1 GLY 5 N 0.0018 -0.0525 -0.0352 2 GLY 5 CA 0.0019 -0.0479 -0.0298 3 GLY 5 C 0.0047 -0.0390 -0.0241 4 GLY 5 O 0.0096 -0.0343 -0.0273 5 LEU 6 N 0.0017 -0.0366 -0.0157 6 LEU 6 CA 0.0038 -0.0282 -0.0094 7 LEU 6 C -0.0018 -0.0294 -0.0008 8 LEU 6 O -0.0074 -0.0348 0.0028 9 LEU 6 CB 0.0061 -0.0229 -0.0072 10 LEU 6 CG 0.0107 -0.0131 -0.0037 11 LEU 6 CD1 0.0161 -0.0099 -0.0095 12 LEU 6 CD2 0.0137 -0.0086 -0.0035 13 TYR 7 N 0.0044 -0.0168 -0.0034 14 TYR 7 CA 0.0028 -0.0185 0.0006 15 TYR 7 C 0.0047 -0.0157 0.0035 16 TYR 7 O 0.0068 -0.0131 0.0020 17 TYR 7 CB 0.0005 -0.0216 -0.0007 18 TYR 7 CG -0.0019 -0.0249 -0.0025 19 TYR 7 CD1 -0.0018 -0.0251 -0.0068 20 TYR 7 CD2 -0.0043 -0.0278 0.0002 21 TYR 7 CE1 -0.0040 -0.0282 -0.0085 22 TYR 7 CE2 -0.0065 -0.0309 -0.0014 23 TYR 7 CZ -0.0063 -0.0310 -0.0058 24 TYR 7 OH -0.0085 -0.0340 -0.0074 25 ARG 8 N 0.0038 -0.0164 0.0079 26 ARG 8 CA 0.0053 -0.0142 0.0112 27 ARG 8 C 0.0034 -0.0164 0.0139 28 ARG 8 O 0.0013 -0.0191 0.0157 29 ARG 8 CB 0.0066 -0.0122 0.0143 30 ARG 8 CG 0.0083 -0.0097 0.0177 31 ARG 8 CD 0.0091 -0.0083 0.0212 32 ARG 8 NE 0.0111 -0.0058 0.0195 33 ARG 8 CZ 0.0110 -0.0059 0.0202 34 ARG 8 NH1 0.0090 -0.0083 0.0228 35 ARG 8 NH2 0.0129 -0.0035 0.0184 36 MET 9 N 0.0032 -0.0078 0.0065 37 MET 9 CA 0.0030 -0.0065 0.0067 38 MET 9 C 0.0030 -0.0069 0.0066 39 MET 9 O 0.0035 -0.0078 0.0072 40 MET 9 CB 0.0035 -0.0058 0.0080 41 MET 9 CG 0.0036 -0.0051 0.0086 42 MET 9 SD 0.0041 -0.0042 0.0102 43 MET 9 CE 0.0036 -0.0029 0.0098 44 THR 10 N 0.0025 -0.0063 0.0057 45 THR 10 CA 0.0025 -0.0065 0.0056 46 THR 10 C 0.0023 -0.0051 0.0059 47 THR 10 O 0.0019 -0.0041 0.0055 48 THR 10 CB 0.0020 -0.0071 0.0042 49 THR 10 CG2 0.0013 -0.0063 0.0032 50 THR 10 OG1 0.0019 -0.0072 0.0040 51 TYR 11 N 0.0052 0.0013 0.0050 52 TYR 11 CA 0.0053 0.0023 0.0052 53 TYR 11 C 0.0052 0.0018 0.0051 54 TYR 11 O 0.0051 0.0006 0.0051 55 TYR 11 CB 0.0056 0.0030 0.0065 56 TYR 11 CG 0.0059 0.0023 0.0077 57 TYR 11 CD1 0.0060 0.0012 0.0083 58 TYR 11 CD2 0.0060 0.0026 0.0081 59 TYR 11 CE1 0.0062 0.0006 0.0094 60 TYR 11 CE2 0.0062 0.0020 0.0091 61 TYR 11 CZ 0.0064 0.0010 0.0098 62 TYR 11 OH 0.0066 0.0003 0.0108 63 ILE 12 N 0.0052 0.0027 0.0050 64 ILE 12 CA 0.0052 0.0024 0.0049 65 ILE 12 C 0.0055 0.0031 0.0059 66 ILE 12 O 0.0057 0.0040 0.0065 67 ILE 12 CB 0.0049 0.0027 0.0035 68 ILE 12 CG1 0.0049 0.0042 0.0033 69 ILE 12 CG2 0.0046 0.0020 0.0025 70 ILE 12 CD1 0.0045 0.0046 0.0019 71 SER 13 N 0.0092 0.0054 0.0084 72 SER 13 CA 0.0102 0.0070 0.0098 73 SER 13 C 0.0095 0.0068 0.0082 74 SER 13 O 0.0082 0.0049 0.0066 75 SER 13 CB 0.0112 0.0059 0.0129 76 SER 13 OG 0.0107 0.0040 0.0133 77 ARG 14 N 0.0103 0.0088 0.0086 78 ARG 14 CA 0.0098 0.0090 0.0073 79 ARG 14 C 0.0104 0.0080 0.0095 80 ARG 14 O 0.0117 0.0093 0.0117 81 ARG 14 CB 0.0101 0.0120 0.0058 82 ARG 14 CG 0.0096 0.0131 0.0036 83 ARG 14 CD 0.0096 0.0158 0.0017 84 ARG 14 NE 0.0091 0.0170 -0.0004 85 ARG 14 CZ 0.0078 0.0161 -0.0030 86 ARG 14 NH1 0.0068 0.0141 -0.0039 87 ARG 14 NH2 0.0074 0.0174 -0.0047 88 ALA 15 N 0.0094 -0.0001 0.0075 89 ALA 15 CA 0.0068 -0.0013 0.0078 90 ALA 15 C 0.0072 -0.0020 0.0048 91 ALA 15 O 0.0088 -0.0020 0.0020 92 ALA 15 CB 0.0036 -0.0028 0.0080 93 VAL 16 N 0.0057 -0.0025 0.0053 94 VAL 16 CA 0.0058 -0.0033 0.0027 95 VAL 16 C 0.0037 -0.0050 -0.0000 96 VAL 16 O 0.0014 -0.0059 0.0008 97 VAL 16 CB 0.0046 -0.0034 0.0042 98 VAL 16 CG1 0.0072 -0.0016 0.0061 99 VAL 16 CG2 0.0015 -0.0041 0.0066 100 PRO 17 N 0.0065 -0.0100 -0.0051 101 PRO 17 CA 0.0012 -0.0024 -0.0048 102 PRO 17 C -0.0011 0.0045 -0.0092 103 PRO 17 O -0.0065 0.0103 -0.0065 104 PRO 17 CB 0.0032 -0.0020 -0.0090 105 PRO 17 CG 0.0098 -0.0085 -0.0128 106 PRO 17 CD 0.0118 -0.0143 -0.0093 107 GLY 18 N 0.0029 0.0040 -0.0159 108 GLY 18 CA 0.0013 0.0105 -0.0210 109 GLY 18 C -0.0004 0.0111 -0.0185 110 GLY 18 O -0.0005 0.0152 -0.0235 111 LEU 19 N -0.0018 -0.0051 0.0003 112 LEU 19 CA -0.0021 -0.0056 0.0011 113 LEU 19 C -0.0045 -0.0016 0.0015 114 LEU 19 O -0.0068 0.0008 0.0030 115 LEU 19 CB -0.0030 -0.0091 0.0048 116 LEU 19 CG -0.0026 -0.0108 0.0055 117 LEU 19 CD1 0.0006 -0.0142 0.0035 118 LEU 19 CD2 -0.0049 -0.0125 0.0097 119 GLY 20 N -0.0040 -0.0007 0.0001 120 GLY 20 CA -0.0060 0.0031 0.0003 121 GLY 20 C -0.0068 0.0023 0.0019 122 GLY 20 O -0.0059 -0.0013 0.0032 123 TYR 21 N -0.0016 0.0087 -0.0008 124 TYR 21 CA -0.0020 0.0080 0.0001 125 TYR 21 C 0.0014 0.0058 -0.0036 126 TYR 21 O 0.0015 0.0028 -0.0028 127 TYR 21 CB -0.0039 0.0133 0.0008 128 TYR 21 CG -0.0077 0.0150 0.0051 129 TYR 21 CD1 -0.0087 0.0180 0.0055 130 TYR 21 CD2 -0.0102 0.0137 0.0087 131 TYR 21 CE1 -0.0122 0.0196 0.0094 132 TYR 21 CE2 -0.0136 0.0153 0.0126 133 TYR 21 CZ -0.0146 0.0182 0.0129 134 TYR 21 OH -0.0180 0.0198 0.0168 135 ASN 22 N 0.0041 0.0073 -0.0076 136 ASN 22 CA 0.0074 0.0055 -0.0113 137 ASN 22 C 0.0087 -0.0005 -0.0110 138 ASN 22 O 0.0099 -0.0033 -0.0116 139 ASN 22 CB 0.0100 0.0082 -0.0155 140 ASN 22 CG 0.0089 0.0142 -0.0161 141 ASN 22 ND2 0.0103 0.0170 -0.0188 142 ASN 22 OD1 0.0068 0.0163 -0.0141 143 ASP 23 N 0.0070 -0.0038 -0.0053 144 ASP 23 CA 0.0060 -0.0094 -0.0059 145 ASP 23 C 0.0040 -0.0120 -0.0042 146 ASP 23 O 0.0044 -0.0160 -0.0062 147 ASP 23 CB 0.0040 -0.0107 -0.0038 148 ASP 23 CG 0.0061 -0.0094 -0.0060 149 ASP 23 OD1 0.0079 -0.0122 -0.0094 150 ASP 23 OD2 0.0060 -0.0055 -0.0045 151 LEU 24 N 0.0018 -0.0097 -0.0006 152 LEU 24 CA -0.0002 -0.0119 0.0012 153 LEU 24 C 0.0020 -0.0123 -0.0017 154 LEU 24 O 0.0014 -0.0163 -0.0024 155 LEU 24 CB -0.0027 -0.0088 0.0055 156 LEU 24 CG -0.0058 -0.0098 0.0092 157 LEU 24 CD1 -0.0079 -0.0061 0.0132 158 LEU 24 CD2 -0.0079 -0.0153 0.0099 159 ARG 25 N -0.0013 -0.0017 -0.0051 160 ARG 25 CA 0.0006 -0.0025 -0.0070 161 ARG 25 C 0.0044 -0.0065 -0.0107 162 ARG 25 O 0.0052 -0.0099 -0.0114 163 ARG 25 CB 0.0016 0.0033 -0.0082 164 ARG 25 CG 0.0048 0.0069 -0.0115 165 ARG 25 CD 0.0062 0.0120 -0.0131 166 ARG 25 NE 0.0068 0.0173 -0.0139 167 ARG 25 CZ 0.0048 0.0223 -0.0119 168 ARG 25 NH1 0.0018 0.0228 -0.0090 169 ARG 25 NH2 0.0056 0.0268 -0.0129 170 ASP 26 N 0.0067 -0.0064 -0.0131 171 ASP 26 CA 0.0102 -0.0106 -0.0164 172 ASP 26 C 0.0087 -0.0168 -0.0147 173 ASP 26 O 0.0104 -0.0207 -0.0163 174 ASP 26 CB 0.0126 -0.0092 -0.0188 175 ASP 26 CG 0.0165 -0.0130 -0.0226 176 ASP 26 OD1 0.0189 -0.0133 -0.0251 177 ASP 26 OD2 0.0170 -0.0156 -0.0231 178 ILE 27 N 0.0051 -0.0112 -0.0089 179 ILE 27 CA 0.0052 -0.0131 -0.0076 180 ILE 27 C 0.0045 -0.0133 -0.0063 181 ILE 27 O 0.0049 -0.0148 -0.0059 182 ILE 27 CB 0.0047 -0.0135 -0.0066 183 ILE 27 CG1 0.0056 -0.0136 -0.0079 184 ILE 27 CG2 0.0047 -0.0154 -0.0051 185 ILE 27 CD1 0.0049 -0.0130 -0.0073 186 MET 28 N 0.0033 -0.0117 -0.0056 187 MET 28 CA 0.0024 -0.0117 -0.0043 188 MET 28 C 0.0031 -0.0120 -0.0051 189 MET 28 O 0.0031 -0.0132 -0.0043 190 MET 28 CB 0.0011 -0.0098 -0.0036 191 MET 28 CG -0.0000 -0.0097 -0.0019 192 MET 28 SD 0.0002 -0.0101 -0.0019 193 MET 28 CE 0.0004 -0.0082 -0.0038 194 GLY 29 N 0.0028 -0.0131 -0.0039 195 GLY 29 CA 0.0010 -0.0131 0.0004 196 GLY 29 C 0.0037 -0.0105 0.0035 197 GLY 29 O 0.0034 -0.0096 0.0073 198 LYS 30 N 0.0064 -0.0091 0.0019 199 LYS 30 CA 0.0092 -0.0065 0.0047 200 LYS 30 C 0.0115 -0.0046 0.0059 201 LYS 30 O 0.0122 -0.0030 0.0097 202 LYS 30 CB 0.0118 -0.0054 0.0023 203 LYS 30 CG 0.0099 -0.0067 0.0019 204 LYS 30 CD 0.0126 -0.0056 -0.0006 205 LYS 30 CE 0.0108 -0.0070 -0.0011 206 LYS 30 NZ 0.0134 -0.0060 -0.0038 207 SER 31 N 0.0086 0.0014 -0.0010 208 SER 31 CA 0.0096 0.0018 0.0001 209 SER 31 C 0.0080 0.0011 0.0026 210 SER 31 O 0.0091 0.0015 0.0048 211 SER 31 CB 0.0097 0.0018 -0.0021 212 SER 31 OG 0.0072 0.0008 -0.0031 213 GLU 32 N 0.0054 0.0001 0.0023 214 GLU 32 CA 0.0038 -0.0006 0.0046 215 GLU 32 C 0.0042 -0.0004 0.0071 216 GLU 32 O 0.0046 -0.0003 0.0094 217 GLU 32 CB 0.0010 -0.0018 0.0037 218 GLU 32 CG -0.0003 -0.0023 0.0037 219 GLU 32 CD -0.0028 -0.0033 0.0020 220 GLU 32 OE1 -0.0039 -0.0037 0.0015 221 GLU 32 OE2 -0.0036 -0.0036 0.0012 222 VAL 33 N 0.0086 -0.0039 0.0097 223 VAL 33 CA 0.0087 -0.0035 0.0140 224 VAL 33 C 0.0077 0.0016 0.0137 225 VAL 33 O 0.0077 0.0017 0.0138 226 VAL 33 CB 0.0089 -0.0041 0.0192 227 VAL 33 CG1 0.0086 -0.0019 0.0236 228 VAL 33 CG2 0.0100 -0.0096 0.0202 229 ASN 34 N 0.0069 0.0058 0.0132 230 ASN 34 CA 0.0060 0.0108 0.0134 231 ASN 34 C 0.0057 0.0116 0.0087 232 ASN 34 O 0.0054 0.0133 0.0094 233 ASN 34 CB 0.0052 0.0151 0.0136 234 ASN 34 CG 0.0053 0.0152 0.0187 235 ASN 34 ND2 0.0059 0.0121 0.0191 236 ASN 34 OD1 0.0048 0.0180 0.0223 237 ASN 35 N 0.0069 0.0086 0.0045 238 ASN 35 CA 0.0075 0.0100 0.0020 239 ASN 35 C 0.0087 0.0101 0.0005 240 ASN 35 O 0.0086 0.0117 -0.0015 241 ASN 35 CB 0.0090 0.0094 0.0012 242 ASN 35 CG 0.0077 0.0097 0.0022 243 ASN 35 ND2 0.0077 0.0108 0.0007 244 ASN 35 OD1 0.0065 0.0090 0.0044 245 SER 36 N 0.0099 0.0085 0.0014 246 SER 36 CA 0.0107 0.0087 0.0002 247 SER 36 C 0.0086 0.0102 0.0004 248 SER 36 O 0.0087 0.0115 -0.0013 249 SER 36 CB 0.0121 0.0066 0.0013 250 SER 36 OG 0.0108 0.0063 0.0033 251 HIS 37 N 0.0108 0.0114 0.0025 252 HIS 37 CA 0.0069 0.0131 0.0012 253 HIS 37 C 0.0036 0.0156 -0.0021 254 HIS 37 O 0.0024 0.0176 -0.0056 255 HIS 37 CB 0.0037 0.0120 0.0055 256 HIS 37 CG -0.0013 0.0139 0.0045 257 HIS 37 CD2 -0.0060 0.0143 0.0065 258 HIS 37 ND1 -0.0017 0.0156 0.0010 259 HIS 37 CE1 -0.0064 0.0170 0.0009 260 HIS 37 NE2 -0.0091 0.0162 0.0042 261 VAL 38 N 0.0022 0.0154 -0.0010 262 VAL 38 CA -0.0011 0.0177 -0.0038 263 VAL 38 C 0.0016 0.0189 -0.0080 264 VAL 38 O -0.0004 0.0212 -0.0117 265 VAL 38 CB -0.0044 0.0172 -0.0008 266 VAL 38 CG1 -0.0091 0.0196 -0.0032 267 VAL 38 CG2 -0.0060 0.0154 0.0041 268 GLY 39 N 0.0067 0.0124 -0.0084 269 GLY 39 CA 0.0083 0.0139 -0.0076 270 GLY 39 C 0.0091 0.0125 -0.0048 271 GLY 39 O 0.0093 0.0126 -0.0046 272 LEU 40 N 0.0094 0.0111 -0.0028 273 LEU 40 CA 0.0103 0.0098 0.0000 274 LEU 40 C 0.0127 0.0112 0.0020 275 LEU 40 O 0.0132 0.0121 0.0017 276 LEU 40 CB 0.0088 0.0069 0.0011 277 LEU 40 CG 0.0063 0.0051 -0.0006 278 LEU 40 CD1 0.0050 0.0027 0.0002 279 LEU 40 CD2 0.0060 0.0042 -0.0001 280 THR 41 N 0.0065 0.0107 -0.0012 281 THR 41 CA 0.0058 0.0118 -0.0006 282 THR 41 C 0.0073 0.0101 -0.0006 283 THR 41 O 0.0088 0.0083 -0.0009 284 THR 41 CB 0.0056 0.0136 0.0019 285 THR 41 CG2 0.0041 0.0152 0.0018 286 THR 41 OG1 0.0075 0.0127 0.0038 287 GLY 42 N 0.0068 0.0108 -0.0003 288 GLY 42 CA 0.0082 0.0094 -0.0002 289 GLY 42 C 0.0071 0.0099 -0.0013 290 GLY 42 O 0.0054 0.0117 -0.0015 291 LEU 43 N -0.0036 0.0041 0.0018 292 LEU 43 CA -0.0027 0.0006 0.0017 293 LEU 43 C -0.0026 -0.0013 0.0018 294 LEU 43 O -0.0019 0.0001 0.0013 295 LEU 43 CB 0.0004 0.0003 0.0000 296 LEU 43 CG 0.0018 -0.0032 -0.0004 297 LEU 43 CD1 -0.0001 -0.0049 0.0008 298 LEU 43 CD2 0.0049 -0.0028 -0.0021 299 LEU 44 N -0.0034 -0.0046 0.0026 300 LEU 44 CA -0.0036 -0.0067 0.0029 301 LEU 44 C -0.0016 -0.0100 0.0022 302 LEU 44 O -0.0018 -0.0116 0.0024 303 LEU 44 CB -0.0068 -0.0076 0.0047 304 LEU 44 CG -0.0074 -0.0104 0.0053 305 LEU 44 CD1 -0.0063 -0.0096 0.0047 306 LEU 44 CD2 -0.0107 -0.0112 0.0072 307 CYS 45 N -0.0099 -0.0096 0.0105 308 CYS 45 CA -0.0093 -0.0110 0.0098 309 CYS 45 C -0.0095 -0.0117 0.0099 310 CYS 45 O -0.0095 -0.0108 0.0101 311 CYS 45 CB -0.0080 -0.0106 0.0087 312 CYS 45 SG -0.0071 -0.0122 0.0078 313 PHE 46 N -0.0095 -0.0132 0.0099 314 PHE 46 CA -0.0097 -0.0141 0.0100 315 PHE 46 C -0.0088 -0.0152 0.0090 316 PHE 46 O -0.0084 -0.0159 0.0086 317 PHE 46 CB -0.0109 -0.0150 0.0109 318 PHE 46 CG -0.0112 -0.0159 0.0111 319 PHE 46 CD1 -0.0110 -0.0152 0.0110 320 PHE 46 CD2 -0.0117 -0.0174 0.0113 321 PHE 46 CE1 -0.0113 -0.0160 0.0111 322 PHE 46 CE2 -0.0119 -0.0182 0.0115 323 PHE 46 CZ -0.0117 -0.0175 0.0114 324 GLY 47 N -0.0107 -0.0127 0.0082 325 GLY 47 CA -0.0116 -0.0137 0.0029 326 GLY 47 C -0.0078 -0.0114 -0.0010 327 GLY 47 O -0.0041 -0.0087 0.0004 328 ASN 48 N -0.0088 -0.0123 -0.0058 329 ASN 48 CA -0.0055 -0.0103 -0.0099 330 ASN 48 C -0.0022 -0.0080 -0.0080 331 ASN 48 O 0.0017 -0.0054 -0.0092 332 ASN 48 CB -0.0031 -0.0088 -0.0118 333 ASN 48 CG -0.0011 -0.0078 -0.0173 334 ASN 48 ND2 0.0026 -0.0053 -0.0183 335 ASN 48 OD1 -0.0029 -0.0092 -0.0206 336 SER 49 N -0.0037 -0.0095 -0.0047 337 SER 49 CA -0.0020 -0.0072 -0.0019 338 SER 49 C 0.0002 -0.0044 0.0002 339 SER 49 O 0.0026 -0.0015 0.0006 340 SER 49 CB -0.0007 -0.0058 -0.0044 341 SER 49 OG -0.0024 -0.0079 -0.0041 342 ILE 50 N -0.0005 -0.0051 0.0014 343 ILE 50 CA 0.0014 -0.0027 0.0035 344 ILE 50 C -0.0002 -0.0043 0.0073 345 ILE 50 O -0.0025 -0.0072 0.0067 346 ILE 50 CB 0.0028 -0.0012 0.0003 347 ILE 50 CG1 0.0055 0.0018 -0.0020 348 ILE 50 CG2 0.0035 -0.0002 0.0026 349 ILE 50 CD1 0.0069 0.0033 -0.0054 350 PHE 51 N 0.0011 -0.0067 0.0060 351 PHE 51 CA 0.0005 -0.0066 0.0077 352 PHE 51 C 0.0016 -0.0043 0.0067 353 PHE 51 O 0.0026 -0.0018 0.0060 354 PHE 51 CB -0.0006 -0.0058 0.0111 355 PHE 51 CG -0.0019 -0.0084 0.0126 356 PHE 51 CD1 -0.0029 -0.0109 0.0131 357 PHE 51 CD2 -0.0022 -0.0081 0.0135 358 PHE 51 CE1 -0.0041 -0.0133 0.0146 359 PHE 51 CE2 -0.0034 -0.0104 0.0150 360 PHE 51 CZ -0.0044 -0.0130 0.0155 361 LEU 52 N 0.0014 -0.0050 0.0066 362 LEU 52 CA 0.0023 -0.0028 0.0060 363 LEU 52 C 0.0013 -0.0031 0.0082 364 LEU 52 O 0.0006 -0.0056 0.0082 365 LEU 52 CB 0.0034 -0.0033 0.0028 366 LEU 52 CG 0.0040 -0.0020 0.0021 367 LEU 52 CD1 0.0051 0.0015 0.0019 368 LEU 52 CD2 0.0047 -0.0036 -0.0008 369 GLN 53 N 0.0056 -0.0040 0.0074 370 GLN 53 CA 0.0050 -0.0027 0.0067 371 GLN 53 C 0.0052 -0.0015 0.0062 372 GLN 53 O 0.0048 -0.0018 0.0063 373 GLN 53 CB 0.0034 -0.0030 0.0064 374 GLN 53 CG 0.0027 -0.0016 0.0056 375 GLN 53 CD 0.0012 -0.0020 0.0054 376 GLN 53 NE2 0.0009 -0.0010 0.0049 377 GLN 53 OE1 0.0004 -0.0031 0.0057 378 ILE 54 N 0.0056 -0.0002 0.0058 379 ILE 54 CA 0.0057 0.0010 0.0052 380 ILE 54 C 0.0046 0.0021 0.0045 381 ILE 54 O 0.0048 0.0024 0.0043 382 ILE 54 CB 0.0073 0.0017 0.0053 383 ILE 54 CG1 0.0073 0.0032 0.0046 384 ILE 54 CG2 0.0081 0.0018 0.0055 385 ILE 54 CD1 0.0089 0.0039 0.0047 386 LEU 55 N 0.0107 -0.0022 0.0102 387 LEU 55 CA 0.0100 -0.0014 0.0073 388 LEU 55 C 0.0099 -0.0011 0.0067 389 LEU 55 O 0.0096 -0.0025 0.0079 390 LEU 55 CB 0.0083 -0.0032 0.0058 391 LEU 55 CG 0.0081 -0.0035 0.0056 392 LEU 55 CD1 0.0066 -0.0062 0.0060 393 LEU 55 CD2 0.0078 -0.0021 0.0029 394 GLU 56 N 0.0102 0.0008 0.0047 395 GLU 56 CA 0.0102 0.0013 0.0038 396 GLU 56 C 0.0093 0.0019 0.0008 397 GLU 56 O 0.0097 0.0034 -0.0004 398 GLU 56 CB 0.0119 0.0034 0.0050 399 GLU 56 CG 0.0129 0.0030 0.0080 400 GLU 56 CD 0.0142 0.0046 0.0091 401 GLU 56 OE1 0.0149 0.0067 0.0077 402 GLU 56 OE2 0.0147 0.0038 0.0113 403 GLY 57 N 0.0107 -0.0103 0.0049 404 GLY 57 CA 0.0119 -0.0113 0.0003 405 GLY 57 C 0.0076 -0.0142 -0.0021 406 GLY 57 O 0.0040 -0.0156 -0.0011 407 SER 58 N 0.0080 -0.0151 -0.0054 408 SER 58 CA 0.0041 -0.0179 -0.0078 409 SER 58 C 0.0004 -0.0184 -0.0043 410 SER 58 O 0.0015 -0.0166 -0.0006 411 SER 58 CB 0.0058 -0.0186 -0.0123 412 SER 58 OG 0.0074 -0.0173 -0.0108 413 ARG 59 N -0.0108 -0.0170 0.0045 414 ARG 59 CA -0.0113 -0.0159 0.0048 415 ARG 59 C -0.0111 -0.0156 0.0062 416 ARG 59 O -0.0112 -0.0153 0.0066 417 ARG 59 CB -0.0119 -0.0150 0.0043 418 ARG 59 CG -0.0125 -0.0139 0.0041 419 ARG 59 CD -0.0131 -0.0132 0.0033 420 ARG 59 NE -0.0131 -0.0128 0.0040 421 ARG 59 CZ -0.0135 -0.0123 0.0034 422 ARG 59 NH1 -0.0140 -0.0120 0.0023 423 ARG 59 NH2 -0.0135 -0.0120 0.0041 424 GLN 60 N -0.0109 -0.0158 0.0069 425 GLN 60 CA -0.0107 -0.0154 0.0082 426 GLN 60 C -0.0102 -0.0161 0.0089 427 GLN 60 O -0.0102 -0.0157 0.0097 428 GLN 60 CB -0.0106 -0.0155 0.0088 429 GLN 60 CG -0.0105 -0.0150 0.0101 430 GLN 60 CD -0.0098 -0.0159 0.0110 431 GLN 60 NE2 -0.0094 -0.0165 0.0112 432 GLN 60 OE1 -0.0095 -0.0161 0.0115 433 ALA 61 N -0.0082 -0.0077 0.0037 434 ALA 61 CA -0.0062 -0.0088 0.0055 435 ALA 61 C -0.0057 -0.0094 0.0072 436 ALA 61 O -0.0055 -0.0101 0.0095 437 ALA 61 CB -0.0037 -0.0092 0.0040 438 ILE 62 N -0.0056 -0.0091 0.0060 439 ILE 62 CA -0.0053 -0.0096 0.0076 440 ILE 62 C -0.0076 -0.0094 0.0096 441 ILE 62 O -0.0073 -0.0102 0.0119 442 ILE 62 CB -0.0050 -0.0093 0.0058 443 ILE 62 CG1 -0.0025 -0.0096 0.0040 444 ILE 62 CG2 -0.0049 -0.0098 0.0075 445 ILE 62 CD1 -0.0028 -0.0088 0.0015 446 SER 63 N -0.0130 -0.0049 0.0082 447 SER 63 CA -0.0129 -0.0040 0.0084 448 SER 63 C -0.0118 -0.0034 0.0088 449 SER 63 O -0.0118 -0.0023 0.0091 450 SER 63 CB -0.0130 -0.0045 0.0083 451 SER 63 OG -0.0140 -0.0051 0.0079 452 HIS 64 N -0.0108 -0.0040 0.0089 453 HIS 64 CA -0.0097 -0.0035 0.0093 454 HIS 64 C -0.0096 -0.0028 0.0094 455 HIS 64 O -0.0092 -0.0018 0.0098 456 HIS 64 CB -0.0087 -0.0044 0.0092 457 HIS 64 CG -0.0076 -0.0041 0.0096 458 HIS 64 CD2 -0.0070 -0.0045 0.0096 459 HIS 64 ND1 -0.0070 -0.0032 0.0099 460 HIS 64 CE1 -0.0060 -0.0031 0.0101 461 HIS 64 NE2 -0.0060 -0.0038 0.0099 462 THR 65 N -0.0094 0.0037 0.0109 463 THR 65 CA -0.0094 0.0028 0.0106 464 THR 65 C -0.0091 0.0029 0.0101 465 THR 65 O -0.0093 0.0023 0.0102 466 THR 65 CB -0.0092 0.0023 0.0102 467 THR 65 CG2 -0.0091 0.0015 0.0096 468 THR 65 OG1 -0.0096 0.0019 0.0108 469 TYR 66 N -0.0088 0.0035 0.0095 470 TYR 66 CA -0.0085 0.0036 0.0090 471 TYR 66 C -0.0088 0.0039 0.0095 472 TYR 66 O -0.0087 0.0036 0.0094 473 TYR 66 CB -0.0081 0.0043 0.0083 474 TYR 66 CG -0.0078 0.0044 0.0077 475 TYR 66 CD1 -0.0077 0.0036 0.0072 476 TYR 66 CD2 -0.0077 0.0052 0.0076 477 TYR 66 CE1 -0.0074 0.0037 0.0067 478 TYR 66 CE2 -0.0074 0.0053 0.0070 479 TYR 66 CZ -0.0073 0.0045 0.0065 480 TYR 66 OH -0.0070 0.0046 0.0060 481 HIS 67 N -0.0123 0.0059 0.0080 482 HIS 67 CA -0.0110 0.0063 0.0072 483 HIS 67 C -0.0104 0.0077 0.0065 484 HIS 67 O -0.0099 0.0088 0.0059 485 HIS 67 CB -0.0097 0.0048 0.0072 486 HIS 67 CG -0.0082 0.0052 0.0064 487 HIS 67 CD2 -0.0077 0.0062 0.0058 488 HIS 67 ND1 -0.0069 0.0046 0.0060 489 HIS 67 CE1 -0.0057 0.0051 0.0053 490 HIS 67 NE2 -0.0061 0.0061 0.0052 491 ARG 68 N -0.0104 0.0078 0.0065 492 ARG 68 CA -0.0099 0.0091 0.0058 493 ARG 68 C -0.0110 0.0106 0.0058 494 ARG 68 O -0.0105 0.0119 0.0051 495 ARG 68 CB -0.0097 0.0088 0.0058 496 ARG 68 CG -0.0081 0.0080 0.0054 497 ARG 68 CD -0.0082 0.0075 0.0056 498 ARG 68 NE -0.0093 0.0086 0.0057 499 ARG 68 CZ -0.0102 0.0081 0.0063 500 ARG 68 NH1 -0.0102 0.0066 0.0068 501 ARG 68 NH2 -0.0112 0.0092 0.0063 502 ILE 69 N -0.0097 0.0096 0.0059 503 ILE 69 CA -0.0099 0.0096 0.0055 504 ILE 69 C -0.0097 0.0097 0.0052 505 ILE 69 O -0.0098 0.0097 0.0048 506 ILE 69 CB -0.0101 0.0096 0.0056 507 ILE 69 CG1 -0.0105 0.0095 0.0058 508 ILE 69 CG2 -0.0102 0.0096 0.0053 509 ILE 69 CD1 -0.0108 0.0094 0.0059 510 LEU 70 N -0.0093 0.0097 0.0053 511 LEU 70 CA -0.0090 0.0098 0.0050 512 LEU 70 C -0.0089 0.0099 0.0047 513 LEU 70 O -0.0088 0.0100 0.0044 514 LEU 70 CB -0.0086 0.0099 0.0051 515 LEU 70 CG -0.0085 0.0099 0.0052 516 LEU 70 CD1 -0.0082 0.0099 0.0054 517 LEU 70 CD2 -0.0086 0.0099 0.0048 518 GLN 71 N -0.0141 0.0096 0.0013 519 GLN 71 CA -0.0141 0.0094 -0.0015 520 GLN 71 C -0.0136 0.0128 -0.0013 521 GLN 71 O -0.0136 0.0129 -0.0034 522 GLN 71 CB -0.0142 0.0090 -0.0055 523 GLN 71 CG -0.0148 0.0053 -0.0062 524 GLN 71 CD -0.0148 0.0052 -0.0099 525 GLN 71 NE2 -0.0150 0.0041 -0.0129 526 GLN 71 OE1 -0.0147 0.0061 -0.0102 527 ASP 72 N -0.0131 0.0155 0.0011 528 ASP 72 CA -0.0126 0.0188 0.0014 529 ASP 72 C -0.0128 0.0177 0.0032 530 ASP 72 O -0.0131 0.0157 0.0061 531 ASP 72 CB -0.0121 0.0218 0.0038 532 ASP 72 CG -0.0115 0.0257 0.0025 533 ASP 72 OD1 -0.0113 0.0268 0.0028 534 ASP 72 OD2 -0.0111 0.0278 0.0013 535 PRO 73 N -0.0169 0.0106 0.0080 536 PRO 73 CA -0.0171 0.0079 0.0115 537 PRO 73 C -0.0120 0.0049 0.0121 538 PRO 73 O -0.0118 0.0023 0.0153 539 PRO 73 CB -0.0203 0.0061 0.0156 540 PRO 73 CG -0.0202 0.0070 0.0144 541 PRO 73 CD -0.0174 0.0095 0.0096 542 ARG 74 N -0.0078 0.0053 0.0091 543 ARG 74 CA -0.0028 0.0026 0.0095 544 ARG 74 C -0.0007 0.0035 0.0071 545 ARG 74 O 0.0036 0.0015 0.0071 546 ARG 74 CB 0.0008 0.0023 0.0077 547 ARG 74 CG -0.0001 0.0004 0.0106 548 ARG 74 CD 0.0042 -0.0007 0.0093 549 ARG 74 NE 0.0036 0.0023 0.0060 550 ARG 74 CZ 0.0008 0.0030 0.0069 551 ARG 74 NH1 -0.0018 0.0010 0.0109 552 ARG 74 NH2 0.0005 0.0058 0.0036 553 HIS 75 N 0.0062 0.0061 0.0184 554 HIS 75 CA 0.0084 0.0072 0.0158 555 HIS 75 C 0.0112 0.0104 0.0160 556 HIS 75 O 0.0114 0.0118 0.0185 557 HIS 75 CB 0.0080 0.0071 0.0167 558 HIS 75 CG 0.0080 0.0091 0.0204 559 HIS 75 CD2 0.0081 0.0107 0.0234 560 HIS 75 ND1 0.0079 0.0096 0.0216 561 HIS 75 CE1 0.0080 0.0114 0.0250 562 HIS 75 NE2 0.0081 0.0121 0.0261 563 HIS 76 N 0.0134 0.0115 0.0133 564 HIS 76 CA 0.0162 0.0145 0.0130 565 HIS 76 C 0.0183 0.0157 0.0108 566 HIS 76 O 0.0175 0.0141 0.0094 567 HIS 76 CB 0.0169 0.0144 0.0111 568 HIS 76 CG 0.0169 0.0124 0.0072 569 HIS 76 CD2 0.0189 0.0130 0.0040 570 HIS 76 ND1 0.0147 0.0094 0.0062 571 HIS 76 CE1 0.0153 0.0083 0.0026 572 HIS 76 NE2 0.0178 0.0104 0.0012 573 SER 77 N 0.0142 0.0141 0.0102 574 SER 77 CA 0.0113 0.0140 0.0087 575 SER 77 C 0.0105 0.0108 0.0075 576 SER 77 O 0.0084 0.0101 0.0063 577 SER 77 CB 0.0094 0.0160 0.0083 578 SER 77 OG 0.0099 0.0191 0.0093 579 ALA 78 N 0.0123 0.0087 0.0079 580 ALA 78 CA 0.0118 0.0056 0.0069 581 ALA 78 C 0.0094 0.0052 0.0055 582 ALA 78 O 0.0091 0.0068 0.0058 583 ALA 78 CB 0.0144 0.0036 0.0077 584 GLU 79 N 0.0049 0.0019 0.0039 585 GLU 79 CA 0.0043 0.0023 0.0030 586 GLU 79 C 0.0043 0.0012 0.0026 587 GLU 79 O 0.0045 0.0002 0.0026 588 GLU 79 CB 0.0038 0.0026 0.0020 589 GLU 79 CG 0.0036 0.0038 0.0022 590 GLU 79 CD 0.0031 0.0041 0.0013 591 GLU 79 OE1 0.0032 0.0046 0.0015 592 GLU 79 OE2 0.0026 0.0040 0.0003 593 ILE 80 N 0.0042 0.0015 0.0024 594 ILE 80 CA 0.0041 0.0006 0.0020 595 ILE 80 C 0.0035 0.0004 0.0008 596 ILE 80 O 0.0031 0.0013 0.0003 597 ILE 80 CB 0.0043 0.0008 0.0025 598 ILE 80 CG1 0.0049 0.0011 0.0037 599 ILE 80 CG2 0.0043 -0.0002 0.0021 600 ILE 80 CD1 0.0050 0.0017 0.0041 601 ILE 81 N 0.0021 0.0014 0.0018 602 ILE 81 CA -0.0000 0.0008 -0.0004 603 ILE 81 C -0.0003 -0.0007 -0.0005 604 ILE 81 O -0.0013 0.0004 -0.0018 605 ILE 81 CB -0.0011 -0.0012 -0.0014 606 ILE 81 CG1 -0.0016 0.0007 -0.0022 607 ILE 81 CG2 -0.0031 -0.0028 -0.0032 608 ILE 81 CD1 -0.0024 -0.0011 -0.0028 609 ALA 82 N 0.0007 -0.0030 0.0010 610 ALA 82 CA 0.0004 -0.0045 0.0009 611 ALA 82 C 0.0022 -0.0061 0.0031 612 ALA 82 O 0.0033 -0.0069 0.0045 613 ALA 82 CB -0.0015 -0.0067 -0.0009 614 PHE 83 N -0.0058 -0.0134 0.0077 615 PHE 83 CA -0.0045 -0.0146 0.0080 616 PHE 83 C -0.0048 -0.0165 0.0094 617 PHE 83 O -0.0040 -0.0174 0.0097 618 PHE 83 CB -0.0023 -0.0145 0.0071 619 PHE 83 CG -0.0009 -0.0156 0.0073 620 PHE 83 CD1 -0.0002 -0.0174 0.0083 621 PHE 83 CD2 -0.0003 -0.0149 0.0066 622 PHE 83 CE1 0.0011 -0.0185 0.0085 623 PHE 83 CE2 0.0009 -0.0159 0.0068 624 PHE 83 CZ 0.0016 -0.0177 0.0077 625 ASP 84 N -0.0060 -0.0171 0.0103 626 ASP 84 CA -0.0065 -0.0188 0.0117 627 ASP 84 C -0.0066 -0.0197 0.0124 628 ASP 84 O -0.0069 -0.0189 0.0119 629 ASP 84 CB -0.0086 -0.0185 0.0124 630 ASP 84 CG -0.0101 -0.0170 0.0119 631 ASP 84 OD1 -0.0099 -0.0154 0.0107 632 ASP 84 OD2 -0.0116 -0.0172 0.0126 633 PRO 85 N -0.0099 -0.0404 0.0169 634 PRO 85 CA -0.0061 -0.0389 0.0110 635 PRO 85 C -0.0041 -0.0347 0.0142 636 PRO 85 O -0.0068 -0.0350 0.0200 637 PRO 85 CB -0.0094 -0.0453 0.0063 638 PRO 85 CG -0.0150 -0.0499 0.0107 639 PRO 85 CD -0.0154 -0.0467 0.0179 640 VAL 86 N 0.0008 -0.0307 0.0102 641 VAL 86 CA 0.0036 -0.0260 0.0127 642 VAL 86 C 0.0062 -0.0260 0.0063 643 VAL 86 O 0.0070 -0.0284 -0.0003 644 VAL 86 CB 0.0076 -0.0194 0.0158 645 VAL 86 CG1 0.0049 -0.0186 0.0238 646 VAL 86 CG2 0.0105 -0.0183 0.0110 647 LEU 87 N 0.0355 0.0331 0.0046 648 LEU 87 CA 0.0340 0.0202 0.0131 649 LEU 87 C 0.0316 0.0036 0.0226 650 LEU 87 O 0.0345 -0.0020 0.0384 651 LEU 87 CB 0.0278 0.0146 -0.0014 652 LEU 87 CG 0.0269 0.0072 0.0035 653 LEU 87 CD1 0.0202 0.0028 -0.0137 654 LEU 87 CD2 0.0257 -0.0094 0.0173 655 GLN 88 N 0.0262 -0.0043 0.0135 656 GLN 88 CA 0.0235 -0.0202 0.0214 657 GLN 88 C 0.0226 -0.0182 0.0164 658 GLN 88 O 0.0217 -0.0083 0.0030 659 GLN 88 CB 0.0158 -0.0377 0.0147 660 GLN 88 CG 0.0097 -0.0373 -0.0059 661 GLN 88 CD 0.0022 -0.0546 -0.0122 662 GLN 88 NE2 -0.0039 -0.0568 -0.0298 663 GLN 88 OE1 0.0019 -0.0659 -0.0013 664 ARG 89 N 0.0212 0.0098 0.0128 665 ARG 89 CA 0.0207 0.0105 0.0105 666 ARG 89 C 0.0196 0.0127 0.0126 667 ARG 89 O 0.0189 0.0145 0.0153 668 ARG 89 CB 0.0196 0.0120 0.0069 669 ARG 89 CG 0.0200 0.0109 0.0054 670 ARG 89 CD 0.0186 0.0131 0.0022 671 ARG 89 NE 0.0191 0.0116 -0.0014 672 ARG 89 CZ 0.0196 0.0102 -0.0037 673 ARG 89 NH1 0.0198 0.0100 -0.0029 674 ARG 89 NH2 0.0200 0.0091 -0.0070 675 GLU 90 N 0.0195 0.0127 0.0113 676 GLU 90 CA 0.0184 0.0149 0.0127 677 GLU 90 C 0.0171 0.0169 0.0097 678 GLU 90 O 0.0159 0.0191 0.0107 679 GLU 90 CB 0.0197 0.0129 0.0146 680 GLU 90 CG 0.0210 0.0110 0.0178 681 GLU 90 CD 0.0215 0.0105 0.0207 682 GLU 90 OE1 0.0225 0.0085 0.0199 683 GLU 90 OE2 0.0209 0.0120 0.0237 684 PHE 91 N 0.0132 0.0207 0.0059 685 PHE 91 CA 0.0093 0.0192 0.0032 686 PHE 91 C 0.0049 0.0217 0.0031 687 PHE 91 O 0.0020 0.0201 0.0007 688 PHE 91 CB 0.0099 0.0147 0.0002 689 PHE 91 CG 0.0141 0.0121 0.0001 690 PHE 91 CD1 0.0138 0.0104 -0.0012 691 PHE 91 CD2 0.0182 0.0113 0.0013 692 PHE 91 CE1 0.0176 0.0080 -0.0013 693 PHE 91 CE2 0.0221 0.0088 0.0012 694 PHE 91 CZ 0.0218 0.0072 -0.0002 695 VAL 92 N 0.0043 0.0257 0.0057 696 VAL 92 CA 0.0005 0.0284 0.0060 697 VAL 92 C -0.0041 0.0281 0.0039 698 VAL 92 O -0.0075 0.0283 0.0026 699 VAL 92 CB 0.0011 0.0328 0.0094 700 VAL 92 CG1 0.0023 0.0338 0.0107 701 VAL 92 CG2 -0.0032 0.0358 0.0098 702 GLN 93 N -0.0041 0.0292 0.0099 703 GLN 93 CA -0.0102 0.0277 0.0085 704 GLN 93 C -0.0130 0.0240 0.0052 705 GLN 93 O -0.0186 0.0242 0.0052 706 GLN 93 CB -0.0098 0.0260 0.0070 707 GLN 93 CG -0.0047 0.0282 0.0090 708 GLN 93 CD 0.0015 0.0257 0.0070 709 GLN 93 NE2 0.0064 0.0284 0.0095 710 GLN 93 OE1 0.0019 0.0214 0.0033 711 TRP 94 N -0.0093 0.0206 0.0024 712 TRP 94 CA -0.0117 0.0165 -0.0013 713 TRP 94 C -0.0108 0.0168 -0.0010 714 TRP 94 O -0.0057 0.0175 -0.0002 715 TRP 94 CB -0.0084 0.0121 -0.0050 716 TRP 94 CG -0.0082 0.0118 -0.0053 717 TRP 94 CD1 -0.0032 0.0125 -0.0045 718 TRP 94 CD2 -0.0133 0.0108 -0.0063 719 TRP 94 CE2 -0.0110 0.0109 -0.0061 720 TRP 94 CE3 -0.0195 0.0097 -0.0073 721 TRP 94 NE1 -0.0048 0.0120 -0.0050 722 TRP 94 CZ2 -0.0147 0.0100 -0.0069 723 TRP 94 CZ3 -0.0232 0.0089 -0.0081 724 TRP 94 CH2 -0.0208 0.0091 -0.0079 725 SER 95 N -0.0037 0.0082 -0.0021 726 SER 95 CA -0.0042 0.0081 -0.0020 727 SER 95 C -0.0031 0.0060 -0.0033 728 SER 95 O -0.0019 0.0062 -0.0034 729 SER 95 CB -0.0071 0.0081 -0.0015 730 SER 95 OG -0.0080 0.0104 -0.0003 731 MET 96 N -0.0034 0.0039 -0.0042 732 MET 96 CA -0.0021 0.0018 -0.0054 733 MET 96 C -0.0025 -0.0001 -0.0062 734 MET 96 O -0.0047 -0.0006 -0.0060 735 MET 96 CB -0.0029 0.0006 -0.0058 736 MET 96 CG -0.0005 -0.0002 -0.0066 737 MET 96 SD 0.0015 0.0023 -0.0059 738 MET 96 CE -0.0008 0.0032 -0.0050 739 LYS 97 N -0.0172 -0.0029 -0.0046 740 LYS 97 CA -0.0150 -0.0044 -0.0036 741 LYS 97 C -0.0146 -0.0068 -0.0021 742 LYS 97 O -0.0149 -0.0068 -0.0021 743 LYS 97 CB -0.0122 -0.0030 -0.0045 744 LYS 97 CG -0.0101 -0.0041 -0.0037 745 LYS 97 CD -0.0117 -0.0051 -0.0032 746 LYS 97 CE -0.0096 -0.0054 -0.0029 747 LYS 97 NZ -0.0111 -0.0065 -0.0022 748 LEU 98 N -0.0139 -0.0088 -0.0009 749 LEU 98 CA -0.0133 -0.0111 0.0006 750 LEU 98 C -0.0101 -0.0116 0.0010 751 LEU 98 O -0.0087 -0.0112 0.0007 752 LEU 98 CB -0.0150 -0.0132 0.0019 753 LEU 98 CG -0.0157 -0.0156 0.0034 754 LEU 98 CD1 -0.0130 -0.0172 0.0045 755 LEU 98 CD2 -0.0170 -0.0151 0.0031 756 VAL 99 N -0.0253 -0.0159 0.0070 757 VAL 99 CA -0.0233 -0.0163 0.0076 758 VAL 99 C -0.0236 -0.0175 0.0092 759 VAL 99 O -0.0249 -0.0177 0.0094 760 VAL 99 CB -0.0225 -0.0154 0.0063 761 VAL 99 CG1 -0.0208 -0.0159 0.0071 762 VAL 99 CG2 -0.0217 -0.0142 0.0048 763 GLN 100 N -0.0225 -0.0184 0.0105 764 GLN 100 CA -0.0226 -0.0197 0.0122 765 GLN 100 C -0.0208 -0.0199 0.0125 766 GLN 100 O -0.0191 -0.0193 0.0118 767 GLN 100 CB -0.0226 -0.0206 0.0135 768 GLN 100 CG -0.0224 -0.0220 0.0152 769 GLN 100 CD -0.0240 -0.0228 0.0164 770 GLN 100 NE2 -0.0243 -0.0239 0.0178 771 GLN 100 OE1 -0.0249 -0.0226 0.0160 772 ILE 101 N -0.0449 -0.0133 0.0110 773 ILE 101 CA -0.0327 -0.0158 0.0098 774 ILE 101 C -0.0327 -0.0295 -0.0001 775 ILE 101 O -0.0206 -0.0349 -0.0034 776 ILE 101 CB -0.0166 -0.0125 0.0131 777 ILE 101 CG1 -0.0138 -0.0192 0.0084 778 ILE 101 CG2 -0.0156 0.0016 0.0234 779 ILE 101 CD1 -0.0031 -0.0308 0.0005 780 ASP 102 N -0.0464 -0.0349 -0.0048 781 ASP 102 CA -0.0483 -0.0480 -0.0144 782 ASP 102 C -0.0404 -0.0510 -0.0161 783 ASP 102 O -0.0292 -0.0584 -0.0209 784 ASP 102 CB -0.0655 -0.0509 -0.0174 785 ASP 102 CG -0.0750 -0.0404 -0.0103 786 ASP 102 OD1 -0.0681 -0.0313 -0.0033 787 ASP 102 OD2 -0.0895 -0.0412 -0.0117 788 SER 105 N 0.0051 0.0011 0.0533 789 SER 105 CA 0.0043 -0.0007 0.0498 790 SER 105 C 0.0037 -0.0023 0.0469 791 SER 105 O 0.0023 -0.0010 0.0470 792 SER 105 CB 0.0013 0.0012 0.0490 793 SER 105 OG -0.0017 0.0027 0.0475 794 PRO 106 N 0.0048 -0.0050 0.0442 795 PRO 106 CA 0.0040 -0.0066 0.0411 796 PRO 106 C 0.0002 -0.0048 0.0392 797 PRO 106 O -0.0017 -0.0032 0.0391 798 PRO 106 CB 0.0057 -0.0096 0.0388 799 PRO 106 CG 0.0064 -0.0092 0.0402 800 PRO 106 CD 0.0069 -0.0069 0.0441 801 GLU 107 N -0.0083 -0.0071 0.0270 802 GLU 107 CA -0.0125 0.0001 0.0191 803 GLU 107 C -0.0130 -0.0012 0.0184 804 GLU 107 O -0.0152 0.0060 0.0136 805 GLU 107 CB -0.0186 -0.0026 0.0093 806 GLU 107 CG -0.0215 -0.0148 0.0062 807 GLU 107 CD -0.0255 -0.0162 -0.0001 808 GLU 107 OE1 -0.0287 -0.0087 -0.0065 809 GLU 107 OE2 -0.0254 -0.0250 0.0014 810 LYS 108 N -0.0111 -0.0103 0.0229 811 LYS 108 CA -0.0113 -0.0117 0.0227 812 LYS 108 C -0.0070 -0.0026 0.0285 813 LYS 108 O -0.0083 0.0012 0.0259 814 LYS 108 CB -0.0100 -0.0237 0.0266 815 LYS 108 CG -0.0150 -0.0330 0.0196 816 LYS 108 CD -0.0207 -0.0318 0.0101 817 LYS 108 CE -0.0193 -0.0300 0.0121 818 LYS 108 NZ -0.0174 -0.0404 0.0167 819 MET 109 N -0.0028 0.0047 0.0211 820 MET 109 CA -0.0034 0.0073 0.0226 821 MET 109 C -0.0046 0.0098 0.0214 822 MET 109 O -0.0054 0.0119 0.0210 823 MET 109 CB -0.0026 0.0073 0.0259 824 MET 109 CG -0.0018 0.0063 0.0275 825 MET 109 SD -0.0007 0.0058 0.0312 826 MET 109 CE 0.0002 0.0041 0.0323 827 ARG 110 N -0.0047 0.0098 0.0209 828 ARG 110 CA -0.0058 0.0121 0.0196 829 ARG 110 C -0.0066 0.0123 0.0165 830 ARG 110 O -0.0077 0.0146 0.0155 831 ARG 110 CB -0.0057 0.0119 0.0198 832 ARG 110 CG -0.0048 0.0114 0.0228 833 ARG 110 CD -0.0047 0.0112 0.0229 834 ARG 110 NE -0.0035 0.0085 0.0238 835 ARG 110 CZ -0.0033 0.0066 0.0220 836 ARG 110 NH1 -0.0041 0.0070 0.0194 837 ARG 110 NH2 -0.0022 0.0041 0.0230 838 ARG 111 N -0.0036 0.0212 0.0078 839 ARG 111 CA -0.0085 0.0180 0.0034 840 ARG 111 C -0.0069 0.0171 0.0047 841 ARG 111 O -0.0105 0.0192 0.0018 842 ARG 111 CB -0.0102 0.0102 0.0015 843 ARG 111 CG -0.0159 0.0070 -0.0035 844 ARG 111 CD -0.0212 0.0121 -0.0077 845 ARG 111 NE -0.0241 0.0094 -0.0103 846 ARG 111 CZ -0.0278 0.0036 -0.0137 847 ARG 111 NH1 -0.0292 -0.0004 -0.0152 848 ARG 111 NH2 -0.0301 0.0018 -0.0158 849 LEU 112 N -0.0015 0.0140 0.0091 850 LEU 112 CA 0.0005 0.0134 0.0108 851 LEU 112 C 0.0011 0.0213 0.0117 852 LEU 112 O -0.0001 0.0224 0.0108 853 LEU 112 CB 0.0064 0.0087 0.0155 854 LEU 112 CG 0.0061 0.0003 0.0148 855 LEU 112 CD1 0.0123 -0.0031 0.0198 856 LEU 112 CD2 0.0029 -0.0047 0.0118 857 TYR 113 N 0.0001 0.0102 0.0096 858 TYR 113 CA 0.0014 0.0111 0.0088 859 TYR 113 C 0.0016 0.0115 0.0081 860 TYR 113 O 0.0028 0.0120 0.0082 861 TYR 113 CB 0.0014 0.0116 0.0077 862 TYR 113 CG 0.0021 0.0117 0.0083 863 TYR 113 CD1 0.0034 0.0119 0.0093 864 TYR 113 CD2 0.0014 0.0115 0.0080 865 TYR 113 CE1 0.0041 0.0120 0.0099 866 TYR 113 CE2 0.0021 0.0116 0.0086 867 TYR 113 CZ 0.0034 0.0118 0.0096 868 TYR 113 OH 0.0041 0.0119 0.0102 869 LEU 114 N 0.0004 0.0113 0.0072 870 LEU 114 CA 0.0004 0.0116 0.0064 871 LEU 114 C 0.0007 0.0113 0.0075 872 LEU 114 O 0.0016 0.0118 0.0072 873 LEU 114 CB -0.0011 0.0113 0.0053 874 LEU 114 CG -0.0010 0.0119 0.0039 875 LEU 114 CD1 -0.0005 0.0126 0.0026 876 LEU 114 CD2 -0.0026 0.0114 0.0033 877 LYS 115 N -0.0017 0.0274 0.0083 878 LYS 115 CA -0.0043 0.0221 0.0075 879 LYS 115 C -0.0056 0.0165 0.0054 880 LYS 115 O -0.0097 0.0124 0.0067 881 LYS 115 CB -0.0011 0.0216 0.0044 882 LYS 115 CG -0.0032 0.0157 0.0028 883 LYS 115 CD -0.0042 0.0166 0.0041 884 LYS 115 CE 0.0008 0.0202 0.0018 885 LYS 115 NZ 0.0051 0.0180 -0.0033 886 TYR 116 N -0.0021 0.0161 0.0020 887 TYR 116 CA -0.0027 0.0107 -0.0006 888 TYR 116 C -0.0038 0.0112 0.0007 889 TYR 116 O -0.0032 0.0075 -0.0020 890 TYR 116 CB 0.0020 0.0088 -0.0059 891 TYR 116 CG 0.0031 0.0075 -0.0077 892 TYR 116 CD1 0.0001 0.0023 -0.0080 893 TYR 116 CD2 0.0072 0.0113 -0.0091 894 TYR 116 CE1 0.0011 0.0010 -0.0097 895 TYR 116 CE2 0.0083 0.0101 -0.0108 896 TYR 116 CZ 0.0052 0.0049 -0.0110 897 TYR 116 OH 0.0062 0.0037 -0.0127 898 SER 117 N 0.0019 0.0160 0.0059 899 SER 117 CA 0.0033 0.0149 0.0042 900 SER 117 C 0.0046 0.0137 0.0024 901 SER 117 O 0.0037 0.0134 0.0021 902 SER 117 CB 0.0014 0.0140 0.0032 903 SER 117 OG -0.0011 0.0134 0.0027 904 GLY 118 N 0.0066 0.0129 0.0012 905 GLY 118 CA 0.0079 0.0117 -0.0007 906 GLY 118 C 0.0069 0.0100 -0.0029 907 GLY 118 O 0.0079 0.0089 -0.0045 908 GLU 119 N 0.0069 0.0073 -0.0061 909 GLU 119 CA 0.0066 0.0065 -0.0057 910 GLU 119 C 0.0069 0.0065 -0.0057 911 GLU 119 O 0.0068 0.0071 -0.0060 912 GLU 119 CB 0.0055 0.0063 -0.0057 913 GLU 119 CG 0.0053 0.0058 -0.0054 914 GLU 119 CD 0.0050 0.0063 -0.0058 915 GLU 119 OE1 0.0051 0.0071 -0.0062 916 GLU 119 OE2 0.0048 0.0060 -0.0056 917 VAL 120 N 0.0072 0.0058 -0.0052 918 VAL 120 CA 0.0075 0.0057 -0.0052 919 VAL 120 C 0.0067 0.0057 -0.0053 920 VAL 120 O 0.0067 0.0061 -0.0055 921 VAL 120 CB 0.0081 0.0048 -0.0046 922 VAL 120 CG1 0.0092 0.0050 -0.0046 923 VAL 120 CG2 0.0076 0.0041 -0.0043 924 ALA 121 N 0.0034 -0.0014 -0.0103 925 ALA 121 CA 0.0034 -0.0015 -0.0095 926 ALA 121 C 0.0041 -0.0013 -0.0074 927 ALA 121 O 0.0048 -0.0010 -0.0067 928 ALA 121 CB 0.0045 -0.0008 -0.0106 929 PHE 122 N 0.0039 -0.0015 -0.0064 930 PHE 122 CA 0.0045 -0.0014 -0.0044 931 PHE 122 C 0.0064 -0.0005 -0.0042 932 PHE 122 O 0.0070 -0.0001 -0.0044 933 PHE 122 CB 0.0036 -0.0020 -0.0034 934 PHE 122 CG 0.0039 -0.0021 -0.0012 935 PHE 122 CD1 0.0041 -0.0021 -0.0002 936 PHE 122 CD2 0.0041 -0.0021 -0.0003 937 PHE 122 CE1 0.0045 -0.0021 0.0017 938 PHE 122 CE2 0.0044 -0.0021 0.0016 939 PHE 122 CZ 0.0046 -0.0021 0.0027 940 MET 123 N 0.0026 0.0012 -0.0066 941 MET 123 CA 0.0025 0.0039 -0.0062 942 MET 123 C 0.0024 0.0039 -0.0066 943 MET 123 O 0.0017 0.0045 -0.0087 944 MET 123 CB 0.0018 0.0059 -0.0079 945 MET 123 CG 0.0018 0.0057 -0.0080 946 MET 123 SD 0.0012 0.0088 -0.0089 947 MET 123 CE 0.0015 0.0081 -0.0082 948 PRO 124 N 0.0030 0.0033 -0.0046 949 PRO 124 CA 0.0029 0.0031 -0.0049 950 PRO 124 C 0.0027 0.0058 -0.0049 951 PRO 124 O 0.0025 0.0059 -0.0054 952 PRO 124 CB 0.0038 0.0015 -0.0026 953 PRO 124 CG 0.0043 0.0012 -0.0009 954 PRO 124 CD 0.0039 0.0028 -0.0019 955 GLU 125 N -0.0004 0.0070 -0.0065 956 GLU 125 CA -0.0011 0.0089 -0.0066 957 GLU 125 C -0.0043 0.0094 -0.0090 958 GLU 125 O -0.0052 0.0105 -0.0094 959 GLU 125 CB 0.0000 0.0124 -0.0049 960 GLU 125 CG -0.0017 0.0152 -0.0056 961 GLU 125 CD -0.0007 0.0152 -0.0048 962 GLU 125 OE1 0.0018 0.0136 -0.0033 963 GLU 125 OE2 -0.0023 0.0167 -0.0057 964 THR 126 N -0.0061 0.0087 -0.0105 965 THR 126 CA -0.0092 0.0092 -0.0128 966 THR 126 C -0.0104 0.0057 -0.0145 967 THR 126 O -0.0130 0.0057 -0.0166 968 THR 126 CB -0.0107 0.0109 -0.0136 969 THR 126 CG2 -0.0099 0.0146 -0.0121 970 THR 126 OG1 -0.0099 0.0088 -0.0134 971 MET 127 N -0.0118 0.0042 -0.0071 972 MET 127 CA -0.0121 0.0007 -0.0099 973 MET 127 C -0.0120 -0.0040 -0.0139 974 MET 127 O -0.0094 -0.0044 -0.0148 975 MET 127 CB -0.0073 0.0018 -0.0102 976 MET 127 CG -0.0013 0.0013 -0.0120 977 MET 127 SD 0.0043 0.0048 -0.0104 978 MET 127 CE 0.0050 0.0012 -0.0135 979 THR 128 N -0.0148 -0.0075 -0.0162 980 THR 128 CA -0.0155 -0.0121 -0.0199 981 THR 128 C -0.0099 -0.0141 -0.0228 982 THR 128 O -0.0059 -0.0124 -0.0224 983 THR 128 CB -0.0201 -0.0151 -0.0213 984 THR 128 CG2 -0.0252 -0.0125 -0.0180 985 THR 128 OG1 -0.0177 -0.0164 -0.0229 986 PRO 129 N -0.0120 -0.0115 -0.0220 987 PRO 129 CA -0.0071 -0.0131 -0.0252 988 PRO 129 C -0.0044 -0.0146 -0.0278 989 PRO 129 O 0.0009 -0.0146 -0.0286 990 PRO 129 CB -0.0095 -0.0158 -0.0286 991 PRO 129 CG -0.0158 -0.0157 -0.0274 992 PRO 129 CD -0.0169 -0.0124 -0.0225 993 ALA 130 N -0.0078 -0.0160 -0.0292 994 ALA 130 CA -0.0054 -0.0174 -0.0316 995 ALA 130 C -0.0018 -0.0147 -0.0284 996 ALA 130 O 0.0028 -0.0152 -0.0298 997 ALA 130 CB -0.0101 -0.0193 -0.0335 998 GLN 131 N -0.0042 -0.0093 -0.0253 999 GLN 131 CA -0.0002 -0.0068 -0.0213 1000 GLN 131 C 0.0051 -0.0057 -0.0204 1001 GLN 131 O 0.0103 -0.0049 -0.0199 1002 GLN 131 CB -0.0039 -0.0044 -0.0159 1003 GLN 131 CG -0.0075 -0.0047 -0.0156 1004 GLN 131 CD -0.0125 -0.0029 -0.0111 1005 GLN 131 NE2 -0.0180 -0.0042 -0.0124 1006 GLN 131 OE1 -0.0114 -0.0003 -0.0065 1007 CYS 132 N 0.0039 -0.0058 -0.0202 1008 CYS 132 CA 0.0089 -0.0049 -0.0197 1009 CYS 132 C 0.0136 -0.0068 -0.0244 1010 CYS 132 O 0.0191 -0.0057 -0.0236 1011 CYS 132 CB 0.0063 -0.0051 -0.0195 1012 CYS 132 SG 0.0025 -0.0022 -0.0132 1013 LEU 133 N 0.0131 0.0014 -0.0240 1014 LEU 133 CA 0.0139 0.0001 -0.0244 1015 LEU 133 C 0.0145 -0.0013 -0.0253 1016 LEU 133 O 0.0155 -0.0026 -0.0248 1017 LEU 133 CB 0.0132 0.0004 -0.0255 1018 LEU 133 CG 0.0140 -0.0009 -0.0261 1019 LEU 133 CD1 0.0149 -0.0015 -0.0245 1020 LEU 133 CD2 0.0133 -0.0005 -0.0272 1021 GLN 134 N 0.0140 -0.0012 -0.0266 1022 GLN 134 CA 0.0146 -0.0026 -0.0275 1023 GLN 134 C 0.0154 -0.0032 -0.0263 1024 GLN 134 O 0.0164 -0.0046 -0.0263 1025 GLN 134 CB 0.0138 -0.0022 -0.0291 1026 GLN 134 CG 0.0132 -0.0022 -0.0307 1027 GLN 134 CD 0.0140 -0.0037 -0.0314 1028 GLN 134 NE2 0.0138 -0.0038 -0.0323 1029 GLN 134 OE1 0.0149 -0.0049 -0.0313 1030 PHE 135 N 0.0112 0.0003 -0.0215 1031 PHE 135 CA 0.0135 -0.0006 -0.0180 1032 PHE 135 C 0.0151 -0.0013 -0.0171 1033 PHE 135 O 0.0183 -0.0026 -0.0160 1034 PHE 135 CB 0.0112 0.0005 -0.0146 1035 PHE 135 CG 0.0129 -0.0001 -0.0107 1036 PHE 135 CD1 0.0165 -0.0016 -0.0100 1037 PHE 135 CD2 0.0109 0.0009 -0.0076 1038 PHE 135 CE1 0.0181 -0.0021 -0.0063 1039 PHE 135 CE2 0.0124 0.0004 -0.0040 1040 PHE 135 CZ 0.0160 -0.0011 -0.0033 1041 MET 136 N 0.0130 -0.0004 -0.0176 1042 MET 136 CA 0.0144 -0.0010 -0.0168 1043 MET 136 C 0.0175 -0.0024 -0.0195 1044 MET 136 O 0.0200 -0.0035 -0.0182 1045 MET 136 CB 0.0114 0.0003 -0.0173 1046 MET 136 CG 0.0093 0.0014 -0.0136 1047 MET 136 SD 0.0114 0.0007 -0.0089 1048 MET 136 CE 0.0152 -0.0010 -0.0094 1049 ILE 137 N 0.0203 0.0031 -0.0218 1050 ILE 137 CA 0.0203 0.0037 -0.0217 1051 ILE 137 C 0.0207 0.0027 -0.0220 1052 ILE 137 O 0.0201 0.0025 -0.0218 1053 ILE 137 CB 0.0211 0.0049 -0.0219 1054 ILE 137 CG1 0.0205 0.0060 -0.0216 1055 ILE 137 CG2 0.0214 0.0053 -0.0220 1056 ILE 137 CD1 0.0212 0.0072 -0.0217 1057 ASP 138 N 0.0217 0.0021 -0.0224 1058 ASP 138 CA 0.0223 0.0013 -0.0227 1059 ASP 138 C 0.0215 0.0001 -0.0225 1060 ASP 138 O 0.0218 -0.0004 -0.0227 1061 ASP 138 CB 0.0235 0.0008 -0.0231 1062 ASP 138 CG 0.0245 0.0019 -0.0234 1063 ASP 138 OD1 0.0242 0.0030 -0.0231 1064 ASP 138 OD2 0.0256 0.0016 -0.0238 1065 ILE 139 N 0.0138 0.0005 -0.0204 1066 ILE 139 CA 0.0121 -0.0030 -0.0189 1067 ILE 139 C 0.0085 -0.0017 -0.0176 1068 ILE 139 O 0.0064 -0.0043 -0.0161 1069 ILE 139 CB 0.0112 -0.0060 -0.0178 1070 ILE 139 CG1 0.0076 -0.0045 -0.0166 1071 ILE 139 CG2 0.0146 -0.0067 -0.0191 1072 ILE 139 CD1 0.0059 -0.0078 -0.0152 1073 ASP 140 N 0.0079 0.0022 -0.0182 1074 ASP 140 CA 0.0046 0.0037 -0.0171 1075 ASP 140 C 0.0049 0.0017 -0.0168 1076 ASP 140 O 0.0078 0.0020 -0.0181 1077 ASP 140 CB 0.0044 0.0084 -0.0180 1078 ASP 140 CG 0.0005 0.0102 -0.0167 1079 ASP 140 OD1 -0.0022 0.0080 -0.0150 1080 ASP 140 OD2 0.0002 0.0140 -0.0174 1081 PRO 141 N -0.0052 0.0032 -0.0200 1082 PRO 141 CA -0.0098 0.0027 -0.0201 1083 PRO 141 C -0.0113 0.0080 -0.0167 1084 PRO 141 O -0.0127 0.0081 -0.0165 1085 PRO 141 CB -0.0156 0.0002 -0.0213 1086 PRO 141 CG -0.0131 -0.0029 -0.0234 1087 PRO 141 CD -0.0075 0.0004 -0.0217 1088 ALA 142 N -0.0109 0.0124 -0.0139 1089 ALA 142 CA -0.0122 0.0177 -0.0105 1090 ALA 142 C -0.0067 0.0200 -0.0093 1091 ALA 142 O -0.0070 0.0247 -0.0064 1092 ALA 142 CB -0.0140 0.0215 -0.0080 1093 ARG 143 N -0.0083 0.0173 -0.0149 1094 ARG 143 CA -0.0045 0.0187 -0.0123 1095 ARG 143 C -0.0059 0.0170 -0.0150 1096 ARG 143 O -0.0034 0.0181 -0.0129 1097 ARG 143 CB 0.0030 0.0178 -0.0123 1098 ARG 143 CG 0.0057 0.0209 -0.0074 1099 ARG 143 CD 0.0132 0.0207 -0.0065 1100 ARG 143 NE 0.0162 0.0232 -0.0024 1101 ARG 143 CZ 0.0165 0.0228 -0.0029 1102 ARG 143 NH1 0.0141 0.0199 -0.0075 1103 ARG 143 NH2 0.0194 0.0253 0.0011 1104 SER 144 N -0.0100 0.0143 -0.0195 1105 SER 144 CA -0.0117 0.0124 -0.0226 1106 SER 144 C -0.0056 0.0108 -0.0237 1107 SER 144 O -0.0054 0.0114 -0.0230 1108 SER 144 CB -0.0166 0.0150 -0.0196 1109 SER 144 OG -0.0147 0.0188 -0.0139 1110 GLY 5 N 0.0330 -0.0205 0.0088 1111 GLY 5 CA 0.0339 -0.0161 0.0069 1112 GLY 5 C 0.0261 -0.0132 0.0047 1113 GLY 5 O 0.0199 -0.0171 0.0058 1114 LEU 6 N 0.0264 -0.0064 0.0016 1115 LEU 6 CA 0.0194 -0.0028 -0.0009 1116 LEU 6 C 0.0174 0.0033 -0.0039 1117 LEU 6 O 0.0227 0.0071 -0.0051 1118 LEU 6 CB 0.0208 0.0002 -0.0021 1119 LEU 6 CG 0.0134 0.0011 -0.0034 1120 LEU 6 CD1 0.0085 -0.0062 -0.0006 1121 LEU 6 CD2 0.0156 0.0037 -0.0044 1122 TYR 7 N 0.0089 -0.0018 -0.0054 1123 TYR 7 CA 0.0086 -0.0005 -0.0066 1124 TYR 7 C 0.0064 -0.0000 -0.0075 1125 TYR 7 O 0.0049 -0.0010 -0.0070 1126 TYR 7 CB 0.0090 -0.0010 -0.0061 1127 TYR 7 CG 0.0113 -0.0009 -0.0056 1128 TYR 7 CD1 0.0125 0.0005 -0.0066 1129 TYR 7 CD2 0.0124 -0.0022 -0.0042 1130 TYR 7 CE1 0.0146 0.0006 -0.0062 1131 TYR 7 CE2 0.0145 -0.0021 -0.0038 1132 TYR 7 CZ 0.0156 -0.0007 -0.0048 1133 TYR 7 OH 0.0177 -0.0007 -0.0044 1134 ARG 8 N 0.0062 0.0015 -0.0089 1135 ARG 8 CA 0.0042 0.0021 -0.0099 1136 ARG 8 C 0.0040 0.0029 -0.0107 1137 ARG 8 O 0.0054 0.0039 -0.0113 1138 ARG 8 CB 0.0041 0.0033 -0.0110 1139 ARG 8 CG 0.0020 0.0039 -0.0121 1140 ARG 8 CD 0.0021 0.0053 -0.0133 1141 ARG 8 NE 0.0023 0.0047 -0.0128 1142 ARG 8 CZ 0.0035 0.0055 -0.0132 1143 ARG 8 NH1 0.0047 0.0069 -0.0142 1144 ARG 8 NH2 0.0036 0.0049 -0.0126 1145 MET 9 N -0.0046 0.0029 -0.0051 1146 MET 9 CA -0.0053 0.0020 -0.0035 1147 MET 9 C -0.0047 0.0031 -0.0017 1148 MET 9 O -0.0039 0.0042 -0.0016 1149 MET 9 CB -0.0059 0.0012 -0.0037 1150 MET 9 CG -0.0066 0.0004 -0.0020 1151 MET 9 SD -0.0075 -0.0009 -0.0026 1152 MET 9 CE -0.0087 -0.0024 -0.0011 1153 THR 10 N -0.0051 0.0027 -0.0003 1154 THR 10 CA -0.0047 0.0036 0.0015 1155 THR 10 C -0.0055 0.0026 0.0030 1156 THR 10 O -0.0064 0.0013 0.0032 1157 THR 10 CB -0.0042 0.0043 0.0018 1158 THR 10 CG2 -0.0051 0.0030 0.0016 1159 THR 10 OG1 -0.0039 0.0050 0.0037 1160 TYR 11 N -0.0054 0.0062 0.0076 1161 TYR 11 CA -0.0065 0.0062 0.0076 1162 TYR 11 C -0.0056 0.0062 0.0082 1163 TYR 11 O -0.0041 0.0062 0.0082 1164 TYR 11 CB -0.0073 0.0060 0.0059 1165 TYR 11 CG -0.0064 0.0058 0.0048 1166 TYR 11 CD1 -0.0068 0.0058 0.0047 1167 TYR 11 CD2 -0.0052 0.0056 0.0037 1168 TYR 11 CE1 -0.0059 0.0056 0.0036 1169 TYR 11 CE2 -0.0044 0.0054 0.0027 1170 TYR 11 CZ -0.0047 0.0055 0.0026 1171 TYR 11 OH -0.0039 0.0053 0.0015 1172 ILE 12 N -0.0066 0.0063 0.0086 1173 ILE 12 CA -0.0059 0.0064 0.0091 1174 ILE 12 C -0.0067 0.0063 0.0082 1175 ILE 12 O -0.0080 0.0062 0.0074 1176 ILE 12 CB -0.0061 0.0066 0.0110 1177 ILE 12 CG1 -0.0079 0.0068 0.0114 1178 ILE 12 CG2 -0.0053 0.0067 0.0119 1179 ILE 12 CD1 -0.0082 0.0070 0.0132 1180 SER 13 N 0.0005 0.0133 0.0094 1181 SER 13 CA 0.0011 0.0148 0.0054 1182 SER 13 C 0.0036 0.0125 0.0043 1183 SER 13 O 0.0052 0.0096 0.0061 1184 SER 13 CB 0.0019 0.0155 0.0026 1185 SER 13 OG 0.0036 0.0157 -0.0012 1186 ARG 14 N 0.0040 0.0138 0.0013 1187 ARG 14 CA 0.0062 0.0120 -0.0001 1188 ARG 14 C 0.0083 0.0117 -0.0041 1189 ARG 14 O 0.0075 0.0141 -0.0065 1190 ARG 14 CB 0.0049 0.0136 -0.0003 1191 ARG 14 CG 0.0032 0.0134 0.0036 1192 ARG 14 CD 0.0022 0.0148 0.0032 1193 ARG 14 NE 0.0007 0.0144 0.0070 1194 ARG 14 CZ 0.0020 0.0117 0.0089 1195 ARG 14 NH1 0.0049 0.0092 0.0076 1196 ARG 14 NH2 0.0005 0.0116 0.0123 1197 ALA 15 N 0.0139 0.0271 -0.0067 1198 ALA 15 CA 0.0142 0.0211 -0.0129 1199 ALA 15 C 0.0085 0.0226 -0.0188 1200 ALA 15 O 0.0049 0.0280 -0.0178 1201 ALA 15 CB 0.0196 0.0159 -0.0113 1202 VAL 16 N 0.0078 0.0177 -0.0250 1203 VAL 16 CA 0.0030 0.0179 -0.0311 1204 VAL 16 C 0.0051 0.0155 -0.0310 1205 VAL 16 O 0.0105 0.0115 -0.0281 1206 VAL 16 CB 0.0015 0.0136 -0.0378 1207 VAL 16 CG1 -0.0019 0.0171 -0.0386 1208 VAL 16 CG2 0.0071 0.0066 -0.0379 1209 PRO 17 N -0.0406 0.0452 -0.0300 1210 PRO 17 CA -0.0215 0.0425 -0.0177 1211 PRO 17 C 0.0027 0.0268 -0.0369 1212 PRO 17 O 0.0244 0.0229 -0.0255 1213 PRO 17 CB -0.0435 0.0515 -0.0151 1214 PRO 17 CG -0.0724 0.0563 -0.0313 1215 PRO 17 CD -0.0723 0.0544 -0.0366 1216 GLY 18 N -0.0002 0.0176 -0.0656 1217 GLY 18 CA 0.0202 0.0029 -0.0858 1218 GLY 18 C 0.0460 -0.0082 -0.0903 1219 GLY 18 O 0.0592 -0.0210 -0.1128 1220 LEU 19 N 0.0075 0.0004 -0.0121 1221 LEU 19 CA 0.0032 0.0007 -0.0092 1222 LEU 19 C -0.0058 0.0015 -0.0103 1223 LEU 19 O -0.0088 0.0019 -0.0165 1224 LEU 19 CB 0.0063 0.0005 -0.0136 1225 LEU 19 CG 0.0134 -0.0002 -0.0089 1226 LEU 19 CD1 0.0147 -0.0003 -0.0108 1227 LEU 19 CD2 0.0123 -0.0002 0.0001 1228 GLY 20 N -0.0103 0.0018 -0.0041 1229 GLY 20 CA -0.0190 0.0026 -0.0043 1230 GLY 20 C -0.0231 0.0029 -0.0021 1231 GLY 20 O -0.0192 0.0026 -0.0012 1232 TYR 21 N -0.0238 0.0256 0.0324 1233 TYR 21 CA -0.0135 0.0273 0.0244 1234 TYR 21 C -0.0125 0.0176 0.0164 1235 TYR 21 O -0.0056 0.0152 0.0083 1236 TYR 21 CB -0.0082 0.0372 0.0269 1237 TYR 21 CG -0.0064 0.0476 0.0330 1238 TYR 21 CD1 -0.0133 0.0520 0.0425 1239 TYR 21 CD2 0.0022 0.0529 0.0291 1240 TYR 21 CE1 -0.0117 0.0615 0.0480 1241 TYR 21 CE2 0.0039 0.0624 0.0346 1242 TYR 21 CZ -0.0031 0.0667 0.0440 1243 TYR 21 OH -0.0014 0.0761 0.0495 1244 ASN 22 N -0.0192 0.0122 0.0184 1245 ASN 22 CA -0.0186 0.0029 0.0110 1246 ASN 22 C -0.0197 -0.0058 0.0056 1247 ASN 22 O -0.0144 -0.0109 -0.0029 1248 ASN 22 CB -0.0263 -0.0011 0.0151 1249 ASN 22 CG -0.0244 0.0066 0.0190 1250 ASN 22 ND2 -0.0321 0.0059 0.0255 1251 ASN 22 OD1 -0.0161 0.0132 0.0163 1252 ASP 23 N -0.0066 -0.0069 0.0094 1253 ASP 23 CA -0.0049 -0.0105 0.0076 1254 ASP 23 C -0.0017 -0.0093 0.0038 1255 ASP 23 O 0.0003 -0.0121 0.0015 1256 ASP 23 CB -0.0064 -0.0117 0.0093 1257 ASP 23 CG -0.0092 -0.0143 0.0126 1258 ASP 23 OD1 -0.0090 -0.0184 0.0125 1259 ASP 23 OD2 -0.0116 -0.0122 0.0154 1260 LEU 24 N -0.0012 -0.0050 0.0031 1261 LEU 24 CA 0.0018 -0.0036 -0.0004 1262 LEU 24 C 0.0036 -0.0037 -0.0025 1263 LEU 24 O 0.0062 -0.0051 -0.0055 1264 LEU 24 CB 0.0018 0.0012 -0.0005 1265 LEU 24 CG 0.0009 0.0014 0.0005 1266 LEU 24 CD1 0.0010 0.0062 0.0002 1267 LEU 24 CD2 0.0029 -0.0018 -0.0018 1268 ARG 25 N 0.0044 0.0011 0.0032 1269 ARG 25 CA 0.0061 0.0044 -0.0019 1270 ARG 25 C 0.0054 -0.0009 -0.0049 1271 ARG 25 O 0.0065 -0.0007 -0.0113 1272 ARG 25 CB 0.0071 0.0110 0.0017 1273 ARG 25 CG 0.0090 0.0180 0.0007 1274 ARG 25 CD 0.0096 0.0241 0.0056 1275 ARG 25 NE 0.0106 0.0294 0.0074 1276 ARG 25 CZ 0.0098 0.0312 0.0141 1277 ARG 25 NH1 0.0081 0.0282 0.0198 1278 ARG 25 NH2 0.0108 0.0361 0.0151 1279 ASP 26 N 0.0035 -0.0055 -0.0003 1280 ASP 26 CA 0.0026 -0.0111 -0.0030 1281 ASP 26 C 0.0023 -0.0162 -0.0086 1282 ASP 26 O 0.0028 -0.0182 -0.0142 1283 ASP 26 CB 0.0005 -0.0153 0.0034 1284 ASP 26 CG -0.0004 -0.0203 0.0012 1285 ASP 26 OD1 0.0008 -0.0179 -0.0023 1286 ASP 26 OD2 -0.0022 -0.0267 0.0029 1287 ILE 27 N 0.0071 -0.0091 -0.0007 1288 ILE 27 CA 0.0066 -0.0111 -0.0028 1289 ILE 27 C 0.0048 -0.0098 -0.0052 1290 ILE 27 O 0.0041 -0.0102 -0.0066 1291 ILE 27 CB 0.0073 -0.0136 -0.0033 1292 ILE 27 CG1 0.0092 -0.0153 -0.0011 1293 ILE 27 CG2 0.0065 -0.0155 -0.0058 1294 ILE 27 CD1 0.0099 -0.0174 -0.0012 1295 MET 28 N 0.0039 -0.0082 -0.0057 1296 MET 28 CA 0.0021 -0.0068 -0.0078 1297 MET 28 C 0.0015 -0.0050 -0.0078 1298 MET 28 O 0.0004 -0.0052 -0.0097 1299 MET 28 CB 0.0015 -0.0050 -0.0078 1300 MET 28 CG -0.0001 -0.0047 -0.0104 1301 MET 28 SD 0.0001 -0.0073 -0.0118 1302 MET 28 CE -0.0004 -0.0054 -0.0113 1303 GLY 29 N -0.0030 -0.0037 0.0027 1304 GLY 29 CA -0.0049 0.0008 0.0046 1305 GLY 29 C -0.0033 -0.0006 0.0050 1306 GLY 29 O -0.0063 0.0011 0.0034 1307 LYS 30 N 0.0014 -0.0038 0.0071 1308 LYS 30 CA 0.0032 -0.0053 0.0077 1309 LYS 30 C 0.0010 -0.0085 0.0028 1310 LYS 30 O -0.0005 -0.0074 0.0021 1311 LYS 30 CB 0.0088 -0.0083 0.0107 1312 LYS 30 CG 0.0113 -0.0050 0.0161 1313 LYS 30 CD 0.0167 -0.0083 0.0189 1314 LYS 30 CE 0.0193 -0.0049 0.0243 1315 LYS 30 NZ 0.0246 -0.0081 0.0270 1316 SER 31 N -0.0061 -0.0030 0.0027 1317 SER 31 CA -0.0085 -0.0049 0.0013 1318 SER 31 C -0.0101 -0.0031 -0.0007 1319 SER 31 O -0.0122 -0.0032 -0.0024 1320 SER 31 CB -0.0082 -0.0076 0.0024 1321 SER 31 OG -0.0067 -0.0068 0.0034 1322 GLU 32 N -0.0091 -0.0013 -0.0005 1323 GLU 32 CA -0.0105 0.0004 -0.0023 1324 GLU 32 C -0.0114 0.0027 -0.0037 1325 GLU 32 O -0.0135 0.0029 -0.0056 1326 GLU 32 CB -0.0091 0.0020 -0.0016 1327 GLU 32 CG -0.0099 0.0006 -0.0018 1328 GLU 32 CD -0.0080 0.0014 -0.0005 1329 GLU 32 OE1 -0.0064 0.0037 0.0001 1330 GLU 32 OE2 -0.0080 -0.0002 0.0000 1331 VAL 33 N -0.0166 0.0070 0.0003 1332 VAL 33 CA -0.0175 0.0107 0.0009 1333 VAL 33 C -0.0179 0.0072 -0.0009 1334 VAL 33 O -0.0210 0.0088 -0.0037 1335 VAL 33 CB -0.0140 0.0140 0.0058 1336 VAL 33 CG1 -0.0140 0.0162 0.0067 1337 VAL 33 CG2 -0.0147 0.0190 0.0070 1338 ASN 34 N -0.0148 0.0024 0.0005 1339 ASN 34 CA -0.0148 -0.0010 -0.0009 1340 ASN 34 C -0.0186 -0.0035 -0.0059 1341 ASN 34 O -0.0206 -0.0034 -0.0080 1342 ASN 34 CB -0.0106 -0.0059 0.0016 1343 ASN 34 CG -0.0068 -0.0037 0.0066 1344 ASN 34 ND2 -0.0050 -0.0017 0.0093 1345 ASN 34 OD1 -0.0055 -0.0038 0.0079 1346 ASN 35 N -0.0164 -0.0023 -0.0028 1347 ASN 35 CA -0.0178 -0.0041 -0.0075 1348 ASN 35 C -0.0197 -0.0003 -0.0109 1349 ASN 35 O -0.0210 -0.0015 -0.0149 1350 ASN 35 CB -0.0177 -0.0056 -0.0077 1351 ASN 35 CG -0.0161 -0.0101 -0.0052 1352 ASN 35 ND2 -0.0164 -0.0137 -0.0076 1353 ASN 35 OD1 -0.0145 -0.0105 -0.0013 1354 SER 36 N -0.0199 0.0044 -0.0095 1355 SER 36 CA -0.0216 0.0082 -0.0125 1356 SER 36 C -0.0218 0.0076 -0.0133 1357 SER 36 O -0.0233 0.0082 -0.0171 1358 SER 36 CB -0.0216 0.0133 -0.0104 1359 SER 36 OG -0.0234 0.0167 -0.0139 1360 HIS 37 N -0.0261 0.0102 -0.0077 1361 HIS 37 CA -0.0253 0.0097 -0.0067 1362 HIS 37 C -0.0245 0.0038 -0.0110 1363 HIS 37 O -0.0259 0.0041 -0.0135 1364 HIS 37 CB -0.0218 0.0096 0.0005 1365 HIS 37 CG -0.0210 0.0095 0.0022 1366 HIS 37 CD2 -0.0191 0.0047 0.0012 1367 HIS 37 ND1 -0.0222 0.0150 0.0052 1368 HIS 37 CE1 -0.0211 0.0135 0.0061 1369 HIS 37 NE2 -0.0192 0.0073 0.0037 1370 VAL 38 N -0.0224 -0.0017 -0.0120 1371 VAL 38 CA -0.0210 -0.0078 -0.0155 1372 VAL 38 C -0.0240 -0.0089 -0.0228 1373 VAL 38 O -0.0245 -0.0114 -0.0265 1374 VAL 38 CB -0.0169 -0.0135 -0.0127 1375 VAL 38 CG1 -0.0163 -0.0197 -0.0178 1376 VAL 38 CG2 -0.0136 -0.0146 -0.0068 1377 GLY 39 N -0.0135 -0.0066 -0.0167 1378 GLY 39 CA -0.0134 -0.0063 -0.0190 1379 GLY 39 C -0.0137 -0.0075 -0.0178 1380 GLY 39 O -0.0141 -0.0092 -0.0196 1381 LEU 40 N -0.0136 -0.0068 -0.0147 1382 LEU 40 CA -0.0139 -0.0078 -0.0132 1383 LEU 40 C -0.0132 -0.0049 -0.0123 1384 LEU 40 O -0.0125 -0.0023 -0.0117 1385 LEU 40 CB -0.0145 -0.0098 -0.0101 1386 LEU 40 CG -0.0155 -0.0134 -0.0103 1387 LEU 40 CD1 -0.0159 -0.0147 -0.0070 1388 LEU 40 CD2 -0.0159 -0.0150 -0.0117 1389 THR 41 N -0.0056 -0.0001 -0.0094 1390 THR 41 CA -0.0041 0.0016 -0.0076 1391 THR 41 C -0.0047 -0.0001 -0.0045 1392 THR 41 O -0.0062 -0.0025 -0.0039 1393 THR 41 CB -0.0038 0.0026 -0.0096 1394 THR 41 CG2 -0.0032 0.0044 -0.0126 1395 THR 41 OG1 -0.0055 0.0003 -0.0105 1396 GLY 42 N -0.0034 0.0012 -0.0025 1397 GLY 42 CA -0.0038 -0.0002 0.0004 1398 GLY 42 C -0.0021 0.0016 0.0030 1399 GLY 42 O -0.0005 0.0040 0.0025 1400 LEU 43 N 0.0041 0.0000 0.0040 1401 LEU 43 CA 0.0059 0.0002 0.0056 1402 LEU 43 C 0.0053 -0.0005 0.0070 1403 LEU 43 O 0.0035 -0.0014 0.0071 1404 LEU 43 CB 0.0066 0.0000 0.0069 1405 LEU 43 CG 0.0085 0.0003 0.0086 1406 LEU 43 CD1 0.0104 0.0016 0.0076 1407 LEU 43 CD2 0.0086 -0.0001 0.0100 1408 LEU 44 N 0.0069 -0.0002 0.0081 1409 LEU 44 CA 0.0067 -0.0008 0.0094 1410 LEU 44 C 0.0082 -0.0009 0.0115 1411 LEU 44 O 0.0100 -0.0000 0.0115 1412 LEU 44 CB 0.0071 -0.0002 0.0083 1413 LEU 44 CG 0.0073 -0.0006 0.0096 1414 LEU 44 CD1 0.0052 -0.0017 0.0102 1415 LEU 44 CD2 0.0082 0.0003 0.0084 1416 CYS 45 N 0.0082 0.0001 0.0114 1417 CYS 45 CA 0.0078 -0.0011 0.0095 1418 CYS 45 C 0.0091 -0.0005 0.0078 1419 CYS 45 O 0.0104 0.0009 0.0076 1420 CYS 45 CB 0.0077 -0.0014 0.0091 1421 CYS 45 SG 0.0077 -0.0025 0.0065 1422 PHE 46 N 0.0087 -0.0014 0.0067 1423 PHE 46 CA 0.0097 -0.0010 0.0050 1424 PHE 46 C 0.0095 -0.0021 0.0030 1425 PHE 46 O 0.0083 -0.0036 0.0029 1426 PHE 46 CB 0.0095 -0.0011 0.0052 1427 PHE 46 CG 0.0105 -0.0008 0.0035 1428 PHE 46 CD1 0.0120 0.0004 0.0027 1429 PHE 46 CD2 0.0100 -0.0018 0.0027 1430 PHE 46 CE1 0.0129 0.0007 0.0011 1431 PHE 46 CE2 0.0109 -0.0015 0.0011 1432 PHE 46 CZ 0.0124 -0.0003 0.0003 1433 GLY 47 N 0.0091 -0.0019 0.0006 1434 GLY 47 CA 0.0105 -0.0040 0.0019 1435 GLY 47 C 0.0100 -0.0040 0.0021 1436 GLY 47 O 0.0078 -0.0029 0.0023 1437 ASN 48 N 0.0121 -0.0051 0.0020 1438 ASN 48 CA 0.0120 -0.0052 0.0021 1439 ASN 48 C 0.0110 -0.0029 0.0005 1440 ASN 48 O 0.0093 -0.0025 0.0010 1441 ASN 48 CB 0.0103 -0.0066 0.0044 1442 ASN 48 CG 0.0106 -0.0072 0.0048 1443 ASN 48 ND2 0.0086 -0.0077 0.0064 1444 ASN 48 OD1 0.0125 -0.0070 0.0036 1445 SER 49 N 0.0122 0.0015 0.0015 1446 SER 49 CA 0.0113 0.0039 -0.0002 1447 SER 49 C 0.0091 0.0056 0.0013 1448 SER 49 O 0.0079 0.0076 0.0005 1449 SER 49 CB 0.0116 0.0047 -0.0020 1450 SER 49 OG 0.0099 0.0060 -0.0008 1451 ILE 50 N 0.0085 0.0048 0.0034 1452 ILE 50 CA 0.0065 0.0062 0.0049 1453 ILE 50 C 0.0065 0.0058 0.0054 1454 ILE 50 O 0.0077 0.0038 0.0062 1455 ILE 50 CB 0.0054 0.0058 0.0075 1456 ILE 50 CG1 0.0055 0.0059 0.0071 1457 ILE 50 CG2 0.0033 0.0075 0.0089 1458 ILE 50 CD1 0.0038 0.0083 0.0068 1459 PHE 51 N 0.0090 0.0008 0.0062 1460 PHE 51 CA 0.0078 0.0016 0.0063 1461 PHE 51 C 0.0056 0.0014 0.0072 1462 PHE 51 O 0.0047 0.0019 0.0073 1463 PHE 51 CB 0.0080 0.0037 0.0051 1464 PHE 51 CG 0.0101 0.0041 0.0040 1465 PHE 51 CD1 0.0114 0.0043 0.0034 1466 PHE 51 CD2 0.0108 0.0042 0.0037 1467 PHE 51 CE1 0.0134 0.0047 0.0024 1468 PHE 51 CE2 0.0127 0.0046 0.0028 1469 PHE 51 CZ 0.0140 0.0048 0.0021 1470 LEU 52 N 0.0047 0.0007 0.0079 1471 LEU 52 CA 0.0025 0.0007 0.0088 1472 LEU 52 C 0.0016 0.0018 0.0085 1473 LEU 52 O 0.0022 0.0012 0.0086 1474 LEU 52 CB 0.0020 -0.0014 0.0101 1475 LEU 52 CG -0.0002 -0.0016 0.0111 1476 LEU 52 CD1 -0.0018 -0.0005 0.0111 1477 LEU 52 CD2 -0.0003 -0.0038 0.0123 1478 GLN 53 N -0.0004 -0.0005 0.0068 1479 GLN 53 CA 0.0000 -0.0003 0.0055 1480 GLN 53 C 0.0001 -0.0010 0.0040 1481 GLN 53 O -0.0004 -0.0023 0.0039 1482 GLN 53 CB -0.0003 -0.0010 0.0057 1483 GLN 53 CG 0.0001 -0.0009 0.0042 1484 GLN 53 CD -0.0000 -0.0010 0.0046 1485 GLN 53 NE2 0.0005 -0.0003 0.0037 1486 GLN 53 OE1 -0.0006 -0.0016 0.0058 1487 ILE 54 N 0.0008 -0.0001 0.0028 1488 ILE 54 CA 0.0010 -0.0007 0.0012 1489 ILE 54 C 0.0013 -0.0007 0.0001 1490 ILE 54 O 0.0018 0.0005 0.0000 1491 ILE 54 CB 0.0015 0.0004 0.0007 1492 ILE 54 CG1 0.0012 0.0003 0.0017 1493 ILE 54 CG2 0.0018 -0.0001 -0.0010 1494 ILE 54 CD1 0.0016 0.0007 0.0010 1495 LEU 55 N -0.0054 -0.0031 -0.0049 1496 LEU 55 CA -0.0052 -0.0036 -0.0056 1497 LEU 55 C -0.0045 -0.0040 -0.0072 1498 LEU 55 O -0.0044 -0.0046 -0.0076 1499 LEU 55 CB -0.0056 -0.0051 -0.0049 1500 LEU 55 CG -0.0062 -0.0048 -0.0035 1501 LEU 55 CD1 -0.0068 -0.0062 -0.0025 1502 LEU 55 CD2 -0.0061 -0.0046 -0.0038 1503 GLU 56 N -0.0041 -0.0036 -0.0080 1504 GLU 56 CA -0.0034 -0.0040 -0.0096 1505 GLU 56 C -0.0032 -0.0046 -0.0101 1506 GLU 56 O -0.0033 -0.0040 -0.0098 1507 GLU 56 CB -0.0029 -0.0025 -0.0104 1508 GLU 56 CG -0.0028 -0.0023 -0.0106 1509 GLU 56 CD -0.0025 -0.0006 -0.0109 1510 GLU 56 OE1 -0.0024 0.0004 -0.0108 1511 GLU 56 OE2 -0.0023 -0.0003 -0.0113 1512 GLY 57 N -0.0018 -0.0065 -0.0102 1513 GLY 57 CA -0.0008 -0.0096 -0.0092 1514 GLY 57 C 0.0013 -0.0104 -0.0088 1515 GLY 57 O 0.0026 -0.0083 -0.0095 1516 SER 58 N 0.0016 -0.0133 -0.0079 1517 SER 58 CA 0.0036 -0.0144 -0.0075 1518 SER 58 C 0.0020 -0.0135 -0.0078 1519 SER 58 O -0.0009 -0.0131 -0.0080 1520 SER 58 CB 0.0041 -0.0178 -0.0063 1521 SER 58 OG 0.0012 -0.0194 -0.0059 1522 ARG 59 N -0.0001 -0.0105 -0.0016 1523 ARG 59 CA 0.0017 -0.0091 -0.0034 1524 ARG 59 C 0.0019 -0.0090 -0.0032 1525 ARG 59 O 0.0020 -0.0088 -0.0053 1526 ARG 59 CB 0.0041 -0.0075 -0.0025 1527 ARG 59 CG 0.0058 -0.0061 -0.0048 1528 ARG 59 CD 0.0081 -0.0045 -0.0038 1529 ARG 59 NE 0.0091 -0.0039 -0.0013 1530 ARG 59 CZ 0.0110 -0.0027 0.0002 1531 ARG 59 NH1 0.0120 -0.0019 -0.0005 1532 ARG 59 NH2 0.0118 -0.0023 0.0024 1533 GLN 60 N 0.0018 -0.0092 -0.0006 1534 GLN 60 CA 0.0020 -0.0091 -0.0002 1535 GLN 60 C -0.0000 -0.0104 -0.0016 1536 GLN 60 O 0.0003 -0.0101 -0.0030 1537 GLN 60 CB 0.0022 -0.0091 0.0030 1538 GLN 60 CG 0.0021 -0.0093 0.0037 1539 GLN 60 CD 0.0041 -0.0078 0.0026 1540 GLN 60 NE2 0.0039 -0.0079 0.0028 1541 GLN 60 OE1 0.0058 -0.0065 0.0017 1542 ALA 61 N -0.0032 -0.0152 -0.0075 1543 ALA 61 CA -0.0044 -0.0144 -0.0069 1544 ALA 61 C -0.0054 -0.0130 -0.0065 1545 ALA 61 O -0.0069 -0.0129 -0.0057 1546 ALA 61 CB -0.0036 -0.0136 -0.0074 1547 ILE 62 N -0.0047 -0.0118 -0.0069 1548 ILE 62 CA -0.0056 -0.0104 -0.0065 1549 ILE 62 C -0.0068 -0.0113 -0.0059 1550 ILE 62 O -0.0082 -0.0107 -0.0052 1551 ILE 62 CB -0.0045 -0.0092 -0.0072 1552 ILE 62 CG1 -0.0037 -0.0079 -0.0076 1553 ILE 62 CG2 -0.0053 -0.0082 -0.0068 1554 ILE 62 CD1 -0.0029 -0.0064 -0.0082 1555 SER 63 N -0.0005 -0.0075 -0.0011 1556 SER 63 CA -0.0006 -0.0074 -0.0011 1557 SER 63 C -0.0017 -0.0082 -0.0008 1558 SER 63 O -0.0024 -0.0079 -0.0012 1559 SER 63 CB 0.0008 -0.0075 -0.0007 1560 SER 63 OG 0.0018 -0.0067 -0.0011 1561 HIS 64 N -0.0019 -0.0092 0.0000 1562 HIS 64 CA -0.0029 -0.0100 0.0004 1563 HIS 64 C -0.0043 -0.0097 -0.0001 1564 HIS 64 O -0.0052 -0.0098 -0.0002 1565 HIS 64 CB -0.0028 -0.0111 0.0014 1566 HIS 64 CG -0.0036 -0.0120 0.0019 1567 HIS 64 CD2 -0.0035 -0.0122 0.0021 1568 HIS 64 ND1 -0.0045 -0.0127 0.0024 1569 HIS 64 CE1 -0.0050 -0.0134 0.0028 1570 HIS 64 NE2 -0.0044 -0.0131 0.0027 1571 THR 65 N -0.0043 -0.0097 -0.0003 1572 THR 65 CA -0.0044 -0.0098 -0.0004 1573 THR 65 C -0.0058 -0.0083 -0.0002 1574 THR 65 O -0.0067 -0.0084 -0.0010 1575 THR 65 CB -0.0026 -0.0101 0.0007 1576 THR 65 CG2 -0.0026 -0.0100 0.0007 1577 THR 65 OG1 -0.0013 -0.0117 0.0003 1578 TYR 66 N -0.0061 -0.0068 0.0009 1579 TYR 66 CA -0.0075 -0.0053 0.0011 1580 TYR 66 C -0.0093 -0.0054 -0.0004 1581 TYR 66 O -0.0105 -0.0049 -0.0008 1582 TYR 66 CB -0.0074 -0.0037 0.0025 1583 TYR 66 CG -0.0087 -0.0021 0.0029 1584 TYR 66 CD1 -0.0085 -0.0017 0.0034 1585 TYR 66 CD2 -0.0102 -0.0011 0.0027 1586 TYR 66 CE1 -0.0097 -0.0002 0.0038 1587 TYR 66 CE2 -0.0114 0.0004 0.0030 1588 TYR 66 CZ -0.0111 0.0008 0.0036 1589 TYR 66 OH -0.0123 0.0023 0.0039 1590 HIS 67 N -0.0057 -0.0044 0.0012 1591 HIS 67 CA -0.0050 -0.0024 -0.0008 1592 HIS 67 C -0.0044 -0.0039 -0.0029 1593 HIS 67 O -0.0037 -0.0032 -0.0053 1594 HIS 67 CB -0.0054 -0.0002 0.0007 1595 HIS 67 CG -0.0048 0.0017 -0.0011 1596 HIS 67 CD2 -0.0040 0.0030 -0.0034 1597 HIS 67 ND1 -0.0049 0.0025 -0.0006 1598 HIS 67 CE1 -0.0043 0.0041 -0.0025 1599 HIS 67 NE2 -0.0037 0.0045 -0.0043 1600 ARG 68 N -0.0047 -0.0060 -0.0021 1601 ARG 68 CA -0.0042 -0.0076 -0.0041 1602 ARG 68 C -0.0038 -0.0093 -0.0059 1603 ARG 68 O -0.0031 -0.0097 -0.0083 1604 ARG 68 CB -0.0047 -0.0094 -0.0027 1605 ARG 68 CG -0.0042 -0.0110 -0.0046 1606 ARG 68 CD -0.0047 -0.0129 -0.0032 1607 ARG 68 NE -0.0056 -0.0125 -0.0003 1608 ARG 68 CZ -0.0062 -0.0145 0.0015 1609 ARG 68 NH1 -0.0060 -0.0171 0.0008 1610 ARG 68 NH2 -0.0069 -0.0138 0.0042 1611 ILE 69 N -0.0022 -0.0008 -0.0016 1612 ILE 69 CA -0.0007 -0.0032 -0.0018 1613 ILE 69 C -0.0004 -0.0020 -0.0031 1614 ILE 69 O 0.0013 -0.0031 -0.0048 1615 ILE 69 CB -0.0015 -0.0053 0.0011 1616 ILE 69 CG1 -0.0007 -0.0075 0.0018 1617 ILE 69 CG2 -0.0007 -0.0068 0.0013 1618 ILE 69 CD1 -0.0014 -0.0096 0.0046 1619 LEU 70 N -0.0022 0.0003 -0.0025 1620 LEU 70 CA -0.0021 0.0014 -0.0035 1621 LEU 70 C -0.0006 0.0025 -0.0066 1622 LEU 70 O 0.0001 0.0026 -0.0078 1623 LEU 70 CB -0.0043 0.0037 -0.0022 1624 LEU 70 CG -0.0055 0.0028 0.0003 1625 LEU 70 CD1 -0.0077 0.0053 0.0014 1626 LEU 70 CD2 -0.0042 0.0016 -0.0006 1627 GLN 71 N 0.0052 0.0016 -0.0076 1628 GLN 71 CA 0.0032 0.0011 -0.0134 1629 GLN 71 C 0.0048 -0.0015 -0.0157 1630 GLN 71 O 0.0028 -0.0014 -0.0202 1631 GLN 71 CB 0.0039 -0.0009 -0.0165 1632 GLN 71 CG 0.0031 0.0009 -0.0140 1633 GLN 71 CD -0.0012 0.0055 -0.0137 1634 GLN 71 NE2 -0.0036 0.0065 -0.0171 1635 GLN 71 OE1 -0.0025 0.0082 -0.0104 1636 ASP 72 N 0.0083 -0.0038 -0.0127 1637 ASP 72 CA 0.0104 -0.0068 -0.0149 1638 ASP 72 C 0.0080 -0.0046 -0.0153 1639 ASP 72 O 0.0073 -0.0021 -0.0112 1640 ASP 72 CB 0.0148 -0.0099 -0.0114 1641 ASP 72 CG 0.0177 -0.0142 -0.0147 1642 ASP 72 OD1 0.0168 -0.0146 -0.0177 1643 ASP 72 OD2 0.0209 -0.0173 -0.0143 1644 PRO 73 N 0.0102 0.0004 -0.0156 1645 PRO 73 CA 0.0035 0.0063 -0.0212 1646 PRO 73 C 0.0033 0.0071 -0.0213 1647 PRO 73 O -0.0017 0.0127 -0.0255 1648 PRO 73 CB -0.0032 -0.0004 -0.0274 1649 PRO 73 CG 0.0011 -0.0036 -0.0237 1650 PRO 73 CD 0.0067 -0.0071 -0.0190 1651 ARG 74 N 0.0081 0.0013 -0.0174 1652 ARG 74 CA 0.0082 0.0015 -0.0173 1653 ARG 74 C 0.0110 0.0116 -0.0143 1654 ARG 74 O 0.0095 0.0140 -0.0155 1655 ARG 74 CB 0.0132 -0.0077 -0.0133 1656 ARG 74 CG 0.0146 -0.0079 -0.0121 1657 ARG 74 CD 0.0158 -0.0186 -0.0116 1658 ARG 74 NE 0.0204 -0.0258 -0.0079 1659 ARG 74 CZ 0.0176 -0.0319 -0.0107 1660 ARG 74 NH1 0.0101 -0.0321 -0.0173 1661 ARG 74 NH2 0.0224 -0.0380 -0.0067 1662 HIS 75 N 0.0070 0.0065 -0.0174 1663 HIS 75 CA 0.0071 0.0100 -0.0144 1664 HIS 75 C 0.0062 0.0172 -0.0145 1665 HIS 75 O 0.0056 0.0193 -0.0161 1666 HIS 75 CB 0.0086 0.0076 -0.0077 1667 HIS 75 CG 0.0093 0.0089 -0.0031 1668 HIS 75 CD2 0.0105 0.0049 0.0007 1669 HIS 75 ND1 0.0088 0.0150 -0.0019 1670 HIS 75 CE1 0.0096 0.0147 0.0024 1671 HIS 75 NE2 0.0107 0.0086 0.0040 1672 HIS 76 N 0.0060 0.0209 -0.0128 1673 HIS 76 CA 0.0051 0.0279 -0.0130 1674 HIS 76 C 0.0056 0.0310 -0.0082 1675 HIS 76 O 0.0065 0.0278 -0.0057 1676 HIS 76 CB 0.0036 0.0303 -0.0198 1677 HIS 76 CG 0.0033 0.0295 -0.0219 1678 HIS 76 CD2 0.0023 0.0337 -0.0244 1679 HIS 76 ND1 0.0040 0.0237 -0.0215 1680 HIS 76 CE1 0.0036 0.0244 -0.0237 1681 HIS 76 NE2 0.0025 0.0305 -0.0255 1682 SER 77 N -0.0066 0.0158 -0.0009 1683 SER 77 CA -0.0076 0.0167 0.0020 1684 SER 77 C -0.0065 0.0158 0.0041 1685 SER 77 O -0.0059 0.0154 0.0066 1686 SER 77 CB -0.0075 0.0166 0.0031 1687 SER 77 OG -0.0087 0.0176 0.0013 1688 ALA 78 N -0.0063 0.0156 0.0032 1689 ALA 78 CA -0.0054 0.0149 0.0052 1690 ALA 78 C -0.0069 0.0163 0.0077 1691 ALA 78 O -0.0090 0.0180 0.0073 1692 ALA 78 CB -0.0049 0.0145 0.0035 1693 GLU 79 N -0.0134 0.0017 0.0111 1694 GLU 79 CA -0.0133 0.0010 0.0101 1695 GLU 79 C -0.0134 0.0014 0.0089 1696 GLU 79 O -0.0137 0.0025 0.0086 1697 GLU 79 CB -0.0133 0.0011 0.0101 1698 GLU 79 CG -0.0130 -0.0001 0.0098 1699 GLU 79 CD -0.0131 -0.0000 0.0099 1700 GLU 79 OE1 -0.0131 0.0003 0.0109 1701 GLU 79 OE2 -0.0131 -0.0002 0.0090 1702 ILE 80 N -0.0133 0.0006 0.0081 1703 ILE 80 CA -0.0134 0.0009 0.0068 1704 ILE 80 C -0.0134 0.0008 0.0059 1705 ILE 80 O -0.0132 -0.0001 0.0058 1706 ILE 80 CB -0.0132 0.0000 0.0064 1707 ILE 80 CG1 -0.0132 -0.0000 0.0074 1708 ILE 80 CG2 -0.0134 0.0004 0.0052 1709 ILE 80 CD1 -0.0129 -0.0011 0.0073 1710 ILE 81 N -0.0094 0.0002 0.0064 1711 ILE 81 CA -0.0095 -0.0001 0.0064 1712 ILE 81 C -0.0100 -0.0002 0.0057 1713 ILE 81 O -0.0103 -0.0007 0.0057 1714 ILE 81 CB -0.0091 0.0004 0.0066 1715 ILE 81 CG1 -0.0088 0.0002 0.0073 1716 ILE 81 CG2 -0.0094 0.0002 0.0063 1717 ILE 81 CD1 -0.0084 0.0007 0.0075 1718 ALA 82 N -0.0100 0.0003 0.0052 1719 ALA 82 CA -0.0104 0.0002 0.0046 1720 ALA 82 C -0.0104 0.0006 0.0040 1721 ALA 82 O -0.0101 0.0011 0.0041 1722 ALA 82 CB -0.0105 0.0002 0.0044 1723 PHE 83 N -0.0016 0.0091 0.0010 1724 PHE 83 CA -0.0001 0.0063 -0.0008 1725 PHE 83 C 0.0031 0.0059 -0.0036 1726 PHE 83 O 0.0034 0.0038 -0.0043 1727 PHE 83 CB -0.0022 0.0022 0.0001 1728 PHE 83 CG -0.0009 -0.0008 -0.0016 1729 PHE 83 CD1 0.0014 -0.0030 -0.0040 1730 PHE 83 CD2 -0.0022 -0.0015 -0.0007 1731 PHE 83 CE1 0.0025 -0.0058 -0.0055 1732 PHE 83 CE2 -0.0010 -0.0043 -0.0022 1733 PHE 83 CZ 0.0013 -0.0064 -0.0046 1734 ASP 84 N 0.0056 0.0080 -0.0053 1735 ASP 84 CA 0.0088 0.0081 -0.0079 1736 ASP 84 C 0.0112 0.0076 -0.0100 1737 ASP 84 O 0.0107 0.0088 -0.0094 1738 ASP 84 CB 0.0098 0.0120 -0.0080 1739 ASP 84 CG 0.0099 0.0157 -0.0073 1740 ASP 84 OD1 0.0074 0.0167 -0.0049 1741 ASP 84 OD2 0.0125 0.0177 -0.0091 1742 PRO 85 N 0.0264 0.0135 -0.0062 1743 PRO 85 CA 0.0272 0.0107 -0.0040 1744 PRO 85 C 0.0268 0.0124 -0.0053 1745 PRO 85 O 0.0276 0.0159 -0.0077 1746 PRO 85 CB 0.0322 0.0100 -0.0021 1747 PRO 85 CG 0.0341 0.0129 -0.0037 1748 PRO 85 CD 0.0307 0.0155 -0.0065 1749 VAL 86 N 0.0254 0.0098 -0.0038 1750 VAL 86 CA 0.0245 0.0110 -0.0049 1751 VAL 86 C 0.0267 0.0085 -0.0025 1752 VAL 86 O 0.0277 0.0053 0.0001 1753 VAL 86 CB 0.0192 0.0106 -0.0060 1754 VAL 86 CG1 0.0174 0.0141 -0.0092 1755 VAL 86 CG2 0.0167 0.0069 -0.0040 1756 LEU 87 N 0.0075 0.0051 0.0158 1757 LEU 87 CA -0.0029 0.0063 0.0231 1758 LEU 87 C 0.0001 0.0057 0.0211 1759 LEU 87 O -0.0041 0.0142 0.0243 1760 LEU 87 CB -0.0116 -0.0054 0.0289 1761 LEU 87 CG -0.0232 -0.0058 0.0370 1762 LEU 87 CD1 -0.0279 0.0090 0.0408 1763 LEU 87 CD2 -0.0319 -0.0151 0.0428 1764 GLN 88 N 0.0072 -0.0043 0.0157 1765 GLN 88 CA 0.0103 -0.0059 0.0135 1766 GLN 88 C 0.0226 -0.0112 0.0047 1767 GLN 88 O 0.0271 -0.0178 0.0013 1768 GLN 88 CB 0.0019 -0.0160 0.0191 1769 GLN 88 CG -0.0009 -0.0295 0.0205 1770 GLN 88 CD -0.0090 -0.0393 0.0259 1771 GLN 88 NE2 -0.0051 -0.0442 0.0230 1772 GLN 88 OE1 -0.0187 -0.0424 0.0326 1773 ARG 89 N -0.0053 -0.0098 -0.0109 1774 ARG 89 CA -0.0043 -0.0098 -0.0106 1775 ARG 89 C -0.0044 -0.0104 -0.0107 1776 ARG 89 O -0.0052 -0.0105 -0.0111 1777 ARG 89 CB -0.0040 -0.0087 -0.0103 1778 ARG 89 CG -0.0040 -0.0081 -0.0101 1779 ARG 89 CD -0.0033 -0.0072 -0.0097 1780 ARG 89 NE -0.0036 -0.0063 -0.0096 1781 ARG 89 CZ -0.0029 -0.0057 -0.0093 1782 ARG 89 NH1 -0.0020 -0.0058 -0.0089 1783 ARG 89 NH2 -0.0032 -0.0050 -0.0093 1784 GLU 90 N -0.0036 -0.0107 -0.0105 1785 GLU 90 CA -0.0035 -0.0111 -0.0105 1786 GLU 90 C -0.0029 -0.0106 -0.0102 1787 GLU 90 O -0.0029 -0.0108 -0.0102 1788 GLU 90 CB -0.0032 -0.0123 -0.0106 1789 GLU 90 CG -0.0039 -0.0129 -0.0110 1790 GLU 90 CD -0.0044 -0.0137 -0.0113 1791 GLU 90 OE1 -0.0046 -0.0135 -0.0114 1792 GLU 90 OE2 -0.0045 -0.0146 -0.0115 1793 PHE 91 N -0.0041 0.0016 -0.0099 1794 PHE 91 CA -0.0012 0.0047 -0.0076 1795 PHE 91 C -0.0016 0.0091 -0.0089 1796 PHE 91 O 0.0005 0.0109 -0.0072 1797 PHE 91 CB 0.0016 0.0028 -0.0045 1798 PHE 91 CG 0.0019 -0.0018 -0.0033 1799 PHE 91 CD1 0.0034 -0.0026 -0.0016 1800 PHE 91 CD2 0.0006 -0.0054 -0.0038 1801 PHE 91 CE1 0.0037 -0.0068 -0.0005 1802 PHE 91 CE2 0.0009 -0.0096 -0.0027 1803 PHE 91 CZ 0.0024 -0.0103 -0.0010 1804 VAL 92 N -0.0043 0.0107 -0.0119 1805 VAL 92 CA -0.0051 0.0146 -0.0135 1806 VAL 92 C -0.0028 0.0187 -0.0120 1807 VAL 92 O -0.0020 0.0214 -0.0118 1808 VAL 92 CB -0.0085 0.0153 -0.0170 1809 VAL 92 CG1 -0.0090 0.0149 -0.0174 1810 VAL 92 CG2 -0.0093 0.0197 -0.0187 1811 GLN 93 N -0.0108 0.0215 -0.0157 1812 GLN 93 CA -0.0066 0.0280 -0.0146 1813 GLN 93 C -0.0029 0.0290 -0.0106 1814 GLN 93 O -0.0010 0.0343 -0.0117 1815 GLN 93 CB -0.0041 0.0288 -0.0119 1816 GLN 93 CG -0.0075 0.0252 -0.0138 1817 GLN 93 CD -0.0073 0.0186 -0.0094 1818 GLN 93 NE2 -0.0104 0.0149 -0.0108 1819 GLN 93 OE1 -0.0044 0.0170 -0.0046 1820 TRP 94 N -0.0019 0.0239 -0.0060 1821 TRP 94 CA 0.0020 0.0246 -0.0015 1822 TRP 94 C -0.0002 0.0220 -0.0025 1823 TRP 94 O -0.0035 0.0163 -0.0030 1824 TRP 94 CB 0.0049 0.0209 0.0046 1825 TRP 94 CG 0.0067 0.0224 0.0058 1826 TRP 94 CD1 0.0050 0.0184 0.0064 1827 TRP 94 CD2 0.0105 0.0285 0.0066 1828 TRP 94 CE2 0.0109 0.0278 0.0076 1829 TRP 94 CE3 0.0135 0.0345 0.0065 1830 TRP 94 NE1 0.0076 0.0215 0.0075 1831 TRP 94 CZ2 0.0143 0.0328 0.0086 1832 TRP 94 CZ3 0.0169 0.0395 0.0074 1833 TRP 94 CH2 0.0172 0.0386 0.0085 1834 SER 95 N -0.0052 0.0119 -0.0019 1835 SER 95 CA -0.0063 0.0103 -0.0019 1836 SER 95 C -0.0059 0.0081 0.0014 1837 SER 95 O -0.0075 0.0055 0.0017 1838 SER 95 CB -0.0054 0.0126 -0.0030 1839 SER 95 OG -0.0066 0.0136 -0.0064 1840 MET 96 N -0.0038 0.0092 0.0040 1841 MET 96 CA -0.0032 0.0073 0.0073 1842 MET 96 C -0.0009 0.0090 0.0094 1843 MET 96 O 0.0008 0.0117 0.0091 1844 MET 96 CB -0.0029 0.0063 0.0089 1845 MET 96 CG -0.0039 0.0030 0.0110 1846 MET 96 SD -0.0070 -0.0001 0.0091 1847 MET 96 CE -0.0079 0.0008 0.0063 1848 LYS 97 N 0.0021 0.0092 0.0097 1849 LYS 97 CA 0.0042 0.0093 0.0113 1850 LYS 97 C 0.0039 0.0083 0.0135 1851 LYS 97 O 0.0020 0.0073 0.0141 1852 LYS 97 CB 0.0048 0.0092 0.0119 1853 LYS 97 CG 0.0073 0.0097 0.0127 1854 LYS 97 CD 0.0089 0.0108 0.0114 1855 LYS 97 CE 0.0113 0.0116 0.0117 1856 LYS 97 NZ 0.0129 0.0126 0.0104 1857 LEU 98 N 0.0057 0.0085 0.0145 1858 LEU 98 CA 0.0057 0.0076 0.0166 1859 LEU 98 C 0.0072 0.0073 0.0185 1860 LEU 98 O 0.0091 0.0081 0.0183 1861 LEU 98 CB 0.0066 0.0081 0.0163 1862 LEU 98 CG 0.0065 0.0073 0.0181 1863 LEU 98 CD1 0.0042 0.0061 0.0192 1864 LEU 98 CD2 0.0067 0.0077 0.0172 1865 VAL 99 N 0.0048 -0.0005 0.0154 1866 VAL 99 CA 0.0025 -0.0006 0.0114 1867 VAL 99 C 0.0034 0.0003 0.0077 1868 VAL 99 O 0.0070 0.0017 0.0064 1869 VAL 99 CB 0.0036 0.0000 0.0102 1870 VAL 99 CG1 0.0084 0.0016 0.0100 1871 VAL 99 CG2 0.0015 0.0000 0.0057 1872 GLN 100 N 0.0001 -0.0005 0.0062 1873 GLN 100 CA 0.0006 0.0002 0.0026 1874 GLN 100 C -0.0003 0.0006 -0.0019 1875 GLN 100 O -0.0024 -0.0000 -0.0021 1876 GLN 100 CB -0.0024 -0.0008 0.0030 1877 GLN 100 CG -0.0007 -0.0008 0.0062 1878 GLN 100 CD -0.0041 -0.0024 0.0090 1879 GLN 100 NE2 -0.0038 -0.0024 0.0101 1880 GLN 100 OE1 -0.0070 -0.0035 0.0103 1881 ILE 101 N -0.0023 -0.0137 -0.0054 1882 ILE 101 CA -0.0026 -0.0081 -0.0092 1883 ILE 101 C -0.0098 -0.0075 -0.0149 1884 ILE 101 O -0.0105 -0.0017 -0.0192 1885 ILE 101 CB 0.0028 -0.0009 -0.0099 1886 ILE 101 CG1 0.0013 0.0017 -0.0127 1887 ILE 101 CG2 0.0100 -0.0016 -0.0042 1888 ILE 101 CD1 0.0041 0.0097 -0.0158 1889 ASP 102 N -0.0151 -0.0134 -0.0150 1890 ASP 102 CA -0.0222 -0.0134 -0.0202 1891 ASP 102 C -0.0241 -0.0104 -0.0236 1892 ASP 102 O -0.0248 -0.0045 -0.0280 1893 ASP 102 CB -0.0271 -0.0209 -0.0190 1894 ASP 102 CG -0.0255 -0.0265 -0.0141 1895 ASP 102 OD1 -0.0226 -0.0247 -0.0132 1896 ASP 102 OD2 -0.0272 -0.0328 -0.0113 1897 SER 105 N 0.0065 0.0105 -0.0015 1898 SER 105 CA 0.0081 0.0091 -0.0109 1899 SER 105 C 0.0126 0.0151 -0.0069 1900 SER 105 O 0.0108 0.0167 0.0039 1901 SER 105 CB -0.0007 -0.0010 -0.0143 1902 SER 105 OG -0.0050 -0.0030 -0.0064 1903 PRO 106 N 0.0185 0.0185 -0.0155 1904 PRO 106 CA 0.0229 0.0241 -0.0123 1905 PRO 106 C 0.0162 0.0184 -0.0081 1906 PRO 106 O 0.0091 0.0100 -0.0115 1907 PRO 106 CB 0.0293 0.0270 -0.0243 1908 PRO 106 CG 0.0261 0.0205 -0.0341 1909 PRO 106 CD 0.0217 0.0178 -0.0283 1910 GLU 107 N 0.0098 0.0113 -0.0013 1911 GLU 107 CA 0.0093 0.0059 -0.0021 1912 GLU 107 C 0.0062 0.0043 -0.0065 1913 GLU 107 O 0.0056 -0.0003 -0.0074 1914 GLU 107 CB 0.0097 0.0047 -0.0014 1915 GLU 107 CG 0.0076 0.0074 -0.0045 1916 GLU 107 CD 0.0050 0.0042 -0.0083 1917 GLU 107 OE1 0.0054 -0.0005 -0.0077 1918 GLU 107 OE2 0.0026 0.0062 -0.0118 1919 LYS 108 N 0.0043 0.0079 -0.0093 1920 LYS 108 CA 0.0014 0.0066 -0.0135 1921 LYS 108 C 0.0016 0.0038 -0.0132 1922 LYS 108 O -0.0001 0.0002 -0.0157 1923 LYS 108 CB -0.0004 0.0114 -0.0162 1924 LYS 108 CG -0.0034 0.0105 -0.0206 1925 LYS 108 CD -0.0040 0.0136 -0.0214 1926 LYS 108 CE -0.0072 0.0130 -0.0259 1927 LYS 108 NZ -0.0081 0.0172 -0.0272 1928 MET 109 N 0.0040 0.0026 -0.0143 1929 MET 109 CA 0.0029 -0.0020 -0.0142 1930 MET 109 C 0.0018 -0.0047 -0.0119 1931 MET 109 O 0.0012 -0.0084 -0.0134 1932 MET 109 CB 0.0023 -0.0025 -0.0119 1933 MET 109 CG 0.0029 -0.0029 -0.0151 1934 MET 109 SD 0.0021 -0.0040 -0.0124 1935 MET 109 CE 0.0035 -0.0004 -0.0153 1936 ARG 110 N 0.0015 -0.0029 -0.0083 1937 ARG 110 CA 0.0006 -0.0051 -0.0062 1938 ARG 110 C 0.0011 -0.0054 -0.0092 1939 ARG 110 O 0.0003 -0.0087 -0.0091 1940 ARG 110 CB 0.0002 -0.0027 -0.0018 1941 ARG 110 CG -0.0006 -0.0031 0.0018 1942 ARG 110 CD -0.0005 0.0003 0.0055 1943 ARG 110 NE 0.0001 0.0033 0.0061 1944 ARG 110 CZ 0.0009 0.0076 0.0070 1945 ARG 110 NH1 0.0013 0.0095 0.0076 1946 ARG 110 NH2 0.0014 0.0100 0.0074 1947 ARG 111 N 0.0002 -0.0067 -0.0126 1948 ARG 111 CA 0.0017 -0.0057 -0.0132 1949 ARG 111 C 0.0041 -0.0059 -0.0119 1950 ARG 111 O 0.0060 -0.0049 -0.0126 1951 ARG 111 CB 0.0006 -0.0061 -0.0132 1952 ARG 111 CG 0.0019 -0.0050 -0.0142 1953 ARG 111 CD 0.0015 -0.0035 -0.0164 1954 ARG 111 NE -0.0004 -0.0034 -0.0174 1955 ARG 111 CZ -0.0004 -0.0032 -0.0177 1956 ARG 111 NH1 0.0016 -0.0031 -0.0170 1957 ARG 111 NH2 -0.0023 -0.0032 -0.0186 1958 LEU 112 N 0.0042 -0.0073 -0.0099 1959 LEU 112 CA 0.0064 -0.0076 -0.0085 1960 LEU 112 C 0.0077 -0.0070 -0.0088 1961 LEU 112 O 0.0099 -0.0064 -0.0088 1962 LEU 112 CB 0.0060 -0.0093 -0.0063 1963 LEU 112 CG 0.0049 -0.0100 -0.0058 1964 LEU 112 CD1 0.0054 -0.0115 -0.0035 1965 LEU 112 CD2 0.0058 -0.0090 -0.0069 1966 TYR 113 N 0.0032 -0.0028 -0.0059 1967 TYR 113 CA 0.0028 -0.0018 -0.0064 1968 TYR 113 C 0.0039 0.0013 -0.0074 1969 TYR 113 O 0.0056 0.0020 -0.0072 1970 TYR 113 CB -0.0005 -0.0021 -0.0071 1971 TYR 113 CG -0.0015 -0.0049 -0.0062 1972 TYR 113 CD1 0.0000 -0.0059 -0.0054 1973 TYR 113 CD2 -0.0040 -0.0064 -0.0063 1974 TYR 113 CE1 -0.0009 -0.0084 -0.0046 1975 TYR 113 CE2 -0.0050 -0.0089 -0.0055 1976 TYR 113 CZ -0.0034 -0.0099 -0.0047 1977 TYR 113 OH -0.0043 -0.0124 -0.0039 1978 LEU 114 N 0.0031 0.0030 -0.0083 1979 LEU 114 CA 0.0041 0.0060 -0.0093 1980 LEU 114 C 0.0073 0.0065 -0.0086 1981 LEU 114 O 0.0087 0.0084 -0.0091 1982 LEU 114 CB 0.0025 0.0075 -0.0104 1983 LEU 114 CG 0.0023 0.0106 -0.0117 1984 LEU 114 CD1 -0.0001 0.0110 -0.0125 1985 LEU 114 CD2 0.0017 0.0120 -0.0124 1986 LYS 115 N 0.0037 0.0057 -0.0006 1987 LYS 115 CA 0.0079 0.0065 0.0016 1988 LYS 115 C 0.0089 0.0068 0.0022 1989 LYS 115 O 0.0113 0.0097 0.0032 1990 LYS 115 CB 0.0101 0.0028 0.0031 1991 LYS 115 CG 0.0143 0.0041 0.0053 1992 LYS 115 CD 0.0168 0.0001 0.0069 1993 LYS 115 CE 0.0179 -0.0011 0.0076 1994 LYS 115 NZ 0.0210 -0.0044 0.0095 1995 TYR 116 N 0.0072 0.0039 0.0015 1996 TYR 116 CA 0.0084 0.0036 0.0021 1997 TYR 116 C 0.0053 0.0052 0.0003 1998 TYR 116 O 0.0050 0.0035 0.0003 1999 TYR 116 CB 0.0094 -0.0011 0.0030 2000 TYR 116 CG 0.0128 -0.0029 0.0050 2001 TYR 116 CD1 0.0166 -0.0014 0.0069 2002 TYR 116 CD2 0.0121 -0.0063 0.0049 2003 TYR 116 CE1 0.0196 -0.0031 0.0087 2004 TYR 116 CE2 0.0151 -0.0080 0.0066 2005 TYR 116 CZ 0.0189 -0.0063 0.0085 2006 TYR 116 OH 0.0219 -0.0080 0.0103 2007 SER 117 N 0.0033 0.0042 -0.0002 2008 SER 117 CA 0.0009 0.0056 -0.0016 2009 SER 117 C -0.0001 0.0091 -0.0023 2010 SER 117 O 0.0005 0.0100 -0.0019 2011 SER 117 CB -0.0018 0.0031 -0.0031 2012 SER 117 OG -0.0035 0.0029 -0.0040 2013 GLY 118 N -0.0018 0.0111 -0.0033 2014 GLY 118 CA -0.0032 0.0144 -0.0041 2015 GLY 118 C -0.0066 0.0142 -0.0060 2016 GLY 118 O -0.0080 0.0169 -0.0069 2017 GLU 119 N -0.0003 0.0090 -0.0040 2018 GLU 119 CA -0.0073 0.0088 -0.0036 2019 GLU 119 C -0.0082 0.0074 -0.0037 2020 GLU 119 O -0.0042 0.0040 -0.0042 2021 GLU 119 CB -0.0109 0.0035 -0.0038 2022 GLU 119 CG -0.0088 0.0034 -0.0040 2023 GLU 119 CD -0.0140 0.0062 -0.0034 2024 GLU 119 OE1 -0.0176 0.0108 -0.0029 2025 GLU 119 OE2 -0.0145 0.0039 -0.0036 2026 VAL 120 N -0.0136 0.0101 -0.0031 2027 VAL 120 CA -0.0148 0.0095 -0.0031 2028 VAL 120 C -0.0167 0.0024 -0.0036 2029 VAL 120 O -0.0142 -0.0003 -0.0040 2030 VAL 120 CB -0.0202 0.0145 -0.0024 2031 VAL 120 CG1 -0.0171 0.0214 -0.0020 2032 VAL 120 CG2 -0.0259 0.0146 -0.0021 2033 ALA 121 N -0.0052 -0.0026 0.0001 2034 ALA 121 CA -0.0058 -0.0039 0.0013 2035 ALA 121 C -0.0044 -0.0053 0.0012 2036 ALA 121 O -0.0030 -0.0054 0.0003 2037 ALA 121 CB -0.0067 -0.0046 0.0024 2038 PHE 122 N -0.0048 -0.0063 0.0021 2039 PHE 122 CA -0.0036 -0.0077 0.0021 2040 PHE 122 C -0.0030 -0.0090 0.0024 2041 PHE 122 O -0.0038 -0.0097 0.0035 2042 PHE 122 CB -0.0044 -0.0084 0.0030 2043 PHE 122 CG -0.0032 -0.0098 0.0030 2044 PHE 122 CD1 -0.0016 -0.0098 0.0020 2045 PHE 122 CD2 -0.0036 -0.0110 0.0041 2046 PHE 122 CE1 -0.0005 -0.0110 0.0020 2047 PHE 122 CE2 -0.0025 -0.0122 0.0041 2048 PHE 122 CZ -0.0010 -0.0122 0.0030 2049 MET 123 N -0.0051 -0.0072 0.0072 2050 MET 123 CA -0.0062 -0.0061 0.0070 2051 MET 123 C -0.0063 -0.0058 0.0078 2052 MET 123 O -0.0064 -0.0053 0.0090 2053 MET 123 CB -0.0068 -0.0054 0.0075 2054 MET 123 CG -0.0077 -0.0047 0.0065 2055 MET 123 SD -0.0084 -0.0037 0.0072 2056 MET 123 CE -0.0075 -0.0045 0.0076 2057 PRO 124 N -0.0062 -0.0061 0.0071 2058 PRO 124 CA -0.0062 -0.0059 0.0079 2059 PRO 124 C -0.0072 -0.0047 0.0080 2060 PRO 124 O -0.0072 -0.0044 0.0088 2061 PRO 124 CB -0.0057 -0.0067 0.0070 2062 PRO 124 CG -0.0057 -0.0071 0.0056 2063 PRO 124 CD -0.0062 -0.0066 0.0056 2064 GLU 125 N -0.0100 -0.0026 0.0105 2065 GLU 125 CA -0.0099 -0.0034 0.0104 2066 GLU 125 C -0.0099 -0.0037 0.0099 2067 GLU 125 O -0.0098 -0.0043 0.0097 2068 GLU 125 CB -0.0098 -0.0038 0.0111 2069 GLU 125 CG -0.0098 -0.0039 0.0115 2070 GLU 125 CD -0.0099 -0.0033 0.0121 2071 GLU 125 OE1 -0.0100 -0.0029 0.0123 2072 GLU 125 OE2 -0.0099 -0.0032 0.0124 2073 THR 126 N -0.0099 -0.0033 0.0098 2074 THR 126 CA -0.0099 -0.0035 0.0093 2075 THR 126 C -0.0100 -0.0032 0.0085 2076 THR 126 O -0.0099 -0.0033 0.0081 2077 THR 126 CB -0.0099 -0.0032 0.0097 2078 THR 126 CG2 -0.0099 -0.0035 0.0104 2079 THR 126 OG1 -0.0101 -0.0024 0.0097 2080 MET 127 N -0.0094 -0.0032 0.0068 2081 MET 127 CA -0.0074 -0.0036 0.0077 2082 MET 127 C -0.0089 -0.0033 0.0070 2083 MET 127 O -0.0106 -0.0033 0.0047 2084 MET 127 CB -0.0045 -0.0048 0.0060 2085 MET 127 CG -0.0020 -0.0052 0.0075 2086 MET 127 SD 0.0012 -0.0066 0.0053 2087 MET 127 CE 0.0032 -0.0069 0.0070 2088 THR 128 N -0.0082 -0.0031 0.0089 2089 THR 128 CA -0.0091 -0.0029 0.0082 2090 THR 128 C -0.0072 -0.0040 0.0059 2091 THR 128 O -0.0047 -0.0048 0.0056 2092 THR 128 CB -0.0090 -0.0023 0.0112 2093 THR 128 CG2 -0.0101 -0.0015 0.0137 2094 THR 128 OG1 -0.0060 -0.0031 0.0119 2095 PRO 129 N -0.0086 -0.0046 0.0061 2096 PRO 129 CA -0.0059 -0.0060 0.0028 2097 PRO 129 C -0.0016 -0.0062 0.0042 2098 PRO 129 O 0.0014 -0.0072 0.0022 2099 PRO 129 CB -0.0083 -0.0063 0.0007 2100 PRO 129 CG -0.0120 -0.0050 0.0032 2101 PRO 129 CD -0.0127 -0.0042 0.0056 2102 ALA 130 N -0.0013 -0.0052 0.0076 2103 ALA 130 CA 0.0028 -0.0053 0.0091 2104 ALA 130 C 0.0056 -0.0054 0.0102 2105 ALA 130 O 0.0092 -0.0062 0.0092 2106 ALA 130 CB 0.0023 -0.0042 0.0127 2107 GLN 131 N 0.0072 -0.0027 0.0084 2108 GLN 131 CA 0.0066 -0.0025 0.0084 2109 GLN 131 C 0.0057 -0.0053 0.0066 2110 GLN 131 O 0.0067 -0.0062 0.0065 2111 GLN 131 CB 0.0042 0.0000 0.0089 2112 GLN 131 CG 0.0052 0.0029 0.0107 2113 GLN 131 CD 0.0025 0.0054 0.0112 2114 GLN 131 NE2 0.0032 0.0080 0.0128 2115 GLN 131 OE1 -0.0002 0.0049 0.0100 2116 CYS 132 N 0.0039 -0.0067 0.0053 2117 CYS 132 CA 0.0031 -0.0094 0.0036 2118 CYS 132 C 0.0059 -0.0116 0.0034 2119 CYS 132 O 0.0063 -0.0132 0.0027 2120 CYS 132 CB 0.0007 -0.0104 0.0023 2121 CYS 132 SG -0.0031 -0.0086 0.0021 2122 LEU 133 N 0.0045 -0.0102 0.0007 2123 LEU 133 CA 0.0074 -0.0116 -0.0003 2124 LEU 133 C 0.0108 -0.0121 0.0017 2125 LEU 133 O 0.0134 -0.0136 0.0002 2126 LEU 133 CB 0.0066 -0.0112 0.0002 2127 LEU 133 CG 0.0094 -0.0124 -0.0004 2128 LEU 133 CD1 0.0103 -0.0141 -0.0041 2129 LEU 133 CD2 0.0084 -0.0118 0.0003 2130 GLN 134 N 0.0108 -0.0109 0.0051 2131 GLN 134 CA 0.0140 -0.0113 0.0072 2132 GLN 134 C 0.0154 -0.0122 0.0061 2133 GLN 134 O 0.0184 -0.0134 0.0058 2134 GLN 134 CB 0.0135 -0.0097 0.0110 2135 GLN 134 CG 0.0139 -0.0091 0.0128 2136 GLN 134 CD 0.0174 -0.0105 0.0126 2137 GLN 134 NE2 0.0175 -0.0106 0.0124 2138 GLN 134 OE1 0.0200 -0.0114 0.0126 2139 PHE 135 N 0.0098 -0.0109 0.0040 2140 PHE 135 CA 0.0094 -0.0116 0.0030 2141 PHE 135 C 0.0092 -0.0122 0.0034 2142 PHE 135 O 0.0087 -0.0131 0.0032 2143 PHE 135 CB 0.0097 -0.0109 0.0019 2144 PHE 135 CG 0.0093 -0.0115 0.0010 2145 PHE 135 CD1 0.0089 -0.0125 0.0006 2146 PHE 135 CD2 0.0095 -0.0111 0.0004 2147 PHE 135 CE1 0.0086 -0.0130 -0.0002 2148 PHE 135 CE2 0.0092 -0.0116 -0.0005 2149 PHE 135 CZ 0.0087 -0.0126 -0.0008 2150 MET 136 N 0.0095 -0.0116 0.0039 2151 MET 136 CA 0.0093 -0.0121 0.0042 2152 MET 136 C 0.0090 -0.0129 0.0052 2153 MET 136 O 0.0087 -0.0136 0.0054 2154 MET 136 CB 0.0097 -0.0112 0.0044 2155 MET 136 CG 0.0098 -0.0107 0.0032 2156 MET 136 SD 0.0095 -0.0113 0.0026 2157 MET 136 CE 0.0095 -0.0116 0.0038 2158 ILE 137 N 0.0105 -0.0159 -0.0016 2159 ILE 137 CA 0.0115 -0.0176 0.0002 2160 ILE 137 C 0.0125 -0.0198 0.0003 2161 ILE 137 O 0.0133 -0.0219 0.0001 2162 ILE 137 CB 0.0115 -0.0164 0.0029 2163 ILE 137 CG1 0.0109 -0.0151 0.0031 2164 ILE 137 CG2 0.0125 -0.0183 0.0050 2165 ILE 137 CD1 0.0106 -0.0135 0.0056 2166 ASP 138 N 0.0123 -0.0193 0.0006 2167 ASP 138 CA 0.0132 -0.0212 0.0010 2168 ASP 138 C 0.0136 -0.0230 -0.0014 2169 ASP 138 O 0.0144 -0.0249 -0.0011 2170 ASP 138 CB 0.0128 -0.0201 0.0018 2171 ASP 138 CG 0.0127 -0.0189 0.0045 2172 ASP 138 OD1 0.0129 -0.0189 0.0057 2173 ASP 138 OD2 0.0124 -0.0179 0.0053 2174 ILE 139 N 0.0107 -0.0144 0.0049 2175 ILE 139 CA 0.0131 -0.0141 0.0040 2176 ILE 139 C 0.0130 -0.0112 0.0039 2177 ILE 139 O 0.0151 -0.0103 0.0032 2178 ILE 139 CB 0.0160 -0.0144 0.0030 2179 ILE 139 CG1 0.0165 -0.0115 0.0027 2180 ILE 139 CG2 0.0160 -0.0172 0.0031 2181 ILE 139 CD1 0.0196 -0.0112 0.0016 2182 ASP 140 N 0.0105 -0.0097 0.0048 2183 ASP 140 CA 0.0102 -0.0069 0.0048 2184 ASP 140 C 0.0105 -0.0077 0.0047 2185 ASP 140 O 0.0090 -0.0097 0.0053 2186 ASP 140 CB 0.0072 -0.0055 0.0058 2187 ASP 140 CG 0.0071 -0.0021 0.0057 2188 ASP 140 OD1 0.0091 -0.0010 0.0050 2189 ASP 140 OD2 0.0049 -0.0006 0.0064 2190 PRO 141 N 0.0126 0.0029 0.0141 2191 PRO 141 CA 0.0153 0.0067 0.0141 2192 PRO 141 C 0.0081 0.0105 0.0112 2193 PRO 141 O 0.0086 0.0109 0.0112 2194 PRO 141 CB 0.0221 0.0137 0.0145 2195 PRO 141 CG 0.0250 0.0116 0.0158 2196 PRO 141 CD 0.0187 0.0052 0.0154 2197 ALA 142 N 0.0015 0.0132 0.0087 2198 ALA 142 CA -0.0056 0.0168 0.0059 2199 ALA 142 C -0.0118 0.0098 0.0056 2200 ALA 142 O -0.0189 0.0118 0.0031 2201 ALA 142 CB -0.0104 0.0226 0.0033 2202 ARG 143 N -0.0160 -0.0032 0.0095 2203 ARG 143 CA -0.0245 -0.0134 0.0010 2204 ARG 143 C -0.0285 -0.0225 -0.0066 2205 ARG 143 O -0.0369 -0.0310 -0.0136 2206 ARG 143 CB -0.0153 -0.0194 -0.0041 2207 ARG 143 CG -0.0177 -0.0137 0.0007 2208 ARG 143 CD -0.0082 -0.0198 -0.0045 2209 ARG 143 NE -0.0118 -0.0152 -0.0007 2210 ARG 143 CZ -0.0051 -0.0058 0.0072 2211 ARG 143 NH1 0.0056 0.0004 0.0123 2212 ARG 143 NH2 -0.0093 -0.0025 0.0100 2213 SER 144 N -0.0230 -0.0208 -0.0052 2214 SER 144 CA -0.0260 -0.0288 -0.0120 2215 SER 144 C -0.0234 -0.0418 -0.0229 2216 SER 144 O -0.0338 -0.0492 -0.0290 2217 SER 144 CB -0.0425 -0.0272 -0.0104 2218 SER 144 OG -0.0536 -0.0270 -0.0101