.0045 -0.0029 -0.0024 613 ALA 82 CB 0.0006 -0.0030 -0.0027 614 PHE 83 N 0.0083 -0.0140 -0.0043 615 PHE 83 CA 0.0061 -0.0121 -0.0050 616 PHE 83 C 0.0073 -0.0098 -0.0044 617 PHE 83 O 0.0078 -0.0104 -0.0042 618 PHE 83 CB 0.0040 -0.0136 -0.0061 619 PHE 83 CG 0.0018 -0.0117 -0.0070 620 PHE 83 CD1 0.0018 -0.0102 -0.0068 621 PHE 83 CD2 -0.0004 -0.0115 -0.0079 622 PHE 83 CE1 -0.0003 -0.0085 -0.0076 623 PHE 83 CE2 -0.0025 -0.0098 -0.0087 624 PHE 83 CZ -0.0024 -0.0083 -0.0085 625 ASP 84 N 0.0076 -0.0074 -0.0040 626 ASP 84 CA 0.0089 -0.0052 -0.0033 627 ASP 84 C 0.0077 -0.0023 -0.0036 628 ASP 84 O 0.0066 -0.0019 -0.0041 629 ASP 84 CB 0.0118 -0.0052 -0.0020 630 ASP 84 CG 0.0123 -0.0056 -0.0018 631 ASP 84 OD1 0.0119 -0.0080 -0.0022 632 ASP 84 OD2 0.0131 -0.0037 -0.0013 633 PRO 85 N 0.0135 0.0029 0.0025 634 PRO 85 CA 0.0116 0.0055 0.0037 635 PRO 85 C 0.0134 0.0058 0.0034 636 PRO 85 O 0.0168 0.0054 0.0026 637 PRO 85 CB 0.0121 0.0093 0.0047 638 PRO 85 CG 0.0149 0.0087 0.0040 639 PRO 85 CD 0.0163 0.0048 0.0025 640 VAL 86 N 0.0110 0.0065 0.0041 641 VAL 86 CA 0.0121 0.0066 0.0039 642 VAL 86 C 0.0106 0.0101 0.0052 643 VAL 86 O 0.0080 0.0118 0.0063 644 VAL 86 CB 0.0108 0.0030 0.0030 645 VAL 86 CG1 0.0135 -0.0000 0.0015 646 VAL 86 CG2 0.0067 0.0018 0.0035 647 LEU 87 N 0.0054 -0.0078 0.0073 648 LEU 87 CA 0.0065 -0.0108 0.0059 649 LEU 87 C 0.0098 -0.0093 0.0053 650 LEU 87 O 0.0127 -0.0111 0.0037 651 LEU 87 CB 0.0030 -0.0126 0.0066 652 LEU 87 CG 0.0028 -0.0167 0.0053 653 LEU 87 CD1 -0.0010 -0.0176 0.0063 654 LEU 87 CD2 0.0062 -0.0174 0.0040 655 GLN 88 N 0.0095 -0.0059 0.0065 656 GLN 88 CA 0.0125 -0.0042 0.0060 657 GLN 88 C 0.0130 0.0002 0.0072 658 GLN 88 O 0.0104 0.0019 0.0087 659 GLN 88 CB 0.0114 -0.0051 0.0061 660 GLN 88 CG 0.0074 -0.0041 0.0078 661 GLN 88 CD 0.0064 -0.0051 0.0078 662 GLN 88 NE2 0.0033 -0.0036 0.0094 663 GLN 88 OE1 0.0084 -0.0072 0.0065 664 ARG 89 N 0.0020 -0.0063 -0.0000 665 ARG 89 CA 0.0021 -0.0085 0.0015 666 ARG 89 C 0.0050 -0.0090 0.0022 667 ARG 89 O 0.0068 -0.0076 0.0014 668 ARG 89 CB 0.0007 -0.0088 0.0016 669 ARG 89 CG -0.0017 -0.0075 0.0005 670 ARG 89 CD -0.0026 -0.0076 0.0005 671 ARG 89 NE -0.0048 -0.0092 0.0014 672 ARG 89 CZ -0.0073 -0.0088 0.0009 673 ARG 89 NH1 -0.0080 -0.0068 -0.0006 674 ARG 89 NH2 -0.0090 -0.0104 0.0018 675 GLU 90 N 0.0054 -0.0111 0.0037 676 GLU 90 CA 0.0079 -0.0119 0.0045 677 GLU 90 C 0.0079 -0.0134 0.0055 678 GLU 90 O 0.0100 -0.0140 0.0062 679 GLU 90 CB 0.0090 -0.0132 0.0055 680 GLU 90 CG 0.0093 -0.0118 0.0045 681 GLU 90 CD 0.0114 -0.0125 0.0052 682 GLU 90 OE1 0.0109 -0.0142 0.0064 683 GLU 90 OE2 0.0135 -0.0114 0.0047 684 PHE 91 N 0.0077 -0.0133 0.0032 685 PHE 91 CA 0.0077 -0.0134 0.0033 686 PHE 91 C 0.0074 -0.0132 0.0029 687 PHE 91 O 0.0071 -0.0133 0.0029 688 PHE 91 CB 0.0074 -0.0140 0.0036 689 PHE 91 CG 0.0077 -0.0143 0.0041 690 PHE 91 CD1 0.0081 -0.0144 0.0044 691 PHE 91 CD2 0.0075 -0.0144 0.0041 692 PHE 91 CE1 0.0083 -0.0147 0.0048 693 PHE 91 CE2 0.0078 -0.0147 0.0045 694 PHE 91 CZ 0.0082 -0.0148 0.0048 695 VAL 92 N 0.0076 -0.0127 0.0026 696 VAL 92 CA 0.0073 -0.0124 0.0022 697 VAL 92 C 0.0074 -0.0124 0.0022 698 VAL 92 O 0.0070 -0.0123 0.0019 699 VAL 92 CB 0.0076 -0.0119 0.0019 700 VAL 92 CG1 0.0082 -0.0118 0.0021 701 VAL 92 CG2 0.0074 -0.0116 0.0014 702 GLN 93 N 0.0064 -0.0148 0.0011 703 GLN 93 CA 0.0062 -0.0146 0.0009 704 GLN 93 C 0.0071 -0.0138 0.0003 705 GLN 93 O 0.0075 -0.0139 0.0004 706 GLN 93 CB 0.0049 -0.0143 0.0005 707 GLN 93 CG 0.0040 -0.0147 0.0008 708 GLN 93 CD 0.0039 -0.0142 0.0003 709 GLN 93 NE2 0.0037 -0.0147 0.0007 710 GLN 93 OE1 0.0039 -0.0133 -0.0003 711 TRP 94 N 0.0074 -0.0131 -0.0002 712 TRP 94 CA 0.0081 -0.0123 -0.0008 713 TRP 94 C 0.0093 -0.0123 -0.0007 714 TRP 94 O 0.0096 -0.0124 -0.0006 715 TRP 94 CB 0.0075 -0.0114 -0.0015 716 TRP 94 CG 0.0062 -0.0114 -0.0016 717 TRP 94 CD1 0.0053 -0.0115 -0.0016 718 TRP 94 CD2 0.0056 -0.0112 -0.0018 719 TRP 94 CE2 0.0044 -0.0113 -0.0019 720 TRP 94 CE3 0.0061 -0.0110 -0.0019 721 TRP 94 NE1 0.0042 -0.0115 -0.0017 722 TRP 94 CZ2 0.0036 -0.0112 -0.0020 723 TRP 94 CZ3 0.0052 -0.0109 -0.0021 724 TRP 94 CH2 0.0040 -0.0110 -0.0021 725 SER 95 N 0.0054 0.0039 -0.0015 726 SER 95 CA 0.0045 0.0045 -0.0008 727 SER 95 C 0.0040 0.0050 0.0001 728 SER 95 O 0.0030 0.0056 0.0001 729 SER 95 CB 0.0050 0.0043 -0.0001 730 SER 95 OG 0.0050 0.0042 -0.0009 731 MET 96 N 0.0046 0.0047 0.0008 732 MET 96 CA 0.0042 0.0050 0.0016 733 MET 96 C 0.0052 0.0045 0.0021 734 MET 96 O 0.0060 0.0040 0.0026 735 MET 96 CB 0.0036 0.0056 0.0027 736 MET 96 CG 0.0026 0.0062 0.0028 737 MET 96 SD 0.0015 0.0067 0.0016 738 MET 96 CE 0.0011 0.0071 0.0021 739 LYS 97 N 0.0085 -0.0002 -0.0028 740 LYS 97 CA 0.0083 -0.0015 -0.0035 741 LYS 97 C 0.0082 -0.0003 -0.0045 742 LYS 97 O 0.0082 0.0013 -0.0052 743 LYS 97 CB 0.0080 -0.0029 -0.0049 744 LYS 97 CG 0.0078 -0.0047 -0.0053 745 LYS 97 CD 0.0081 -0.0055 -0.0036 746 LYS 97 CE 0.0079 -0.0075 -0.0039 747 LYS 97 NZ 0.0082 -0.0083 -0.0022 748 LEU 98 N 0.0082 -0.0011 -0.0044 749 LEU 98 CA 0.0081 -0.0002 -0.0053 750 LEU 98 C 0.0077 -0.0013 -0.0071 751 LEU 98 O 0.0076 -0.0031 -0.0071 752 LEU 98 CB 0.0083 -0.0001 -0.0040 753 LEU 98 CG 0.0083 0.0013 -0.0043 754 LEU 98 CD1 0.0080 0.0008 -0.0060 755 LEU 98 CD2 0.0084 0.0034 -0.0045 756 VAL 99 N 0.0042 -0.0043 -0.0062 757 VAL 99 CA 0.0017 -0.0032 -0.0058 758 VAL 99 C 0.0007 -0.0005 -0.0054 759 VAL 99 O 0.0001 -0.0006 -0.0053 760 VAL 99 CB -0.0008 -0.0054 -0.0056 761 VAL 99 CG1 -0.0035 -0.0040 -0.0051 762 VAL 99 CG2 -0.0000 -0.0078 -0.0059 763 GLN 100 N 0.0007 0.0019 -0.0052 764 GLN 100 CA -0.0003 0.0046 -0.0049 765 GLN 100 C -0.0034 0.0052 -0.0044 766 GLN 100 O -0.0043 0.0043 -0.0043 767 GLN 100 CB 0.0017 0.0071 -0.0050 768 GLN 100 CG 0.0007 0.0101 -0.0046 769 GLN 100 CD 0.0029 0.0119 -0.0047 770 GLN 100 NE2 0.0020 0.0142 -0.0044 771 GLN 100 OE1 0.0055 0.0113 -0.0051 772 ILE 101 N -0.0086 0.0085 -0.0039 773 ILE 101 CA -0.0063 0.0082 -0.0030 774 ILE 101 C -0.0063 0.0059 -0.0048 775 ILE 101 O -0.0040 0.0046 -0.0046 776 ILE 101 CB -0.0032 0.0078 -0.0018 777 ILE 101 CG1 -0.0026 0.0056 -0.0032 778 ILE 101 CG2 -0.0030 0.0104 0.0003 779 ILE 101 CD1 -0.0005 0.0029 -0.0041 780 ASP 102 N -0.0090 0.0054 -0.0065 781 ASP 102 CA -0.0094 0.0032 -0.0083 782 ASP 102 C -0.0079 0.0032 -0.0076 783 ASP 102 O -0.0057 0.0014 -0.0079 784 ASP 102 CB -0.0127 0.0034 -0.0098 785 ASP 102 CG -0.0146 0.0063 -0.0086 786 ASP 102 OD1 -0.0132 0.0081 -0.0066 787 ASP 102 OD2 -0.0173 0.0067 -0.0097 788 SER 105 N -0.0137 -0.0084 -0.0070 789 SER 105 CA -0.0120 -0.0061 0.0058 790 SER 105 C -0.0168 -0.0084 0.0035 791 SER 105 O -0.0153 -0.0092 -0.0085 792 SER 105 CB 0.0026 0.0005 0.0098 793 SER 105 OG 0.0100 0.0027 0.0016 794 PRO 106 N -0.0224 -0.0094 0.0148 795 PRO 106 CA -0.0264 -0.0112 0.0137 796 PRO 106 C -0.0143 -0.0066 0.0101 797 PRO 106 O -0.0032 -0.0014 0.0141 798 PRO 106 CB -0.0326 -0.0121 0.0286 799 PRO 106 CG -0.0284 -0.0092 0.0381 800 PRO 106 CD -0.0264 -0.0094 0.0288 801 GLU 107 N 0.0168 -0.0104 0.0285 802 GLU 107 CA 0.0115 -0.0036 0.0211 803 GLU 107 C 0.0092 -0.0024 0.0158 804 GLU 107 O 0.0048 0.0046 0.0111 805 GLU 107 CB 0.0103 -0.0070 0.0135 806 GLU 107 CG 0.0123 -0.0169 0.0077 807 GLU 107 CD 0.0088 -0.0163 -0.0019 808 GLU 107 OE1 0.0044 -0.0097 -0.0070 809 GLU 107 OE2 0.0105 -0.0225 -0.0044 810 LYS 108 N 0.0121 -0.0090 0.0165 811 LYS 108 CA 0.0100 -0.0078 0.0118 812 LYS 108 C 0.0082 0.0009 0.0169 813 LYS 108 O 0.0046 0.0058 0.0121 814 LYS 108 CB 0.0138 -0.0171 0.0117 815 LYS 108 CG 0.0147 -0.0255 0.0044 816 LYS 108 CD 0.0102 -0.0234 -0.0063 817 LYS 108 CE 0.0079 -0.0196 -0.0085 818 LYS 108 NZ 0.0111 -0.0272 -0.0082 819 MET 109 N 0.0054 0.0063 0.0147 820 MET 109 CA 0.0029 0.0095 0.0166 821 MET 109 C 0.0043 0.0107 0.0149 822 MET 109 O 0.0038 0.0148 0.0144 823 MET 109 CB -0.0001 0.0074 0.0205 824 MET 109 CG -0.0027 0.0090 0.0229 825 MET 109 SD -0.0061 0.0058 0.0274 826 MET 109 CE -0.0082 0.0078 0.0292 827 ARG 110 N 0.0060 0.0073 0.0138 828 ARG 110 CA 0.0075 0.0083 0.0119 829 ARG 110 C 0.0102 0.0111 0.0083 830 ARG 110 O 0.0108 0.0138 0.0069 831 ARG 110 CB 0.0087 0.0038 0.0117 832 ARG 110 CG 0.0061 0.0007 0.0153 833 ARG 110 CD 0.0074 -0.0038 0.0149 834 ARG 110 NE 0.0074 -0.0080 0.0159 835 ARG 110 CZ 0.0101 -0.0108 0.0137 836 ARG 110 NH1 0.0130 -0.0100 0.0103 837 ARG 110 NH2 0.0098 -0.0145 0.0149 838 ARG 111 N 0.0014 0.0120 0.0054 839 ARG 111 CA -0.0039 0.0091 -0.0015 840 ARG 111 C -0.0034 0.0096 -0.0008 841 ARG 111 O -0.0081 0.0130 -0.0051 842 ARG 111 CB -0.0042 -0.0006 -0.0048 843 ARG 111 CG -0.0101 -0.0037 -0.0125 844 ARG 111 CD -0.0159 0.0019 -0.0174 845 ARG 111 NE -0.0174 -0.0024 -0.0205 846 ARG 111 CZ -0.0205 -0.0092 -0.0260 847 ARG 111 NH1 -0.0224 -0.0128 -0.0292 848 ARG 111 NH2 -0.0217 -0.0125 -0.0283 849 LEU 112 N 0.0023 0.0062 0.0046 850 LEU 112 CA 0.0033 0.0068 0.0059 851 LEU 112 C 0.0024 0.0167 0.0079 852 LEU 112 O -0.0001 0.0192 0.0059 853 LEU 112 CB 0.0099 0.0013 0.0117 854 LEU 112 CG 0.0110 -0.0090 0.0099 855 LEU 112 CD1 0.0181 -0.0133 0.0167 856 LEU 112 CD2 0.0075 -0.0137 0.0045 857 TYR 113 N 0.0014 0.0141 0.0058 858 TYR 113 CA 0.0016 0.0143 0.0057 859 TYR 113 C 0.0022 0.0145 0.0052 860 TYR 113 O 0.0025 0.0150 0.0052 861 TYR 113 CB 0.0014 0.0137 0.0056 862 TYR 113 CG 0.0009 0.0137 0.0061 863 TYR 113 CD1 0.0009 0.0143 0.0065 864 TYR 113 CD2 0.0005 0.0131 0.0063 865 TYR 113 CE1 0.0004 0.0143 0.0069 866 TYR 113 CE2 0.0000 0.0132 0.0067 867 TYR 113 CZ -0.0000 0.0138 0.0071 868 TYR 113 OH -0.0004 0.0138 0.0076 869 LEU 114 N 0.0024 0.0141 0.0047 870 LEU 114 CA 0.0030 0.0142 0.0042 871 LEU 114 C 0.0032 0.0149 0.0043 872 LEU 114 O 0.0037 0.0152 0.0041 873 LEU 114 CB 0.0031 0.0137 0.0038 874 LEU 114 CG 0.0036 0.0135 0.0032 875 LEU 114 CD1 0.0035 0.0132 0.0031 876 LEU 114 CD2 0.0037 0.0131 0.0028 877 LYS 115 N -0.0064 0.0159 -0.0028 878 LYS 115 CA -0.0092 0.0125 -0.0072 879 LYS 115 C -0.0107 0.0149 -0.0069 880 LYS 115 O -0.0150 0.0151 -0.0103 881 LYS 115 CB -0.0057 0.0061 -0.0085 882 LYS 115 CG -0.0079 0.0025 -0.0125 883 LYS 115 CD -0.0087 -0.0025 -0.0164 884 LYS 115 CE -0.0035 -0.0066 -0.0147 885 LYS 115 NZ 0.0009 -0.0080 -0.0121 886 TYR 116 N -0.0072 0.0166 -0.0030 887 TYR 116 CA -0.0080 0.0182 -0.0026 888 TYR 116 C -0.0093 0.0247 0.0005 889 TYR 116 O -0.0089 0.0264 0.0019 890 TYR 116 CB -0.0032 0.0148 -0.0009 891 TYR 116 CG -0.0019 0.0083 -0.0040 892 TYR 116 CD1 -0.0051 0.0057 -0.0082 893 TYR 116 CD2 0.0025 0.0047 -0.0027 894 TYR 116 CE1 -0.0039 -0.0002 -0.0110 895 TYR 116 CE2 0.0037 -0.0012 -0.0055 896 TYR 116 CZ 0.0004 -0.0036 -0.0097 897 TYR 116 OH 0.0016 -0.0095 -0.0125 898 SER 117 N 0.0064 0.0228 0.0025 899 SER 117 CA 0.0056 0.0167 0.0020 900 SER 117 C 0.0122 0.0109 0.0016 901 SER 117 O 0.0157 0.0103 0.0015 902 SER 117 CB -0.0022 0.0126 0.0016 903 SER 117 OG -0.0041 0.0108 0.0014 904 GLY 118 N 0.0137 0.0066 0.0012 905 GLY 118 CA 0.0196 0.0007 0.0008 906 GLY 118 C 0.0166 -0.0074 0.0001 907 GLY 118 O 0.0213 -0.0128 -0.0003 908 GLU 119 N 0.0194 -0.0023 0.0024 909 GLU 119 CA 0.0160 -0.0098 0.0019 910 GLU 119 C 0.0151 -0.0061 0.0008 911 GLU 119 O 0.0127 0.0019 -0.0019 912 GLU 119 CB 0.0073 -0.0142 -0.0019 913 GLU 119 CG 0.0079 -0.0230 -0.0000 914 GLU 119 CD 0.0085 -0.0206 -0.0001 915 GLU 119 OE1 0.0085 -0.0121 -0.0016 916 GLU 119 OE2 0.0090 -0.0272 0.0013 917 VAL 120 N 0.0170 -0.0119 0.0028 918 VAL 120 CA 0.0166 -0.0090 0.0020 919 VAL 120 C 0.0074 -0.0079 -0.0029 920 VAL 120 O 0.0056 -0.0014 -0.0050 921 VAL 120 CB 0.0209 -0.0160 0.0055 922 VAL 120 CG1 0.0305 -0.0136 0.0101 923 VAL 120 CG2 0.0188 -0.0261 0.0062 924 ALA 121 N 0.0080 -0.0062 -0.0016 925 ALA 121 CA 0.0057 -0.0062 -0.0031 926 ALA 121 C 0.0047 -0.0046 -0.0035 927 ALA 121 O 0.0059 -0.0038 -0.0027 928 ALA 121 CB 0.0049 -0.0089 -0.0039 929 PHE 122 N 0.0026 -0.0040 -0.0048 930 PHE 122 CA 0.0015 -0.0025 -0.0054 931 PHE 122 C 0.0011 -0.0042 -0.0058 932 PHE 122 O -0.0004 -0.0056 -0.0070 933 PHE 122 CB -0.0007 -0.0013 -0.0067 934 PHE 122 CG -0.0018 0.0005 -0.0073 935 PHE 122 CD1 -0.0007 0.0022 -0.0064 936 PHE 122 CD2 -0.0041 0.0006 -0.0087 937 PHE 122 CE1 -0.0018 0.0039 -0.0069 938 PHE 122 CE2 -0.0051 0.0023 -0.0092 939 PHE 122 CZ -0.0040 0.0039 -0.0083 940 MET 123 N -0.0046 -0.0072 -0.0070 941 MET 123 CA -0.0069 -0.0078 -0.0071 942 MET 123 C -0.0071 -0.0037 -0.0087 943 MET 123 O -0.0044 -0.0025 -0.0087 944 MET 123 CB -0.0047 -0.0107 -0.0057 945 MET 123 CG -0.0036 -0.0146 -0.0040 946 MET 123 SD -0.0033 -0.0187 -0.0025 947 MET 123 CE -0.0032 -0.0229 -0.0009 948 PRO 124 N -0.0103 -0.0014 -0.0101 949 PRO 124 CA -0.0105 0.0026 -0.0116 950 PRO 124 C -0.0122 0.0026 -0.0119 951 PRO 124 O -0.0121 0.0059 -0.0131 952 PRO 124 CB -0.0134 0.0047 -0.0129 953 PRO 124 CG -0.0153 0.0015 -0.0120 954 PRO 124 CD -0.0138 -0.0025 -0.0103 955 GLU 125 N -0.0165 -0.0044 -0.0125 956 GLU 125 CA -0.0166 -0.0051 -0.0125 957 GLU 125 C -0.0138 -0.0052 -0.0114 958 GLU 125 O -0.0136 -0.0054 -0.0113 959 GLU 125 CB -0.0181 -0.0080 -0.0130 960 GLU 125 CG -0.0164 -0.0107 -0.0123 961 GLU 125 CD -0.0168 -0.0115 -0.0124 962 GLU 125 OE1 -0.0188 -0.0106 -0.0133 963 GLU 125 OE2 -0.0151 -0.0132 -0.0117 964 THR 126 N -0.0116 -0.0052 -0.0106 965 THR 126 CA -0.0089 -0.0052 -0.0095 966 THR 126 C -0.0075 -0.0023 -0.0090 967 THR 126 O -0.0050 -0.0021 -0.0081 968 THR 126 CB -0.0072 -0.0073 -0.0087 969 THR 126 CG2 -0.0083 -0.0104 -0.0091 970 THR 126 OG1 -0.0072 -0.0063 -0.0088 971 MET 127 N -0.0105 0.0140 -0.0001 972 MET 127 CA -0.0100 0.0142 -0.0009 973 MET 127 C -0.0106 0.0142 -0.0020 974 MET 127 O -0.0111 0.0141 -0.0022 975 MET 127 CB -0.0088 0.0145 -0.0010 976 MET 127 CG -0.0086 0.0146 -0.0014 977 MET 127 SD -0.0074 0.0148 -0.0009 978 MET 127 CE -0.0065 0.0151 -0.0019 979 THR 128 N -0.0105 0.0143 -0.0027 980 THR 128 CA -0.0111 0.0143 -0.0037 981 THR 128 C -0.0106 0.0146 -0.0045 982 THR 128 O -0.0097 0.0147 -0.0044 983 THR 128 CB -0.0111 0.0144 -0.0042 984 THR 128 CG2 -0.0113 0.0142 -0.0033 985 THR 128 OG1 -0.0101 0.0147 -0.0047 986 PRO 129 N -0.0100 0.0105 -0.0023 987 PRO 129 CA -0.0073 0.0089 -0.0032 988 PRO 129 C -0.0076 0.0074 -0.0036 989 PRO 129 O -0.0053 0.0073 -0.0039 990 PRO 129 CB -0.0069 0.0066 -0.0040 991 PRO 129 CG -0.0096 0.0069 -0.0036 992 PRO 129 CD -0.0109 0.0098 -0.0024 993 ALA 130 N -0.0104 0.0062 -0.0038 994 ALA 130 CA -0.0108 0.0048 -0.0042 995 ALA 130 C -0.0105 0.0070 -0.0035 996 ALA 130 O -0.0091 0.0064 -0.0038 997 ALA 130 CB -0.0140 0.0032 -0.0044 998 GLN 131 N -0.0101 0.0114 -0.0070 999 GLN 131 CA -0.0085 0.0105 -0.0057 1000 GLN 131 C -0.0059 0.0098 -0.0026 1001 GLN 131 O -0.0037 0.0077 -0.0021 1002 GLN 131 CB -0.0101 0.0129 -0.0048 1003 GLN 131 CG -0.0120 0.0130 -0.0077 1004 GLN 131 CD -0.0142 0.0158 -0.0070 1005 GLN 131 NE2 -0.0168 0.0170 -0.0093 1006 GLN 131 OE1 -0.0137 0.0169 -0.0043 1007 CYS 132 N -0.0062 0.0115 -0.0004 1008 CYS 132 CA -0.0039 0.0109 0.0025 1009 CYS 132 C -0.0017 0.0079 0.0015 1010 CYS 132 O 0.0007 0.0063 0.0029 1011 CYS 132 CB -0.0048 0.0131 0.0046 1012 CYS 132 SG -0.0064 0.0165 0.0071 1013 LEU 133 N 0.0003 0.0058 0.0042 1014 LEU 133 CA 0.0034 0.0004 0.0029 1015 LEU 133 C 0.0042 -0.0034 0.0006 1016 LEU 133 O 0.0082 -0.0070 0.0018 1017 LEU 133 CB 0.0013 -0.0011 -0.0004 1018 LEU 133 CG 0.0040 -0.0068 -0.0023 1019 LEU 133 CD1 0.0091 -0.0082 0.0017 1020 LEU 133 CD2 0.0017 -0.0079 -0.0056 1021 GLN 134 N 0.0004 -0.0027 -0.0026 1022 GLN 134 CA 0.0010 -0.0063 -0.0050 1023 GLN 134 C 0.0042 -0.0059 -0.0015 1024 GLN 134 O 0.0073 -0.0099 -0.0016 1025 GLN 134 CB -0.0038 -0.0052 -0.0091 1026 GLN 134 CG -0.0064 -0.0075 -0.0136 1027 GLN 134 CD -0.0040 -0.0135 -0.0160 1028 GLN 134 NE2 -0.0047 -0.0158 -0.0186 1029 GLN 134 OE1 -0.0015 -0.0159 -0.0154 1030 PHE 135 N 0.0011 -0.0025 0.0031 1031 PHE 135 CA 0.0025 -0.0013 0.0043 1032 PHE 135 C 0.0054 -0.0023 0.0055 1033 PHE 135 O 0.0067 -0.0029 0.0060 1034 PHE 135 CB 0.0018 0.0019 0.0052 1035 PHE 135 CG 0.0037 0.0034 0.0067 1036 PHE 135 CD1 0.0044 0.0026 0.0068 1037 PHE 135 CD2 0.0046 0.0057 0.0081 1038 PHE 135 CE1 0.0061 0.0041 0.0083 1039 PHE 135 CE2 0.0063 0.0071 0.0095 1040 PHE 135 CZ 0.0070 0.0063 0.0096 1041 MET 136 N 0.0065 -0.0026 0.0060 1042 MET 136 CA 0.0093 -0.0036 0.0071 1043 MET 136 C 0.0101 -0.0066 0.0064 1044 MET 136 O 0.0122 -0.0073 0.0073 1045 MET 136 CB 0.0100 -0.0035 0.0075 1046 MET 136 CG 0.0109 -0.0008 0.0090 1047 MET 136 SD 0.0124 0.0013 0.0106 1048 MET 136 CE 0.0152 -0.0012 0.0112 1049 ILE 137 N 0.0136 -0.0123 0.0100 1050 ILE 137 CA 0.0147 -0.0165 0.0086 1051 ILE 137 C 0.0153 -0.0187 0.0078 1052 ILE 137 O 0.0174 -0.0218 0.0089 1053 ILE 137 CB 0.0128 -0.0172 0.0051 1054 ILE 137 CG1 0.0129 -0.0160 0.0061 1055 ILE 137 CG2 0.0135 -0.0214 0.0030 1056 ILE 137 CD1 0.0109 -0.0162 0.0028 1057 ASP 138 N 0.0134 -0.0172 0.0060 1058 ASP 138 CA 0.0137 -0.0195 0.0047 1059 ASP 138 C 0.0159 -0.0203 0.0077 1060 ASP 138 O 0.0166 -0.0229 0.0069 1061 ASP 138 CB 0.0112 -0.0174 0.0022 1062 ASP 138 CG 0.0089 -0.0173 -0.0014 1063 ASP 138 OD1 0.0092 -0.0185 -0.0018 1064 ASP 138 OD2 0.0069 -0.0161 -0.0038 1065 ILE 139 N 0.0071 -0.0139 0.0088 1066 ILE 139 CA 0.0079 -0.0130 0.0089 1067 ILE 139 C 0.0092 -0.0136 0.0088 1068 ILE 139 O 0.0101 -0.0129 0.0088 1069 ILE 139 CB 0.0080 -0.0117 0.0090 1070 ILE 139 CG1 0.0090 -0.0118 0.0090 1071 ILE 139 CG2 0.0067 -0.0113 0.0091 1072 ILE 139 CD1 0.0094 -0.0105 0.0091 1073 ASP 140 N 0.0094 -0.0149 0.0087 1074 ASP 140 CA 0.0106 -0.0155 0.0086 1075 ASP 140 C 0.0110 -0.0154 0.0086 1076 ASP 140 O 0.0102 -0.0158 0.0086 1077 ASP 140 CB 0.0105 -0.0169 0.0085 1078 ASP 140 CG 0.0119 -0.0176 0.0084 1079 ASP 140 OD1 0.0129 -0.0169 0.0084 1080 ASP 140 OD2 0.0119 -0.0188 0.0083 1081 PRO 141 N 0.0066 -0.0122 0.0033 1082 PRO 141 CA 0.0027 -0.0074 0.0024 1083 PRO 141 C 0.0008 -0.0059 0.0064 1084 PRO 141 O -0.0026 -0.0021 0.0078 1085 PRO 141 CB 0.0030 -0.0068 -0.0039 1086 PRO 141 CG 0.0065 -0.0104 -0.0066 1087 PRO 141 CD 0.0092 -0.0143 -0.0022 1088 ALA 142 N 0.0029 -0.0087 0.0082 1089 ALA 142 CA 0.0014 -0.0075 0.0120 1090 ALA 142 C 0.0006 -0.0077 0.0182 1091 ALA 142 O -0.0004 -0.0071 0.0220 1092 ALA 142 CB 0.0039 -0.0104 0.0115 1093 ARG 143 N 0.0022 -0.0068 0.0199 1094 ARG 143 CA -0.0002 -0.0076 0.0246 1095 ARG 143 C -0.0030 -0.0034 0.0262 1096 ARG 143 O -0.0052 -0.0035 0.0302 1097 ARG 143 CB 0.0007 -0.0116 0.0263 1098 ARG 143 CG 0.0023 -0.0162 0.0274 1099 ARG 143 CD 0.0021 -0.0197 0.0306 1100 ARG 143 NE 0.0040 -0.0244 0.0311 1101 ARG 143 CZ 0.0068 -0.0268 0.0279 1102 ARG 143 NH1 0.0083 -0.0251 0.0240 1103 ARG 143 NH2 0.0083 -0.0310 0.0287 1104 SER 144 N -0.0030 0.0003 0.0232 1105 SER 144 CA -0.0056 0.0045 0.0243 1106 SER 144 C -0.0070 0.0035 0.0277 1107 SER 144 O -0.0097 0.0054 0.0308 1108 SER 144 CB -0.0077 0.0073 0.0259 1109 SER 144 OG -0.0082 0.0045 0.0290 1110 GLY 5 N 0.0065 -0.0147 -0.0012 1111 GLY 5 CA 0.0071 -0.0114 -0.0027 1112 GLY 5 C 0.0039 -0.0087 -0.0021 1113 GLY 5 O 0.0012 -0.0098 -0.0005 1114 LEU 6 N 0.0041 -0.0053 -0.0034 1115 LEU 6 CA 0.0011 -0.0025 -0.0031 1116 LEU 6 C 0.0000 -0.0009 -0.0031 1117 LEU 6 O 0.0022 -0.0005 -0.0043 1118 LEU 6 CB 0.0021 0.0005 -0.0046 1119 LEU 6 CG -0.0010 0.0027 -0.0039 1120 LEU 6 CD1 -0.0030 0.0002 -0.0021 1121 LEU 6 CD2 0.0003 0.0054 -0.0055 1122 TYR 7 N 0.0001 -0.0034 -0.0032 1123 TYR 7 CA -0.0010 -0.0020 -0.0034 1124 TYR 7 C -0.0028 -0.0011 -0.0036 1125 TYR 7 O -0.0036 -0.0019 -0.0034 1126 TYR 7 CB -0.0018 -0.0031 -0.0032 1127 TYR 7 CG -0.0001 -0.0034 -0.0032 1128 TYR 7 CD1 0.0003 -0.0020 -0.0035 1129 TYR 7 CD2 0.0010 -0.0052 -0.0029 1130 TYR 7 CE1 0.0018 -0.0023 -0.0034 1131 TYR 7 CE2 0.0025 -0.0056 -0.0029 1132 TYR 7 CZ 0.0029 -0.0041 -0.0032 1133 TYR 7 OH 0.0043 -0.0044 -0.0031 1134 ARG 8 N -0.0034 0.0007 -0.0039 1135 ARG 8 CA -0.0051 0.0018 -0.0040 1136 ARG 8 C -0.0065 0.0025 -0.0041 1137 ARG 8 O -0.0058 0.0035 -0.0043 1138 ARG 8 CB -0.0045 0.0037 -0.0044 1139 ARG 8 CG -0.0062 0.0048 -0.0045 1140 ARG 8 CD -0.0055 0.0068 -0.0049 1141 ARG 8 NE -0.0042 0.0064 -0.0049 1142 ARG 8 CZ -0.0025 0.0075 -0.0051 1143 ARG 8 NH1 -0.0019 0.0090 -0.0054 1144 ARG 8 NH2 -0.0014 0.0070 -0.0050 1145 MET 9 N -0.0036 -0.0004 -0.0113 1146 MET 9 CA -0.0032 -0.0008 -0.0108 1147 MET 9 C -0.0043 -0.0000 -0.0109 1148 MET 9 O -0.0054 0.0006 -0.0101 1149 MET 9 CB -0.0028 -0.0016 -0.0092 1150 MET 9 CG -0.0025 -0.0020 -0.0085 1151 MET 9 SD -0.0017 -0.0031 -0.0068 1152 MET 9 CE -0.0005 -0.0038 -0.0070 1153 THR 10 N -0.0040 0.0000 -0.0118 1154 THR 10 CA -0.0049 0.0007 -0.0119 1155 THR 10 C -0.0044 0.0002 -0.0112 1156 THR 10 O -0.0033 -0.0005 -0.0117 1157 THR 10 CB -0.0052 0.0014 -0.0136 1158 THR 10 CG2 -0.0039 0.0008 -0.0147 1159 THR 10 OG1 -0.0060 0.0020 -0.0136 1160 TYR 11 N -0.0074 -0.0009 -0.0187 1161 TYR 11 CA -0.0073 -0.0014 -0.0178 1162 TYR 11 C -0.0071 -0.0008 -0.0169 1163 TYR 11 O -0.0069 0.0000 -0.0170 1164 TYR 11 CB -0.0073 -0.0017 -0.0177 1165 TYR 11 CG -0.0071 -0.0010 -0.0172 1166 TYR 11 CD1 -0.0070 -0.0011 -0.0163 1167 TYR 11 CD2 -0.0071 -0.0003 -0.0178 1168 TYR 11 CE1 -0.0068 -0.0004 -0.0158 1169 TYR 11 CE2 -0.0069 0.0004 -0.0173 1170 TYR 11 CZ -0.0068 0.0003 -0.0164 1171 TYR 11 OH -0.0066 0.0010 -0.0159 1172 ILE 12 N -0.0070 -0.0013 -0.0161 1173 ILE 12 CA -0.0068 -0.0009 -0.0152 1174 ILE 12 C -0.0067 -0.0012 -0.0144 1175 ILE 12 O -0.0069 -0.0019 -0.0145 1176 ILE 12 CB -0.0068 -0.0012 -0.0149 1177 ILE 12 CG1 -0.0069 -0.0022 -0.0146 1178 ILE 12 CG2 -0.0069 -0.0009 -0.0157 1179 ILE 12 CD1 -0.0070 -0.0026 -0.0144 1180 SER 13 N 0.0028 0.0038 -0.0169 1181 SER 13 CA 0.0017 0.0030 -0.0159 1182 SER 13 C 0.0048 0.0046 -0.0097 1183 SER 13 O 0.0088 0.0071 -0.0072 1184 SER 13 CB 0.0033 0.0045 -0.0219 1185 SER 13 OG 0.0043 0.0051 -0.0201 1186 ARG 14 N 0.0032 0.0033 -0.0072 1187 ARG 14 CA 0.0057 0.0045 -0.0012 1188 ARG 14 C 0.0085 0.0066 -0.0029 1189 ARG 14 O 0.0063 0.0054 -0.0068 1190 ARG 14 CB 0.0014 0.0012 0.0040 1191 ARG 14 CG -0.0009 -0.0006 0.0070 1192 ARG 14 CD -0.0049 -0.0036 0.0124 1193 ARG 14 NE -0.0068 -0.0052 0.0156 1194 ARG 14 CZ -0.0040 -0.0037 0.0205 1195 ARG 14 NH1 0.0009 -0.0006 0.0229 1196 ARG 14 NH2 -0.0061 -0.0053 0.0231 1197 ALA 15 N 0.0123 0.0211 -0.0026 1198 ALA 15 CA 0.0141 0.0255 -0.0006 1199 ALA 15 C 0.0138 0.0235 0.0073 1200 ALA 15 O 0.0126 0.0200 0.0118 1201 ALA 15 CB 0.0172 0.0333 -0.0009 1202 VAL 16 N 0.0148 0.0260 0.0088 1203 VAL 16 CA 0.0150 0.0255 0.0163 1204 VAL 16 C 0.0176 0.0315 0.0210 1205 VAL 16 O 0.0196 0.0370 0.0178 1206 VAL 16 CB 0.0150 0.0257 0.0158 1207 VAL 16 CG1 0.0122 0.0188 0.0128 1208 VAL 16 CG2 0.0173 0.0320 0.0109 1209 PRO 17 N 0.0314 0.0338 0.0299 1210 PRO 17 CA 0.0350 0.0343 0.0327 1211 PRO 17 C 0.0388 0.0356 0.0305 1212 PRO 17 O 0.0420 0.0362 0.0324 1213 PRO 17 CB 0.0338 0.0335 0.0354 1214 PRO 17 CG 0.0301 0.0329 0.0336 1215 PRO 17 CD 0.0283 0.0328 0.0306 1216 GLY 18 N 0.0385 0.0362 0.0267 1217 GLY 18 CA 0.0421 0.0374 0.0247 1218 GLY 18 C 0.0440 0.0383 0.0220 1219 GLY 18 O 0.0462 0.0394 0.0193 1220 LEU 19 N -0.0195 0.0379 0.0029 1221 LEU 19 CA -0.0156 0.0330 0.0074 1222 LEU 19 C -0.0234 0.0317 0.0064 1223 LEU 19 O -0.0282 0.0378 0.0008 1224 LEU 19 CB -0.0048 0.0377 0.0068 1225 LEU 19 CG 0.0041 0.0343 0.0114 1226 LEU 19 CD1 0.0146 0.0358 0.0130 1227 LEU 19 CD2 0.0010 0.0245 0.0177 1228 GLY 20 N -0.0247 0.0237 0.0118 1229 GLY 20 CA -0.0318 0.0216 0.0115 1230 GLY 20 C -0.0270 0.0173 0.0158 1231 GLY 20 O -0.0174 0.0168 0.0186 1232 TYR 21 N -0.0026 -0.0448 0.0217 1233 TYR 21 CA -0.0072 -0.0451 0.0246 1234 TYR 21 C -0.0113 -0.0303 0.0140 1235 TYR 21 O -0.0223 -0.0264 0.0170 1236 TYR 21 CB 0.0066 -0.0563 0.0263 1237 TYR 21 CG 0.0084 -0.0718 0.0387 1238 TYR 21 CD1 0.0187 -0.0791 0.0391 1239 TYR 21 CD2 -0.0002 -0.0792 0.0501 1240 TYR 21 CE1 0.0203 -0.0933 0.0505 1241 TYR 21 CE2 0.0015 -0.0935 0.0614 1242 TYR 21 CZ 0.0117 -0.1004 0.0616 1243 TYR 21 OH 0.0134 -0.1146 0.0729 1244 ASN 22 N -0.0024 -0.0219 0.0017 1245 ASN 22 CA -0.0055 -0.0077 -0.0089 1246 ASN 22 C -0.0230 0.0023 -0.0074 1247 ASN 22 O -0.0317 0.0102 -0.0093 1248 ASN 22 CB 0.0075 -0.0011 -0.0220 1249 ASN 22 CG 0.0248 -0.0092 -0.0249 1250 ASN 22 ND2 0.0373 -0.0080 -0.0331 1251 ASN 22 OD1 0.0269 -0.0165 -0.0198 1252 ASP 23 N -0.0148 0.0005 0.0018 1253 ASP 23 CA -0.0202 0.0015 0.0016 1254 ASP 23 C -0.0231 0.0005 0.0035 1255 ASP 23 O -0.0266 0.0022 0.0019 1256 ASP 23 CB -0.0220 0.0003 0.0036 1257 ASP 23 CG -0.0205 0.0019 0.0010 1258 ASP 23 OD1 -0.0229 0.0045 -0.0020 1259 ASP 23 OD2 -0.0170 0.0007 0.0020 1260 LEU 24 N -0.0216 -0.0023 0.0070 1261 LEU 24 CA -0.0241 -0.0035 0.0091 1262 LEU 24 C -0.0235 -0.0016 0.0065 1263 LEU 24 O -0.0271 -0.0009 0.0062 1264 LEU 24 CB -0.0221 -0.0068 0.0133 1265 LEU 24 CG -0.0240 -0.0090 0.0166 1266 LEU 24 CD1 -0.0219 -0.0123 0.0207 1267 LEU 24 CD2 -0.0297 -0.0085 0.0170 1268 ARG 25 N -0.0313 -0.0115 0.0009 1269 ARG 25 CA -0.0331 -0.0072 -0.0009 1270 ARG 25 C -0.0347 -0.0036 -0.0024 1271 ARG 25 O -0.0383 -0.0014 -0.0042 1272 ARG 25 CB -0.0293 -0.0047 -0.0003 1273 ARG 25 CG -0.0296 -0.0066 0.0001 1274 ARG 25 CD -0.0252 -0.0048 0.0011 1275 ARG 25 NE -0.0242 -0.0081 0.0023 1276 ARG 25 CZ -0.0202 -0.0103 0.0043 1277 ARG 25 NH1 -0.0167 -0.0096 0.0053 1278 ARG 25 NH2 -0.0198 -0.0133 0.0053 1279 ASP 26 N -0.0321 -0.0030 -0.0017 1280 ASP 26 CA -0.0337 0.0000 -0.0031 1281 ASP 26 C -0.0386 -0.0020 -0.0041 1282 ASP 26 O -0.0417 0.0007 -0.0059 1283 ASP 26 CB -0.0300 0.0005 -0.0019 1284 ASP 26 CG -0.0310 0.0042 -0.0033 1285 ASP 26 OD1 -0.0318 0.0084 -0.0048 1286 ASP 26 OD2 -0.0310 0.0031 -0.0030 1287 ILE 27 N -0.0190 -0.0065 -0.0169 1288 ILE 27 CA -0.0188 -0.0080 -0.0188 1289 ILE 27 C -0.0180 -0.0067 -0.0212 1290 ILE 27 O -0.0177 -0.0079 -0.0232 1291 ILE 27 CB -0.0192 -0.0085 -0.0178 1292 ILE 27 CG1 -0.0200 -0.0103 -0.0157 1293 ILE 27 CG2 -0.0188 -0.0096 -0.0199 1294 ILE 27 CD1 -0.0204 -0.0104 -0.0143 1295 MET 28 N -0.0175 -0.0042 -0.0211 1296 MET 28 CA -0.0167 -0.0028 -0.0234 1297 MET 28 C -0.0164 -0.0031 -0.0248 1298 MET 28 O -0.0160 -0.0037 -0.0270 1299 MET 28 CB -0.0164 0.0000 -0.0227 1300 MET 28 CG -0.0156 0.0014 -0.0247 1301 MET 28 SD -0.0157 0.0013 -0.0243 1302 MET 28 CE -0.0155 0.0045 -0.0231 1303 GLY 29 N -0.0357 0.0060 -0.0194 1304 GLY 29 CA -0.0364 0.0013 -0.0089 1305 GLY 29 C -0.0239 -0.0045 -0.0037 1306 GLY 29 O -0.0196 -0.0069 -0.0009 1307 LYS 30 N -0.0178 -0.0067 -0.0024 1308 LYS 30 CA -0.0060 -0.0123 0.0029 1309 LYS 30 C 0.0043 -0.0115 -0.0047 1310 LYS 30 O 0.0111 -0.0155 -0.0001 1311 LYS 30 CB -0.0018 -0.0143 0.0048 1312 LYS 30 CG -0.0096 -0.0169 0.0149 1313 LYS 30 CD -0.0053 -0.0186 0.0161 1314 LYS 30 CE -0.0129 -0.0214 0.0264 1315 LYS 30 NZ -0.0091 -0.0228 0.0273 1316 SER 31 N 0.0030 -0.0055 -0.0143 1317 SER 31 CA 0.0068 -0.0034 -0.0138 1318 SER 31 C 0.0072 -0.0055 -0.0109 1319 SER 31 O 0.0107 -0.0053 -0.0083 1320 SER 31 CB 0.0068 -0.0002 -0.0178 1321 SER 31 OG 0.0028 -0.0010 -0.0200 1322 GLU 32 N 0.0037 -0.0075 -0.0113 1323 GLU 32 CA 0.0038 -0.0095 -0.0087 1324 GLU 32 C 0.0051 -0.0121 -0.0044 1325 GLU 32 O 0.0079 -0.0124 -0.0017 1326 GLU 32 CB -0.0005 -0.0113 -0.0100 1327 GLU 32 CG -0.0005 -0.0096 -0.0121 1328 GLU 32 CD -0.0050 -0.0105 -0.0146 1329 GLU 32 OE1 -0.0081 -0.0132 -0.0138 1330 GLU 32 OE2 -0.0054 -0.0085 -0.0174 1331 VAL 33 N 0.0061 -0.0059 0.0025 1332 VAL 33 CA 0.0066 -0.0056 0.0079 1333 VAL 33 C 0.0111 -0.0034 0.0099 1334 VAL 33 O 0.0114 -0.0032 0.0138 1335 VAL 33 CB 0.0059 -0.0060 0.0088 1336 VAL 33 CG1 0.0080 -0.0049 0.0139 1337 VAL 33 CG2 0.0010 -0.0085 0.0086 1338 ASN 34 N 0.0148 -0.0015 0.0072 1339 ASN 34 CA 0.0193 0.0007 0.0090 1340 ASN 34 C 0.0200 0.0011 0.0093 1341 ASN 34 O 0.0219 0.0021 0.0130 1342 ASN 34 CB 0.0230 0.0025 0.0057 1343 ASN 34 CG 0.0233 0.0027 0.0064 1344 ASN 34 ND2 0.0204 0.0012 0.0039 1345 ASN 34 OD1 0.0262 0.0042 0.0092 1346 ASN 35 N 0.0122 0.0017 0.0021 1347 ASN 35 CA 0.0111 0.0025 0.0089 1348 ASN 35 C 0.0129 -0.0011 0.0122 1349 ASN 35 O 0.0115 0.0006 0.0169 1350 ASN 35 CB 0.0115 0.0014 0.0119 1351 ASN 35 CG 0.0091 0.0059 0.0098 1352 ASN 35 ND2 0.0073 0.0083 0.0144 1353 ASN 35 OD1 0.0088 0.0073 0.0042 1354 SER 36 N 0.0159 -0.0059 0.0098 1355 SER 36 CA 0.0175 -0.0091 0.0122 1356 SER 36 C 0.0158 -0.0060 0.0109 1357 SER 36 O 0.0155 -0.0060 0.0148 1358 SER 36 CB 0.0210 -0.0148 0.0093 1359 SER 36 OG 0.0229 -0.0187 0.0133 1360 HIS 37 N 0.0259 -0.0048 -0.0025 1361 HIS 37 CA 0.0182 0.0068 -0.0104 1362 HIS 37 C 0.0033 0.0148 -0.0013 1363 HIS 37 O -0.0039 0.0208 -0.0006 1364 HIS 37 CB 0.0212 0.0136 -0.0266 1365 HIS 37 CG 0.0143 0.0252 -0.0359 1366 HIS 37 CD2 0.0016 0.0365 -0.0358 1367 HIS 37 ND1 0.0207 0.0260 -0.0471 1368 HIS 37 CE1 0.0123 0.0373 -0.0534 1369 HIS 37 NE2 0.0006 0.0438 -0.0468 1370 VAL 38 N -0.0015 0.0150 0.0057 1371 VAL 38 CA -0.0157 0.0234 0.0129 1372 VAL 38 C -0.0210 0.0183 0.0297 1373 VAL 38 O -0.0320 0.0252 0.0347 1374 VAL 38 CB -0.0191 0.0272 0.0115 1375 VAL 38 CG1 -0.0313 0.0304 0.0247 1376 VAL 38 CG2 -0.0211 0.0379 -0.0038 1377 GLY 39 N -0.0040 0.0110 0.0180 1378 GLY 39 CA -0.0057 0.0099 0.0184 1379 GLY 39 C -0.0051 0.0085 0.0173 1380 GLY 39 O -0.0058 0.0085 0.0177 1381 LEU 40 N -0.0039 0.0074 0.0158 1382 LEU 40 CA -0.0032 0.0060 0.0146 1383 LEU 40 C -0.0039 0.0038 0.0138 1384 LEU 40 O -0.0042 0.0034 0.0137 1385 LEU 40 CB -0.0009 0.0067 0.0134 1386 LEU 40 CG 0.0001 0.0083 0.0136 1387 LEU 40 CD1 0.0024 0.0088 0.0123 1388 LEU 40 CD2 -0.0005 0.0076 0.0136 1389 THR 41 N 0.0017 0.0079 0.0027 1390 THR 41 CA 0.0011 0.0064 0.0018 1391 THR 41 C 0.0015 0.0073 -0.0000 1392 THR 41 O 0.0022 0.0091 -0.0004 1393 THR 41 CB 0.0008 0.0055 0.0034 1394 THR 41 CG2 0.0004 0.0046 0.0052 1395 THR 41 OG1 0.0014 0.0070 0.0043 1396 GLY 42 N 0.0010 0.0061 -0.0011 1397 GLY 42 CA 0.0013 0.0068 -0.0027 1398 GLY 42 C 0.0007 0.0052 -0.0045 1399 GLY 42 O 0.0000 0.0035 -0.0042 1400 LEU 43 N 0.0001 0.0137 -0.0090 1401 LEU 43 CA 0.0022 0.0115 -0.0098 1402 LEU 43 C 0.0012 0.0131 -0.0117 1403 LEU 43 O -0.0011 0.0157 -0.0114 1404 LEU 43 CB 0.0031 0.0094 -0.0061 1405 LEU 43 CG 0.0054 0.0067 -0.0063 1406 LEU 43 CD1 0.0078 0.0044 -0.0082 1407 LEU 43 CD2 0.0057 0.0054 -0.0023 1408 LEU 44 N 0.0030 0.0115 -0.0137 1409 LEU 44 CA 0.0024 0.0127 -0.0159 1410 LEU 44 C 0.0041 0.0104 -0.0152 1411 LEU 44 O 0.0064 0.0078 -0.0154 1412 LEU 44 CB 0.0027 0.0133 -0.0202 1413 LEU 44 CG 0.0027 0.0141 -0.0229 1414 LEU 44 CD1 0.0001 0.0171 -0.0224 1415 LEU 44 CD2 0.0036 0.0140 -0.0270 1416 CYS 45 N -0.0032 0.0273 -0.0140 1417 CYS 45 CA -0.0001 0.0253 -0.0105 1418 CYS 45 C 0.0008 0.0249 -0.0097 1419 CYS 45 O -0.0024 0.0244 -0.0095 1420 CYS 45 CB -0.0023 0.0228 -0.0070 1421 CYS 45 SG 0.0006 0.0200 -0.0023 1422 PHE 46 N 0.0053 0.0251 -0.0092 1423 PHE 46 CA 0.0067 0.0247 -0.0085 1424 PHE 46 C 0.0091 0.0223 -0.0044 1425 PHE 46 O 0.0120 0.0218 -0.0033 1426 PHE 46 CB 0.0100 0.0270 -0.0115 1427 PHE 46 CG 0.0118 0.0267 -0.0107 1428 PHE 46 CD1 0.0089 0.0257 -0.0096 1429 PHE 46 CD2 0.0165 0.0274 -0.0111 1430 PHE 46 CE1 0.0106 0.0254 -0.0089 1431 PHE 46 CE2 0.0182 0.0272 -0.0104 1432 PHE 46 CZ 0.0152 0.0261 -0.0093 1433 GLY 47 N 0.0162 0.0374 -0.0050 1434 GLY 47 CA 0.0200 0.0349 0.0046 1435 GLY 47 C 0.0150 0.0301 0.0106 1436 GLY 47 O 0.0066 0.0271 0.0089 1437 ASN 48 N 0.0201 0.0293 0.0175 1438 ASN 48 CA 0.0163 0.0249 0.0238 1439 ASN 48 C 0.0102 0.0244 0.0187 1440 ASN 48 O 0.0029 0.0201 0.0211 1441 ASN 48 CB 0.0110 0.0198 0.0300 1442 ASN 48 CG 0.0086 0.0153 0.0379 1443 ASN 48 ND2 0.0018 0.0106 0.0418 1444 ASN 48 OD1 0.0127 0.0160 0.0403 1445 SER 49 N 0.0151 0.0273 0.0139 1446 SER 49 CA 0.0129 0.0263 0.0119 1447 SER 49 C 0.0076 0.0233 0.0076 1448 SER 49 O 0.0046 0.0199 0.0077 1449 SER 49 CB 0.0136 0.0234 0.0170 1450 SER 49 OG 0.0096 0.0180 0.0184 1451 ILE 50 N 0.0062 0.0243 0.0040 1452 ILE 50 CA 0.0013 0.0219 -0.0005 1453 ILE 50 C 0.0015 0.0262 -0.0063 1454 ILE 50 O 0.0043 0.0295 -0.0064 1455 ILE 50 CB -0.0013 0.0177 0.0013 1456 ILE 50 CG1 -0.0010 0.0137 0.0075 1457 ILE 50 CG2 -0.0066 0.0151 -0.0032 1458 ILE 50 CD1 -0.0052 0.0090 0.0075 1459 PHE 51 N 0.0040 0.0144 -0.0119 1460 PHE 51 CA 0.0028 0.0165 -0.0147 1461 PHE 51 C -0.0014 0.0149 -0.0150 1462 PHE 51 O -0.0041 0.0135 -0.0148 1463 PHE 51 CB 0.0028 0.0193 -0.0177 1464 PHE 51 CG 0.0068 0.0212 -0.0178 1465 PHE 51 CD1 0.0082 0.0206 -0.0165 1466 PHE 51 CD2 0.0092 0.0236 -0.0192 1467 PHE 51 CE1 0.0119 0.0223 -0.0165 1468 PHE 51 CE2 0.0129 0.0254 -0.0193 1469 PHE 51 CZ 0.0142 0.0247 -0.0179 1470 LEU 52 N -0.0019 0.0152 -0.0156 1471 LEU 52 CA -0.0058 0.0142 -0.0165 1472 LEU 52 C -0.0064 0.0170 -0.0197 1473 LEU 52 O -0.0042 0.0182 -0.0199 1474 LEU 52 CB -0.0062 0.0117 -0.0139 1475 LEU 52 CG -0.0096 0.0110 -0.0149 1476 LEU 52 CD1 -0.0136 0.0101 -0.0158 1477 LEU 52 CD2 -0.0094 0.0085 -0.0121 1478 GLN 53 N -0.0048 0.0115 -0.0179 1479 GLN 53 CA -0.0048 0.0108 -0.0167 1480 GLN 53 C -0.0049 0.0118 -0.0145 1481 GLN 53 O -0.0050 0.0138 -0.0143 1482 GLN 53 CB -0.0048 0.0114 -0.0179 1483 GLN 53 CG -0.0048 0.0108 -0.0167 1484 GLN 53 CD -0.0047 0.0105 -0.0181 1485 GLN 53 NE2 -0.0047 0.0093 -0.0173 1486 GLN 53 OE1 -0.0047 0.0114 -0.0199 1487 ILE 54 N -0.0050 0.0105 -0.0129 1488 ILE 54 CA -0.0051 0.0113 -0.0107 1489 ILE 54 C -0.0051 0.0108 -0.0100 1490 ILE 54 O -0.0051 0.0090 -0.0102 1491 ILE 54 CB -0.0052 0.0101 -0.0092 1492 ILE 54 CG1 -0.0051 0.0107 -0.0097 1493 ILE 54 CG2 -0.0053 0.0107 -0.0069 1494 ILE 54 CD1 -0.0052 0.0105 -0.0079 1495 LEU 55 N -0.0064 0.0080 -0.0029 1496 LEU 55 CA -0.0061 0.0068 -0.0017 1497 LEU 55 C -0.0047 0.0069 -0.0011 1498 LEU 55 O -0.0037 0.0079 -0.0014 1499 LEU 55 CB -0.0061 0.0064 -0.0013 1500 LEU 55 CG -0.0075 0.0058 -0.0015 1501 LEU 55 CD1 -0.0074 0.0061 -0.0017 1502 LEU 55 CD2 -0.0079 0.0045 -0.0005 1503 GLU 56 N -0.0046 0.0060 -0.0002 1504 GLU 56 CA -0.0033 0.0060 0.0005 1505 GLU 56 C -0.0030 0.0047 0.0017 1506 GLU 56 O -0.0040 0.0038 0.0020 1507 GLU 56 CB -0.0033 0.0062 0.0003 1508 GLU 56 CG -0.0028 0.0075 -0.0006 1509 GLU 56 CD -0.0033 0.0077 -0.0011 1510 GLU 56 OE1 -0.0042 0.0069 -0.0008 1511 GLU 56 OE2 -0.0028 0.0088 -0.0018 1512 GLY 57 N -0.0060 0.0041 0.0027 1513 GLY 57 CA -0.0054 0.0021 0.0022 1514 GLY 57 C -0.0045 -0.0013 0.0013 1515 GLY 57 O -0.0039 -0.0018 0.0005 1516 SER 58 N -0.0043 -0.0036 0.0015 1517 SER 58 CA -0.0034 -0.0069 0.0007 1518 SER 58 C -0.0046 -0.0086 0.0028 1519 SER 58 O -0.0063 -0.0077 0.0051 1520 SER 58 CB -0.0031 -0.0088 0.0005 1521 SER 58 OG -0.0048 -0.0093 0.0031 1522 ARG 59 N -0.0007 -0.0094 0.0013 1523 ARG 59 CA -0.0018 -0.0093 0.0015 1524 ARG 59 C -0.0039 -0.0112 0.0028 1525 ARG 59 O -0.0061 -0.0105 0.0031 1526 ARG 59 CB 0.0006 -0.0099 0.0010 1527 ARG 59 CG -0.0000 -0.0088 0.0009 1528 ARG 59 CD 0.0024 -0.0094 0.0003 1529 ARG 59 NE 0.0031 -0.0123 0.0010 1530 ARG 59 CZ 0.0053 -0.0134 0.0007 1531 ARG 59 NH1 0.0070 -0.0119 -0.0002 1532 ARG 59 NH2 0.0057 -0.0160 0.0014 1533 GLN 60 N -0.0034 -0.0137 0.0034 1534 GLN 60 CA -0.0053 -0.0158 0.0045 1535 GLN 60 C -0.0080 -0.0149 0.0051 1536 GLN 60 O -0.0102 -0.0152 0.0058 1537 GLN 60 CB -0.0041 -0.0185 0.0050 1538 GLN 60 CG -0.0061 -0.0207 0.0063 1539 GLN 60 CD -0.0072 -0.0214 0.0068 1540 GLN 60 NE2 -0.0092 -0.0230 0.0079 1541 GLN 60 OE1 -0.0062 -0.0206 0.0063 1542 ALA 61 N -0.0071 -0.0071 0.0124 1543 ALA 61 CA -0.0095 -0.0043 0.0145 1544 ALA 61 C -0.0096 -0.0041 0.0144 1545 ALA 61 O -0.0105 -0.0035 0.0174 1546 ALA 61 CB -0.0116 -0.0011 0.0127 1547 ILE 62 N -0.0088 -0.0045 0.0108 1548 ILE 62 CA -0.0088 -0.0044 0.0105 1549 ILE 62 C -0.0072 -0.0072 0.0133 1550 ILE 62 O -0.0079 -0.0066 0.0154 1551 ILE 62 CB -0.0080 -0.0046 0.0060 1552 ILE 62 CG1 -0.0101 -0.0013 0.0035 1553 ILE 62 CG2 -0.0072 -0.0057 0.0058 1554 ILE 62 CD1 -0.0096 -0.0012 -0.0007 1555 SER 63 N -0.0099 -0.0092 0.0085 1556 SER 63 CA -0.0021 -0.0106 0.0108 1557 SER 63 C -0.0016 -0.0081 0.0176 1558 SER 63 O 0.0024 -0.0091 0.0180 1559 SER 63 CB 0.0030 -0.0115 0.0124 1560 SER 63 OG 0.0030 -0.0141 0.0059 1561 HIS 64 N -0.0058 -0.0046 0.0231 1562 HIS 64 CA -0.0056 -0.0020 0.0297 1563 HIS 64 C -0.0091 -0.0017 0.0280 1564 HIS 64 O -0.0062 -0.0014 0.0310 1565 HIS 64 CB -0.0097 0.0015 0.0356 1566 HIS 64 CG -0.0078 0.0040 0.0432 1567 HIS 64 CD2 -0.0010 0.0036 0.0473 1568 HIS 64 ND1 -0.0133 0.0074 0.0475 1569 HIS 64 CE1 -0.0100 0.0089 0.0539 1570 HIS 64 NE2 -0.0025 0.0067 0.0539 1571 THR 65 N -0.0107 -0.0056 0.0237 1572 THR 65 CA -0.0127 -0.0066 0.0216 1573 THR 65 C -0.0101 -0.0073 0.0183 1574 THR 65 O -0.0101 -0.0075 0.0175 1575 THR 65 CB -0.0165 -0.0076 0.0203 1576 THR 65 CG2 -0.0184 -0.0087 0.0178 1577 THR 65 OG1 -0.0191 -0.0069 0.0235 1578 TYR 66 N -0.0080 -0.0076 0.0164 1579 TYR 66 CA -0.0053 -0.0082 0.0134 1580 TYR 66 C -0.0022 -0.0072 0.0148 1581 TYR 66 O -0.0011 -0.0076 0.0131 1582 TYR 66 CB -0.0036 -0.0086 0.0113 1583 TYR 66 CG -0.0012 -0.0094 0.0078 1584 TYR 66 CD1 -0.0029 -0.0106 0.0047 1585 TYR 66 CD2 0.0028 -0.0088 0.0077 1586 TYR 66 CE1 -0.0007 -0.0113 0.0015 1587 TYR 66 CE2 0.0050 -0.0095 0.0045 1588 TYR 66 CZ 0.0032 -0.0108 0.0015 1589 TYR 66 OH 0.0054 -0.0114 -0.0017 1590 HIS 67 N 0.0009 -0.0051 0.0197 1591 HIS 67 CA 0.0059 -0.0010 0.0192 1592 HIS 67 C 0.0074 -0.0012 0.0181 1593 HIS 67 O 0.0121 -0.0004 0.0154 1594 HIS 67 CB 0.0054 0.0044 0.0233 1595 HIS 67 CG 0.0099 0.0090 0.0234 1596 HIS 67 CD2 0.0152 0.0098 0.0205 1597 HIS 67 ND1 0.0092 0.0134 0.0270 1598 HIS 67 CE1 0.0138 0.0168 0.0262 1599 HIS 67 NE2 0.0176 0.0147 0.0223 1600 ARG 68 N 0.0035 -0.0021 0.0200 1601 ARG 68 CA 0.0047 -0.0026 0.0189 1602 ARG 68 C 0.0062 -0.0075 0.0145 1603 ARG 68 O 0.0096 -0.0074 0.0123 1604 ARG 68 CB -0.0002 -0.0026 0.0221 1605 ARG 68 CG 0.0009 -0.0027 0.0214 1606 ARG 68 CD -0.0041 -0.0030 0.0245 1607 ARG 68 NE -0.0083 -0.0022 0.0279 1608 ARG 68 CZ -0.0135 -0.0043 0.0299 1609 ARG 68 NH1 -0.0152 -0.0075 0.0288 1610 ARG 68 NH2 -0.0171 -0.0032 0.0330 1611 ILE 69 N 0.0032 -0.0082 0.0100 1612 ILE 69 CA 0.0047 -0.0133 0.0063 1613 ILE 69 C 0.0096 -0.0122 0.0027 1614 ILE 69 O 0.0127 -0.0144 -0.0009 1615 ILE 69 CB 0.0010 -0.0180 0.0072 1616 ILE 69 CG1 -0.0029 -0.0210 0.0090 1617 ILE 69 CG2 0.0032 -0.0222 0.0033 1618 ILE 69 CD1 -0.0068 -0.0256 0.0100 1619 LEU 70 N 0.0105 -0.0089 0.0036 1620 LEU 70 CA 0.0149 -0.0080 0.0003 1621 LEU 70 C 0.0194 -0.0053 -0.0021 1622 LEU 70 O 0.0232 -0.0060 -0.0057 1623 LEU 70 CB 0.0148 -0.0045 0.0021 1624 LEU 70 CG 0.0134 -0.0078 0.0017 1625 LEU 70 CD1 0.0133 -0.0038 0.0037 1626 LEU 70 CD2 0.0169 -0.0111 -0.0029 1627 GLN 71 N 0.0289 -0.0028 0.0011 1628 GLN 71 CA 0.0308 -0.0006 -0.0050 1629 GLN 71 C 0.0312 -0.0070 -0.0117 1630 GLN 71 O 0.0330 -0.0052 -0.0180 1631 GLN 71 CB 0.0302 0.0011 -0.0010 1632 GLN 71 CG 0.0294 0.0063 0.0067 1633 GLN 71 CD 0.0314 0.0146 0.0055 1634 GLN 71 NE2 0.0325 0.0207 0.0059 1635 GLN 71 OE1 0.0319 0.0156 0.0042 1636 ASP 72 N 0.0294 -0.0144 -0.0105 1637 ASP 72 CA 0.0293 -0.0212 -0.0161 1638 ASP 72 C 0.0313 -0.0204 -0.0237 1639 ASP 72 O 0.0314 -0.0199 -0.0234 1640 ASP 72 CB 0.0268 -0.0293 -0.0124 1641 ASP 72 CG 0.0262 -0.0361 -0.0156 1642 ASP 72 OD1 0.0277 -0.0375 -0.0230 1643 ASP 72 OD2 0.0242 -0.0400 -0.0105 1644 PRO 73 N 0.0217 -0.0181 -0.0100 1645 PRO 73 CA 0.0152 -0.0126 -0.0122 1646 PRO 73 C 0.0126 -0.0066 -0.0143 1647 PRO 73 O 0.0078 -0.0014 -0.0163 1648 PRO 73 CB 0.0080 -0.0186 -0.0106 1649 PRO 73 CG 0.0124 -0.0218 -0.0093 1650 PRO 73 CD 0.0184 -0.0260 -0.0076 1651 ARG 74 N 0.0151 -0.0074 -0.0139 1652 ARG 74 CA 0.0129 -0.0019 -0.0158 1653 ARG 74 C 0.0167 0.0062 -0.0183 1654 ARG 74 O 0.0136 0.0119 -0.0203 1655 ARG 74 CB 0.0153 -0.0055 -0.0145 1656 ARG 74 CG 0.0141 -0.0001 -0.0164 1657 ARG 74 CD 0.0123 -0.0044 -0.0151 1658 ARG 74 NE 0.0169 -0.0115 -0.0124 1659 ARG 74 CZ 0.0144 -0.0186 -0.0103 1660 ARG 74 NH1 0.0073 -0.0198 -0.0103 1661 ARG 74 NH2 0.0193 -0.0247 -0.0080 1662 HIS 75 N 0.0146 -0.0039 -0.0167 1663 HIS 75 CA 0.0136 -0.0035 -0.0137 1664 HIS 75 C 0.0090 -0.0064 -0.0137 1665 HIS 75 O 0.0069 -0.0086 -0.0164 1666 HIS 75 CB 0.0166 -0.0021 -0.0153 1667 HIS 75 CG 0.0164 -0.0038 -0.0201 1668 HIS 75 CD2 0.0193 -0.0032 -0.0240 1669 HIS 75 ND1 0.0126 -0.0066 -0.0214 1670 HIS 75 CE1 0.0134 -0.0076 -0.0258 1671 HIS 75 NE2 0.0174 -0.0056 -0.0275 1672 HIS 76 N 0.0075 -0.0063 -0.0106 1673 HIS 76 CA 0.0031 -0.0089 -0.0100 1674 HIS 76 C 0.0026 -0.0086 -0.0082 1675 HIS 76 O 0.0055 -0.0063 -0.0065 1676 HIS 76 CB 0.0002 -0.0096 -0.0067 1677 HIS 76 CG 0.0009 -0.0076 -0.0016 1678 HIS 76 CD2 -0.0019 -0.0080 0.0025 1679 HIS 76 ND1 0.0048 -0.0047 -0.0003 1680 HIS 76 CE1 0.0044 -0.0034 0.0044 1681 HIS 76 NE2 0.0004 -0.0054 0.0062 1682 SER 77 N -0.0032 -0.0116 -0.0119 1683 SER 77 CA -0.0039 -0.0119 -0.0112 1684 SER 77 C -0.0027 -0.0113 -0.0124 1685 SER 77 O -0.0021 -0.0106 -0.0113 1686 SER 77 CB -0.0039 -0.0115 -0.0086 1687 SER 77 OG -0.0052 -0.0122 -0.0074 1688 ALA 78 N -0.0023 -0.0114 -0.0147 1689 ALA 78 CA -0.0012 -0.0109 -0.0160 1690 ALA 78 C -0.0024 -0.0117 -0.0159 1691 ALA 78 O -0.0041 -0.0130 -0.0158 1692 ALA 78 CB -0.0008 -0.0110 -0.0185 1693 GLU 79 N -0.0087 -0.0124 -0.0137 1694 GLU 79 CA -0.0085 -0.0123 -0.0137 1695 GLU 79 C -0.0086 -0.0123 -0.0134 1696 GLU 79 O -0.0088 -0.0125 -0.0134 1697 GLU 79 CB -0.0086 -0.0123 -0.0140 1698 GLU 79 CG -0.0083 -0.0120 -0.0141 1699 GLU 79 CD -0.0084 -0.0121 -0.0145 1700 GLU 79 OE1 -0.0084 -0.0121 -0.0147 1701 GLU 79 OE2 -0.0083 -0.0120 -0.0145 1702 ILE 80 N -0.0084 -0.0122 -0.0132 1703 ILE 80 CA -0.0085 -0.0122 -0.0130 1704 ILE 80 C -0.0085 -0.0122 -0.0131 1705 ILE 80 O -0.0083 -0.0121 -0.0132 1706 ILE 80 CB -0.0083 -0.0121 -0.0127 1707 ILE 80 CG1 -0.0083 -0.0121 -0.0126 1708 ILE 80 CG2 -0.0084 -0.0122 -0.0124 1709 ILE 80 CD1 -0.0081 -0.0119 -0.0124 1710 ILE 81 N -0.0043 -0.0083 -0.0154 1711 ILE 81 CA -0.0034 -0.0067 -0.0155 1712 ILE 81 C -0.0013 -0.0067 -0.0146 1713 ILE 81 O -0.0003 -0.0053 -0.0146 1714 ILE 81 CB -0.0041 -0.0067 -0.0158 1715 ILE 81 CG1 -0.0058 -0.0057 -0.0168 1716 ILE 81 CG2 -0.0026 -0.0056 -0.0155 1717 ILE 81 CD1 -0.0067 -0.0059 -0.0171 1718 ALA 82 N -0.0007 -0.0084 -0.0138 1719 ALA 82 CA 0.0013 -0.0084 -0.0129 1720 ALA 82 C 0.0018 -0.0105 -0.0121 1721 ALA 82 O 0.0006 -0.0118 -0.0121 1722 ALA 82 CB 0.0023 -0.0076 -0.0128 1723 PHE 83 N -0.0004 -0.0011 -0.0072 1724 PHE 83 CA -0.0001 -0.0021 -0.0064 1725 PHE 83 C 0.0013 -0.0021 -0.0073 1726 PHE 83 O 0.0025 -0.0027 -0.0075 1727 PHE 83 CB 0.0001 -0.0033 -0.0053 1728 PHE 83 CG 0.0004 -0.0043 -0.0044 1729 PHE 83 CD1 0.0018 -0.0049 -0.0046 1730 PHE 83 CD2 -0.0007 -0.0046 -0.0033 1731 PHE 83 CE1 0.0021 -0.0058 -0.0038 1732 PHE 83 CE2 -0.0004 -0.0055 -0.0025 1733 PHE 83 CZ 0.0009 -0.0061 -0.0027 1734 ASP 84 N 0.0011 -0.0016 -0.0077 1735 ASP 84 CA 0.0024 -0.0016 -0.0086 1736 ASP 84 C 0.0024 -0.0018 -0.0083 1737 ASP 84 O 0.0012 -0.0016 -0.0078 1738 ASP 84 CB 0.0025 -0.0003 -0.0100 1739 ASP 84 CG 0.0011 0.0007 -0.0102 1740 ASP 84 OD1 -0.0001 0.0010 -0.0097 1741 ASP 84 OD2 0.0012 0.0013 -0.0109 1742 PRO 85 N 0.0040 0.0012 -0.0037 1743 PRO 85 CA 0.0042 0.0010 -0.0036 1744 PRO 85 C 0.0039 0.0027 -0.0048 1745 PRO 85 O 0.0042 0.0038 -0.0060 1746 PRO 85 CB 0.0061 -0.0002 -0.0039 1747 PRO 85 CG 0.0070 -0.0003 -0.0043 1748 PRO 85 CD 0.0057 0.0007 -0.0044 1749 VAL 86 N 0.0033 0.0028 -0.0045 1750 VAL 86 CA 0.0028 0.0043 -0.0055 1751 VAL 86 C 0.0035 0.0039 -0.0057 1752 VAL 86 O 0.0039 0.0025 -0.0047 1753 VAL 86 CB 0.0007 0.0052 -0.0049 1754 VAL 86 CG1 0.0001 0.0062 -0.0053 1755 VAL 86 CG2 -0.0002 0.0039 -0.0033 1756 LEU 87 N 0.0011 0.0044 0.0049 1757 LEU 87 CA -0.0002 0.0039 0.0071 1758 LEU 87 C -0.0001 0.0025 0.0066 1759 LEU 87 O -0.0006 0.0032 0.0077 1760 LEU 87 CB -0.0013 0.0022 0.0085 1761 LEU 87 CG -0.0027 0.0015 0.0109 1762 LEU 87 CD1 -0.0031 0.0037 0.0122 1763 LEU 87 CD2 -0.0036 0.0005 0.0124 1764 GLN 88 N 0.0005 0.0005 0.0050 1765 GLN 88 CA 0.0006 -0.0010 0.0045 1766 GLN 88 C 0.0019 -0.0019 0.0019 1767 GLN 88 O 0.0024 -0.0022 0.0008 1768 GLN 88 CB -0.0006 -0.0033 0.0060 1769 GLN 88 CG -0.0009 -0.0050 0.0062 1770 GLN 88 CD -0.0021 -0.0073 0.0077 1771 GLN 88 NE2 -0.0019 -0.0091 0.0069 1772 GLN 88 OE1 -0.0031 -0.0075 0.0095 1773 ARG 89 N -0.0019 0.0027 0.0042 1774 ARG 89 CA -0.0004 0.0024 0.0041 1775 ARG 89 C 0.0002 0.0011 0.0047 1776 ARG 89 O -0.0005 0.0006 0.0051 1777 ARG 89 CB 0.0005 0.0035 0.0033 1778 ARG 89 CG -0.0001 0.0048 0.0027 1779 ARG 89 CD 0.0011 0.0058 0.0020 1780 ARG 89 NE 0.0005 0.0071 0.0014 1781 ARG 89 CZ 0.0011 0.0081 0.0007 1782 ARG 89 NH1 0.0024 0.0079 0.0006 1783 ARG 89 NH2 0.0005 0.0093 0.0002 1784 GLU 90 N 0.0014 0.0006 0.0047 1785 GLU 90 CA 0.0022 -0.0005 0.0052 1786 GLU 90 C 0.0037 -0.0003 0.0048 1787 GLU 90 O 0.0044 -0.0012 0.0051 1788 GLU 90 CB 0.0022 -0.0017 0.0058 1789 GLU 90 CG 0.0007 -0.0021 0.0063 1790 GLU 90 CD 0.0005 -0.0034 0.0071 1791 GLU 90 OE1 0.0011 -0.0038 0.0072 1792 GLU 90 OE2 -0.0002 -0.0041 0.0076 1793 PHE 91 N 0.0040 0.0007 0.0069 1794 PHE 91 CA 0.0046 -0.0006 0.0049 1795 PHE 91 C 0.0047 -0.0009 0.0049 1796 PHE 91 O 0.0049 -0.0006 0.0031 1797 PHE 91 CB 0.0047 0.0006 0.0027 1798 PHE 91 CG 0.0046 0.0013 0.0028 1799 PHE 91 CD1 0.0049 -0.0002 0.0023 1800 PHE 91 CD2 0.0041 0.0035 0.0033 1801 PHE 91 CE1 0.0048 0.0004 0.0023 1802 PHE 91 CE2 0.0039 0.0041 0.0033 1803 PHE 91 CZ 0.0043 0.0026 0.0028 1804 VAL 92 N 0.0045 -0.0015 0.0068 1805 VAL 92 CA 0.0045 -0.0017 0.0071 1806 VAL 92 C 0.0050 -0.0034 0.0056 1807 VAL 92 O 0.0051 -0.0030 0.0047 1808 VAL 92 CB 0.0041 -0.0021 0.0096 1809 VAL 92 CG1 0.0043 -0.0039 0.0106 1810 VAL 92 CG2 0.0042 -0.0026 0.0098 1811 GLN 93 N 0.0087 -0.0047 0.0101 1812 GLN 93 CA 0.0084 -0.0074 0.0089 1813 GLN 93 C 0.0076 -0.0073 0.0062 1814 GLN 93 O 0.0075 -0.0090 0.0056 1815 GLN 93 CB 0.0084 -0.0089 0.0088 1816 GLN 93 CG 0.0091 -0.0081 0.0109 1817 GLN 93 CD 0.0087 -0.0060 0.0100 1818 GLN 93 NE2 0.0092 -0.0050 0.0118 1819 GLN 93 OE1 0.0080 -0.0052 0.0077 1820 TRP 94 N 0.0070 -0.0054 0.0046 1821 TRP 94 CA 0.0062 -0.0053 0.0019 1822 TRP 94 C 0.0060 -0.0032 0.0015 1823 TRP 94 O 0.0062 -0.0009 0.0023 1824 TRP 94 CB 0.0056 -0.0046 0.0001 1825 TRP 94 CG 0.0058 -0.0062 0.0005 1826 TRP 94 CD1 0.0061 -0.0054 0.0016 1827 TRP 94 CD2 0.0057 -0.0091 -0.0001 1828 TRP 94 CE2 0.0060 -0.0098 0.0006 1829 TRP 94 CE3 0.0055 -0.0111 -0.0013 1830 TRP 94 NE1 0.0062 -0.0075 0.0017 1831 TRP 94 CZ2 0.0060 -0.0124 0.0002 1832 TRP 94 CZ3 0.0055 -0.0137 -0.0017 1833 TRP 94 CH2 0.0057 -0.0143 -0.0009 1834 SER 95 N 0.0075 -0.0050 0.0005 1835 SER 95 CA 0.0082 -0.0025 -0.0000 1836 SER 95 C 0.0074 0.0003 -0.0041 1837 SER 95 O 0.0086 0.0040 -0.0044 1838 SER 95 CB 0.0073 -0.0054 0.0003 1839 SER 95 OG 0.0087 -0.0067 0.0044 1840 MET 96 N 0.0052 -0.0013 -0.0073 1841 MET 96 CA 0.0043 0.0012 -0.0112 1842 MET 96 C 0.0022 -0.0014 -0.0135 1843 MET 96 O 0.0007 -0.0051 -0.0137 1844 MET 96 CB 0.0036 0.0026 -0.0139 1845 MET 96 CG 0.0042 0.0071 -0.0162 1846 MET 96 SD 0.0072 0.0113 -0.0132 1847 MET 96 CE 0.0081 0.0104 -0.0107 1848 LYS 97 N 0.0041 0.0092 -0.0152 1849 LYS 97 CA 0.0059 0.0064 -0.0154 1850 LYS 97 C 0.0048 0.0081 -0.0163 1851 LYS 97 O 0.0030 0.0110 -0.0149 1852 LYS 97 CB 0.0072 0.0044 -0.0113 1853 LYS 97 CG 0.0096 0.0007 -0.0117 1854 LYS 97 CD 0.0107 -0.0011 -0.0156 1855 LYS 97 CE 0.0132 -0.0051 -0.0153 1856 LYS 97 NZ 0.0143 -0.0069 -0.0191 1857 LEU 98 N 0.0060 0.0062 -0.0187 1858 LEU 98 CA 0.0053 0.0074 -0.0198 1859 LEU 98 C 0.0068 0.0050 -0.0178 1860 LEU 98 O 0.0088 0.0018 -0.0178 1861 LEU 98 CB 0.0052 0.0073 -0.0246 1862 LEU 98 CG 0.0042 0.0089 -0.0265 1863 LEU 98 CD1 0.0022 0.0121 -0.0242 1864 LEU 98 CD2 0.0037 0.0096 -0.0311 1865 VAL 99 N 0.0206 -0.0073 -0.0021 1866 VAL 99 CA 0.0218 -0.0063 0.0001 1867 VAL 99 C 0.0202 -0.0060 0.0018 1868 VAL 99 O 0.0182 -0.0062 0.0026 1869 VAL 99 CB 0.0223 -0.0059 0.0010 1870 VAL 99 CG1 0.0200 -0.0063 0.0012 1871 VAL 99 CG2 0.0233 -0.0048 0.0035 1872 GLN 100 N 0.0211 -0.0056 0.0025 1873 GLN 100 CA 0.0198 -0.0053 0.0042 1874 GLN 100 C 0.0205 -0.0043 0.0067 1875 GLN 100 O 0.0224 -0.0038 0.0070 1876 GLN 100 CB 0.0204 -0.0053 0.0037 1877 GLN 100 CG 0.0189 -0.0063 0.0018 1878 GLN 100 CD 0.0204 -0.0065 0.0002 1879 GLN 100 NE2 0.0193 -0.0071 -0.0007 1880 GLN 100 OE1 0.0226 -0.0063 -0.0004 1881 ILE 101 N 0.0195 0.0085 0.0072 1882 ILE 101 CA 0.0199 0.0032 0.0121 1883 ILE 101 C 0.0265 0.0008 0.0130 1884 ILE 101 O 0.0269 -0.0032 0.0166 1885 ILE 101 CB 0.0141 0.0016 0.0148 1886 ILE 101 CG1 0.0143 0.0031 0.0134 1887 ILE 101 CG2 0.0077 0.0038 0.0141 1888 ILE 101 CD1 0.0109 -0.0000 0.0170 1889 ASP 102 N 0.0317 0.0031 0.0097 1890 ASP 102 CA 0.0382 0.0012 0.0101 1891 ASP 102 C 0.0406 -0.0040 0.0144 1892 ASP 102 O 0.0408 -0.0075 0.0176 1893 ASP 102 CB 0.0432 0.0046 0.0059 1894 ASP 102 CG 0.0429 0.0060 0.0047 1895 ASP 102 OD1 0.0408 0.0031 0.0078 1896 ASP 102 OD2 0.0446 0.0100 0.0006 1897 SER 105 N -0.0203 -0.0249 -0.0174 1898 SER 105 CA -0.0131 -0.0252 -0.0197 1899 SER 105 C -0.0073 -0.0172 -0.0150 1900 SER 105 O -0.0111 -0.0113 -0.0092 1901 SER 105 CB -0.0179 -0.0286 -0.0210 1902 SER 105 OG -0.0208 -0.0227 -0.0155 1903 PRO 106 N 0.0019 -0.0168 -0.0173 1904 PRO 106 CA 0.0079 -0.0093 -0.0131 1905 PRO 106 C 0.0043 -0.0058 -0.0092 1906 PRO 106 O -0.0001 -0.0099 -0.0112 1907 PRO 106 CB 0.0179 -0.0114 -0.0176 1908 PRO 106 CG 0.0163 -0.0200 -0.0240 1909 PRO 106 CD 0.0074 -0.0233 -0.0240 1910 GLU 107 N -0.0002 0.0135 0.0102 1911 GLU 107 CA -0.0050 0.0163 0.0157 1912 GLU 107 C -0.0016 0.0145 0.0120 1913 GLU 107 O -0.0061 0.0156 0.0154 1914 GLU 107 CB -0.0026 0.0246 0.0247 1915 GLU 107 CG 0.0090 0.0289 0.0248 1916 GLU 107 CD 0.0119 0.0317 0.0269 1917 GLU 107 OE1 0.0057 0.0341 0.0325 1918 GLU 107 OE2 0.0205 0.0314 0.0229 1919 LYS 108 N 0.0064 0.0117 0.0052 1920 LYS 108 CA 0.0096 0.0095 0.0010 1921 LYS 108 C 0.0010 0.0031 -0.0029 1922 LYS 108 O -0.0005 0.0028 -0.0026 1923 LYS 108 CB 0.0197 0.0075 -0.0058 1924 LYS 108 CG 0.0236 0.0049 -0.0107 1925 LYS 108 CD 0.0248 -0.0027 -0.0203 1926 LYS 108 CE 0.0297 -0.0049 -0.0252 1927 LYS 108 NZ 0.0342 -0.0109 -0.0344 1928 MET 109 N -0.0048 -0.0012 -0.0056 1929 MET 109 CA -0.0089 -0.0070 -0.0067 1930 MET 109 C -0.0130 -0.0075 -0.0025 1931 MET 109 O -0.0150 -0.0112 -0.0040 1932 MET 109 CB -0.0113 -0.0097 -0.0068 1933 MET 109 CG -0.0091 -0.0129 -0.0127 1934 MET 109 SD -0.0123 -0.0167 -0.0128 1935 MET 109 CE -0.0070 -0.0154 -0.0177 1936 ARG 110 N -0.0143 -0.0038 0.0029 1937 ARG 110 CA -0.0179 -0.0039 0.0071 1938 ARG 110 C -0.0156 -0.0022 0.0061 1939 ARG 110 O -0.0184 -0.0044 0.0072 1940 ARG 110 CB -0.0195 0.0000 0.0129 1941 ARG 110 CG -0.0228 -0.0020 0.0148 1942 ARG 110 CD -0.0229 0.0026 0.0198 1943 ARG 110 NE -0.0209 0.0038 0.0185 1944 ARG 110 CZ -0.0180 0.0088 0.0203 1945 ARG 110 NH1 -0.0167 0.0133 0.0234 1946 ARG 110 NH2 -0.0163 0.0094 0.0189 1947 ARG 111 N -0.0161 -0.0044 -0.0033 1948 ARG 111 CA -0.0138 -0.0032 -0.0049 1949 ARG 111 C -0.0123 -0.0061 -0.0065 1950 ARG 111 O -0.0115 -0.0061 -0.0071 1951 ARG 111 CB -0.0118 -0.0007 -0.0060 1952 ARG 111 CG -0.0096 0.0012 -0.0074 1953 ARG 111 CD -0.0107 0.0038 -0.0061 1954 ARG 111 NE -0.0105 0.0072 -0.0058 1955 ARG 111 CZ -0.0082 0.0092 -0.0072 1956 ARG 111 NH1 -0.0059 0.0083 -0.0091 1957 ARG 111 NH2 -0.0083 0.0122 -0.0067 1958 LEU 112 N -0.0118 -0.0086 -0.0072 1959 LEU 112 CA -0.0105 -0.0115 -0.0087 1960 LEU 112 C -0.0123 -0.0136 -0.0077 1961 LEU 112 O -0.0113 -0.0149 -0.0087 1962 LEU 112 CB -0.0099 -0.0137 -0.0096 1963 LEU 112 CG -0.0079 -0.0120 -0.0108 1964 LEU 112 CD1 -0.0066 -0.0145 -0.0122 1965 LEU 112 CD2 -0.0058 -0.0095 -0.0121 1966 TYR 113 N -0.0159 -0.0009 -0.0056 1967 TYR 113 CA -0.0137 -0.0036 -0.0043 1968 TYR 113 C -0.0122 -0.0043 -0.0078 1969 TYR 113 O -0.0096 -0.0069 -0.0087 1970 TYR 113 CB -0.0150 -0.0030 -0.0008 1971 TYR 113 CG -0.0150 -0.0040 0.0033 1972 TYR 113 CD1 -0.0127 -0.0068 0.0043 1973 TYR 113 CD2 -0.0175 -0.0021 0.0062 1974 TYR 113 CE1 -0.0127 -0.0076 0.0080 1975 TYR 113 CE2 -0.0175 -0.0029 0.0100 1976 TYR 113 CZ -0.0151 -0.0057 0.0109 1977 TYR 113 OH -0.0152 -0.0066 0.0146 1978 LEU 114 N -0.0139 -0.0021 -0.0097 1979 LEU 114 CA -0.0127 -0.0026 -0.0131 1980 LEU 114 C -0.0111 -0.0034 -0.0166 1981 LEU 114 O -0.0090 -0.0051 -0.0188 1982 LEU 114 CB -0.0150 0.0003 -0.0145 1983 LEU 114 CG -0.0142 -0.0001 -0.0167 1984 LEU 114 CD1 -0.0138 -0.0013 -0.0137 1985 LEU 114 CD2 -0.0164 0.0029 -0.0192 1986 LYS 115 N -0.0114 -0.0101 -0.0239 1987 LYS 115 CA -0.0079 -0.0096 -0.0224 1988 LYS 115 C -0.0025 -0.0089 -0.0198 1989 LYS 115 O 0.0015 -0.0071 -0.0209 1990 LYS 115 CB -0.0106 -0.0119 -0.0189 1991 LYS 115 CG -0.0085 -0.0112 -0.0189 1992 LYS 115 CD -0.0093 -0.0136 -0.0139 1993 LYS 115 CE -0.0137 -0.0147 -0.0146 1994 LYS 115 NZ -0.0137 -0.0166 -0.0100 1995 TYR 116 N -0.0025 -0.0103 -0.0163 1996 TYR 116 CA 0.0024 -0.0100 -0.0132 1997 TYR 116 C 0.0044 -0.0087 -0.0145 1998 TYR 116 O 0.0069 -0.0093 -0.0112 1999 TYR 116 CB 0.0018 -0.0126 -0.0074 2000 TYR 116 CG 0.0003 -0.0139 -0.0055 2001 TYR 116 CD1 0.0040 -0.0129 -0.0049 2002 TYR 116 CD2 -0.0047 -0.0161 -0.0041 2003 TYR 116 CE1 0.0027 -0.0140 -0.0032 2004 TYR 116 CE2 -0.0060 -0.0173 -0.0023 2005 TYR 116 CZ -0.0023 -0.0162 -0.0018 2006 TYR 116 OH -0.0037 -0.0174 -0.0000 2007 SER 117 N -0.0080 -0.0036 -0.0178 2008 SER 117 CA -0.0058 -0.0049 -0.0165 2009 SER 117 C -0.0061 -0.0027 -0.0216 2010 SER 117 O -0.0089 -0.0001 -0.0254 2011 SER 117 CB -0.0092 -0.0059 -0.0112 2012 SER 117 OG -0.0148 -0.0034 -0.0123 2013 GLY 118 N -0.0030 -0.0038 -0.0215 2014 GLY 118 CA -0.0031 -0.0020 -0.0258 2015 GLY 118 C -0.0066 -0.0015 -0.0239 2016 GLY 118 O -0.0065 -0.0002 -0.0271 2017 GLU 119 N -0.0102 -0.0106 -0.0139 2018 GLU 119 CA -0.0181 -0.0097 -0.0058 2019 GLU 119 C -0.0254 -0.0035 -0.0027 2020 GLU 119 O -0.0242 -0.0036 -0.0040 2021 GLU 119 CB -0.0176 -0.0199 0.0019 2022 GLU 119 CG -0.0093 -0.0274 -0.0013 2023 GLU 119 CD -0.0103 -0.0296 0.0015 2024 GLU 119 OE1 -0.0157 -0.0228 0.0021 2025 GLU 119 OE2 -0.0056 -0.0380 0.0031 2026 VAL 120 N -0.0329 0.0018 0.0014 2027 VAL 120 CA -0.0403 0.0085 0.0042 2028 VAL 120 C -0.0433 0.0028 0.0121 2029 VAL 120 O -0.0452 0.0053 0.0122 2030 VAL 120 CB -0.0474 0.0156 0.0064 2031 VAL 120 CG1 -0.0455 0.0239 -0.0023 2032 VAL 120 CG2 -0.0483 0.0101 0.0119 2033 ALA 121 N -0.0104 0.0098 0.0306 2034 ALA 121 CA -0.0101 0.0108 0.0305 2035 ALA 121 C -0.0110 0.0086 0.0245 2036 ALA 121 O -0.0123 0.0054 0.0211 2037 ALA 121 CB -0.0110 0.0078 0.0360 2038 PHE 122 N -0.0104 0.0105 0.0232 2039 PHE 122 CA -0.0112 0.0087 0.0177 2040 PHE 122 C -0.0135 0.0023 0.0184 2041 PHE 122 O -0.0139 0.0007 0.0223 2042 PHE 122 CB -0.0099 0.0123 0.0166 2043 PHE 122 CG -0.0105 0.0110 0.0107 2044 PHE 122 CD1 -0.0113 0.0090 0.0057 2045 PHE 122 CD2 -0.0102 0.0119 0.0102 2046 PHE 122 CE1 -0.0119 0.0079 0.0003 2047 PHE 122 CE2 -0.0108 0.0107 0.0048 2048 PHE 122 CZ -0.0116 0.0087 -0.0002 2049 MET 123 N -0.0089 0.0115 0.0140 2050 MET 123 CA -0.0102 0.0054 0.0144 2051 MET 123 C -0.0115 0.0032 0.0082 2052 MET 123 O -0.0124 0.0011 0.0056 2053 MET 123 CB -0.0105 0.0019 0.0178 2054 MET 123 CG -0.0107 -0.0021 0.0225 2055 MET 123 SD -0.0112 -0.0065 0.0261 2056 MET 123 CE -0.0096 -0.0011 0.0287 2057 PRO 124 N -0.0118 0.0038 0.0056 2058 PRO 124 CA -0.0129 0.0024 -0.0006 2059 PRO 124 C -0.0145 -0.0039 -0.0017 2060 PRO 124 O -0.0156 -0.0056 -0.0068 2061 PRO 124 CB -0.0124 0.0060 -0.0025 2062 PRO 124 CG -0.0112 0.0082 0.0030 2063 PRO 124 CD -0.0110 0.0058 0.0082 2064 GLU 125 N -0.0111 -0.0007 0.0020 2065 GLU 125 CA -0.0121 -0.0054 0.0011 2066 GLU 125 C -0.0114 -0.0043 0.0006 2067 GLU 125 O -0.0116 -0.0079 -0.0008 2068 GLU 125 CB -0.0159 -0.0085 0.0048 2069 GLU 125 CG -0.0182 -0.0063 0.0091 2070 GLU 125 CD -0.0194 -0.0029 0.0124 2071 GLU 125 OE1 -0.0191 -0.0032 0.0119 2072 GLU 125 OE2 -0.0206 0.0001 0.0156 2073 THR 126 N -0.0104 0.0006 0.0017 2074 THR 126 CA -0.0093 0.0021 0.0009 2075 THR 126 C -0.0055 0.0040 -0.0035 2076 THR 126 O -0.0042 0.0058 -0.0044 2077 THR 126 CB -0.0105 0.0064 0.0047 2078 THR 126 CG2 -0.0143 0.0047 0.0091 2079 THR 126 OG1 -0.0090 0.0109 0.0048 2080 MET 127 N 0.0025 0.0145 -0.0088 2081 MET 127 CA 0.0075 0.0134 -0.0066 2082 MET 127 C 0.0146 0.0118 -0.0034 2083 MET 127 O 0.0148 0.0084 -0.0018 2084 MET 127 CB 0.0043 0.0074 -0.0049 2085 MET 127 CG -0.0002 0.0095 -0.0074 2086 MET 127 SD -0.0036 0.0019 -0.0051 2087 MET 127 CE -0.0104 0.0052 -0.0089 2088 THR 128 N 0.0205 0.0143 -0.0026 2089 THR 128 CA 0.0276 0.0123 0.0007 2090 THR 128 C 0.0281 0.0051 0.0042 2091 THR 128 O 0.0241 0.0026 0.0040 2092 THR 128 CB 0.0336 0.0176 0.0003 2093 THR 128 CG2 0.0317 0.0249 -0.0036 2094 THR 128 OG1 0.0344 0.0162 0.0013 2095 PRO 129 N 0.0190 0.0174 0.0056 2096 PRO 129 CA 0.0200 0.0096 0.0090 2097 PRO 129 C 0.0222 0.0071 0.0115 2098 PRO 129 O 0.0203 0.0005 0.0122 2099 PRO 129 CB 0.0249 0.0097 0.0128 2100 PRO 129 CG 0.0268 0.0177 0.0116 2101 PRO 129 CD 0.0219 0.0217 0.0063 2102 ALA 130 N 0.0260 0.0120 0.0129 2103 ALA 130 CA 0.0282 0.0099 0.0154 2104 ALA 130 C 0.0229 0.0078 0.0119 2105 ALA 130 O 0.0225 0.0022 0.0135 2106 ALA 130 CB 0.0332 0.0162 0.0172 2107 GLN 131 N 0.0154 0.0092 0.0064 2108 GLN 131 CA 0.0115 0.0068 0.0029 2109 GLN 131 C 0.0087 0.0030 0.0032 2110 GLN 131 O 0.0057 -0.0007 0.0029 2111 GLN 131 CB 0.0108 0.0102 -0.0023 2112 GLN 131 CG 0.0128 0.0135 -0.0032 2113 GLN 131 CD 0.0128 0.0173 -0.0080 2114 GLN 131 NE2 0.0142 0.0202 -0.0093 2115 GLN 131 OE1 0.0115 0.0177 -0.0105 2116 CYS 132 N 0.0096 0.0037 0.0039 2117 CYS 132 CA 0.0072 -0.0000 0.0045 2118 CYS 132 C 0.0069 -0.0040 0.0090 2119 CYS 132 O 0.0038 -0.0080 0.0087 2120 CYS 132 CB 0.0087 0.0017 0.0048 2121 CYS 132 SG 0.0080 0.0053 -0.0008 2122 LEU 133 N 0.0050 0.0048 0.0104 2123 LEU 133 CA 0.0038 0.0026 0.0141 2124 LEU 133 C 0.0032 -0.0029 0.0151 2125 LEU 133 O 0.0029 -0.0062 0.0153 2126 LEU 133 CB 0.0026 0.0058 0.0189 2127 LEU 133 CG 0.0013 0.0038 0.0232 2128 LEU 133 CD1 0.0016 0.0033 0.0219 2129 LEU 133 CD2 0.0003 0.0072 0.0277 2130 GLN 134 N 0.0029 -0.0040 0.0156 2131 GLN 134 CA 0.0023 -0.0092 0.0165 2132 GLN 134 C 0.0033 -0.0128 0.0123 2133 GLN 134 O 0.0028 -0.0170 0.0130 2134 GLN 134 CB 0.0020 -0.0094 0.0175 2135 GLN 134 CG 0.0006 -0.0082 0.0228 2136 GLN 134 CD -0.0006 -0.0118 0.0264 2137 GLN 134 NE2 -0.0017 -0.0098 0.0308 2138 GLN 134 OE1 -0.0006 -0.0162 0.0253 2139 PHE 135 N -0.0025 -0.0057 0.0101 2140 PHE 135 CA -0.0015 -0.0074 0.0078 2141 PHE 135 C -0.0009 -0.0082 0.0064 2142 PHE 135 O 0.0000 -0.0105 0.0058 2143 PHE 135 CB -0.0017 -0.0059 0.0057 2144 PHE 135 CG -0.0007 -0.0072 0.0030 2145 PHE 135 CD1 0.0003 -0.0099 0.0031 2146 PHE 135 CD2 -0.0008 -0.0059 0.0005 2147 PHE 135 CE1 0.0012 -0.0112 0.0006 2148 PHE 135 CE2 0.0001 -0.0071 -0.0020 2149 PHE 135 CZ 0.0011 -0.0098 -0.0019 2150 MET 136 N -0.0016 -0.0063 0.0060 2151 MET 136 CA -0.0011 -0.0069 0.0046 2152 MET 136 C -0.0008 -0.0085 0.0064 2153 MET 136 O -0.0001 -0.0099 0.0054 2154 MET 136 CB -0.0019 -0.0042 0.0036 2155 MET 136 CG -0.0019 -0.0030 0.0009 2156 MET 136 SD -0.0009 -0.0041 -0.0023 2157 MET 136 CE -0.0011 -0.0040 -0.0016 2158 ILE 137 N 0.0041 -0.0110 0.0077 2159 ILE 137 CA 0.0026 -0.0128 0.0101 2160 ILE 137 C 0.0029 -0.0166 0.0095 2161 ILE 137 O 0.0027 -0.0182 0.0098 2162 ILE 137 CB 0.0007 -0.0120 0.0130 2163 ILE 137 CG1 0.0000 -0.0085 0.0142 2164 ILE 137 CG2 -0.0007 -0.0149 0.0152 2165 ILE 137 CD1 -0.0016 -0.0074 0.0168 2166 ASP 138 N 0.0034 -0.0182 0.0086 2167 ASP 138 CA 0.0035 -0.0220 0.0084 2168 ASP 138 C 0.0051 -0.0234 0.0059 2169 ASP 138 O 0.0051 -0.0265 0.0059 2170 ASP 138 CB 0.0038 -0.0231 0.0080 2171 ASP 138 CG 0.0021 -0.0226 0.0107 2172 ASP 138 OD1 0.0007 -0.0214 0.0129 2173 ASP 138 OD2 0.0021 -0.0234 0.0106 2174 ILE 139 N 0.0076 -0.0148 0.0048 2175 ILE 139 CA 0.0087 -0.0142 0.0050 2176 ILE 139 C 0.0085 -0.0123 0.0054 2177 ILE 139 O 0.0096 -0.0116 0.0057 2178 ILE 139 CB 0.0105 -0.0147 0.0051 2179 ILE 139 CG1 0.0112 -0.0138 0.0054 2180 ILE 139 CG2 0.0106 -0.0165 0.0048 2181 ILE 139 CD1 0.0130 -0.0138 0.0056 2182 ASP 140 N 0.0072 -0.0116 0.0054 2183 ASP 140 CA 0.0069 -0.0099 0.0058 2184 ASP 140 C 0.0066 -0.0094 0.0058 2185 ASP 140 O 0.0056 -0.0101 0.0056 2186 ASP 140 CB 0.0054 -0.0093 0.0057 2187 ASP 140 CG 0.0054 -0.0075 0.0061 2188 ASP 140 OD1 0.0064 -0.0066 0.0064 2189 ASP 140 OD2 0.0043 -0.0070 0.0061 2190 PRO 141 N 0.0061 -0.0035 0.0069 2191 PRO 141 CA 0.0018 -0.0008 0.0076 2192 PRO 141 C -0.0007 0.0006 0.0065 2193 PRO 141 O -0.0043 0.0027 0.0054 2194 PRO 141 CB 0.0019 -0.0001 0.0128 2195 PRO 141 CG 0.0060 -0.0024 0.0142 2196 PRO 141 CD 0.0088 -0.0046 0.0106 2197 ALA 142 N 0.0011 -0.0004 0.0068 2198 ALA 142 CA -0.0011 0.0008 0.0057 2199 ALA 142 C -0.0017 0.0004 0.0005 2200 ALA 142 O -0.0029 0.0010 -0.0009 2201 ALA 142 CB 0.0010 -0.0002 0.0081 2202 ARG 143 N -0.0108 0.0099 -0.0003 2203 ARG 143 CA -0.0087 0.0134 -0.0083 2204 ARG 143 C -0.0139 0.0205 -0.0103 2205 ARG 143 O -0.0128 0.0241 -0.0169 2206 ARG 143 CB -0.0033 0.0096 -0.0114 2207 ARG 143 CG 0.0029 0.0041 -0.0133 2208 ARG 143 CD 0.0081 0.0005 -0.0162 2209 ARG 143 NE 0.0141 -0.0043 -0.0188 2210 ARG 143 CZ 0.0169 -0.0105 -0.0146 2211 ARG 143 NH1 0.0143 -0.0128 -0.0073 2212 ARG 143 NH2 0.0225 -0.0144 -0.0176 2213 SER 144 N -0.0194 0.0225 -0.0047 2214 SER 144 CA -0.0247 0.0292 -0.0059 2215 SER 144 C -0.0230 0.0315 -0.0116 2216 SER 144 O -0.0240 0.0367 -0.0171 2217 SER 144 CB -0.0276 0.0342 -0.0082 2218 SER 144 OG -0.0231 0.0334 -0.0140