1 PHE 2 N -0.0095 0.0015 0.0325 2 PHE 2 CA -0.0008 0.0042 0.0225 3 PHE 2 C 0.0054 0.0030 0.0154 4 PHE 2 O 0.0054 -0.0067 0.0152 5 PHE 2 CB 0.0023 -0.0043 0.0188 6 PHE 2 CG -0.0035 -0.0050 0.0255 7 PHE 2 CD1 -0.0046 0.0055 0.0270 8 PHE 2 CD2 -0.0081 -0.0161 0.0306 9 PHE 2 CE1 -0.0101 0.0051 0.0333 10 PHE 2 CE2 -0.0134 -0.0169 0.0368 11 PHE 2 CZ -0.0146 -0.0061 0.0382 12 ALA 3 N 0.0372 -0.0283 0.0163 13 ALA 3 CA 0.0283 -0.0322 0.0212 14 ALA 3 C 0.0191 -0.0282 0.0167 15 ALA 3 O 0.0109 -0.0292 0.0181 16 ALA 3 CB 0.0306 -0.0380 0.0280 17 LYS 4 N 0.0222 -0.0071 -0.0325 18 LYS 4 CA 0.0153 0.0144 -0.0016 19 LYS 4 C 0.0182 0.0210 -0.0110 20 LYS 4 O 0.0229 -0.0002 -0.0334 21 LYS 4 CB 0.0044 -0.0083 0.0343 22 LYS 4 CG 0.0015 -0.0361 0.0388 23 LYS 4 CD -0.0055 -0.0729 0.0568 24 PRO 5 N 0.0144 0.0176 -0.0118 25 PRO 5 CA 0.0136 0.0136 -0.0149 26 PRO 5 C 0.0154 0.0044 -0.0140 27 PRO 5 O 0.0141 -0.0004 -0.0188 28 PRO 5 CB 0.0150 0.0173 -0.0104 29 PRO 5 CG 0.0163 0.0239 -0.0049 30 PRO 5 CD 0.0150 0.0253 -0.0075 31 GLU 6 N 0.0209 0.0300 -0.0153 32 GLU 6 CA 0.0153 0.0158 -0.0099 33 GLU 6 C 0.0313 -0.0013 -0.0268 34 GLU 6 O 0.0330 -0.0057 -0.0287 35 GLU 6 CB -0.0024 -0.0033 0.0076 36 GLU 6 CG -0.0206 0.0132 0.0268 37 GLU 6 CD -0.0245 0.0212 0.0310 38 GLU 6 OE1 -0.0125 0.0212 0.0187 39 GLU 6 OE2 -0.0426 0.0287 0.0498 40 ASP 7 N 0.0184 0.0056 -0.0172 41 ASP 7 CA 0.0159 0.0100 -0.0125 42 ASP 7 C 0.0100 0.0046 -0.0120 43 ASP 7 O 0.0096 0.0064 -0.0104 44 ASP 7 CB 0.0127 0.0162 -0.0061 45 ASP 7 CG 0.0185 0.0227 -0.0058 46 ASP 7 OD1 0.0256 0.0253 -0.0091 47 ASP 7 OD2 0.0167 0.0255 -0.0027 48 ALA 8 N 0.0014 0.0030 -0.0143 49 ALA 8 CA -0.0029 -0.0026 -0.0092 50 ALA 8 C -0.0022 -0.0074 -0.0073 51 ALA 8 O -0.0075 -0.0095 -0.0034 52 ALA 8 CB -0.0006 -0.0073 -0.0081 53 VAL 9 N 0.0020 -0.0027 -0.0137 54 VAL 9 CA 0.0020 -0.0051 -0.0113 55 VAL 9 C -0.0028 -0.0023 -0.0110 56 VAL 9 O -0.0058 -0.0038 -0.0075 57 VAL 9 CB 0.0073 -0.0064 -0.0135 58 VAL 9 CG1 0.0070 -0.0083 -0.0113 59 VAL 9 CG2 0.0123 -0.0096 -0.0135 60 LYS 10 N -0.0039 -0.0077 -0.0006 61 LYS 10 CA -0.0133 -0.0041 -0.0008 62 LYS 10 C -0.0250 -0.0040 0.0031 63 LYS 10 O -0.0332 -0.0057 0.0074 64 LYS 10 CB -0.0120 0.0052 -0.0099 65 LYS 10 CG -0.0229 0.0110 -0.0117 66 LYS 10 CD -0.0209 0.0194 -0.0203 67 TYR 11 N -0.0279 -0.0076 0.0002 68 TYR 11 CA -0.0237 -0.0061 0.0048 69 TYR 11 C -0.0222 -0.0019 0.0059 70 TYR 11 O -0.0200 0.0029 0.0078 71 TYR 11 CB -0.0216 -0.0119 0.0080 72 TYR 11 CG -0.0172 -0.0109 0.0128 73 TYR 11 CD1 -0.0154 -0.0093 0.0146 74 TYR 11 CD2 -0.0147 -0.0117 0.0158 75 TYR 11 CE1 -0.0113 -0.0085 0.0191 76 TYR 11 CE2 -0.0106 -0.0110 0.0203 77 TYR 11 CZ -0.0089 -0.0094 0.0220 78 TYR 11 OH -0.0049 -0.0085 0.0264 79 ARG 12 N -0.0200 0.0027 -0.0049 80 ARG 12 CA -0.0200 0.0015 -0.0001 81 ARG 12 C -0.0226 0.0021 0.0019 82 ARG 12 O -0.0244 0.0020 0.0057 83 ARG 12 CB -0.0155 -0.0008 0.0016 84 ARG 12 CG -0.0129 -0.0016 0.0003 85 ARG 12 CD -0.0081 -0.0037 0.0003 86 ARG 12 NE -0.0053 -0.0048 -0.0002 87 ARG 12 CZ -0.0012 -0.0060 -0.0023 88 ARG 12 NH1 0.0006 -0.0063 -0.0042 89 ARG 12 NH2 0.0010 -0.0070 -0.0024 90 GLN 13 N -0.0415 -0.0087 0.0166 91 GLN 13 CA -0.0447 -0.0092 0.0198 92 GLN 13 C -0.0586 -0.0006 0.0217 93 GLN 13 O -0.0660 -0.0017 0.0294 94 GLN 13 CB -0.0359 -0.0069 0.0097 95 GLN 13 CG -0.0229 -0.0172 0.0104 96 GLN 13 CD -0.0132 -0.0156 0.0003 97 GLN 13 OE1 -0.0164 -0.0062 -0.0078 98 GLN 13 NE2 -0.0018 -0.0248 0.0012 99 SER 14 N -0.0505 -0.0122 0.0262 100 SER 14 CA -0.0430 -0.0350 0.0163 101 SER 14 C -0.0072 -0.0192 0.0062 102 SER 14 O -0.0036 -0.0150 0.0060 103 SER 14 CB -0.0395 -0.0771 0.0022 104 SER 14 OG -0.0748 -0.0947 0.0114 105 ALA 15 N 0.0007 -0.0042 0.0056 106 ALA 15 CA 0.0074 -0.0011 -0.0025 107 ALA 15 C 0.0080 0.0056 -0.0076 108 ALA 15 O 0.0144 0.0054 -0.0132 109 ALA 15 CB 0.0067 0.0033 -0.0048 110 LEU 16 N -0.0052 0.0021 -0.0052 111 LEU 16 CA -0.0052 0.0032 -0.0088 112 LEU 16 C -0.0012 -0.0049 -0.0077 113 LEU 16 O 0.0007 -0.0067 -0.0135 114 LEU 16 CB -0.0097 0.0104 -0.0041 115 LEU 16 CG -0.0134 0.0188 -0.0078 116 LEU 16 CD1 -0.0178 0.0252 -0.0011 117 LEU 16 CD2 -0.0130 0.0212 -0.0175 118 THR 17 N -0.0170 -0.0491 -0.0231 119 THR 17 CA 0.0173 -0.0313 -0.0355 120 THR 17 C -0.0011 -0.0138 -0.0121 121 THR 17 O 0.0070 -0.0232 -0.0234 122 THR 17 CB 0.0528 0.0066 -0.0362 123 THR 17 OG1 0.0754 -0.0136 -0.0643 124 THR 17 CG2 0.0852 0.0319 -0.0427 125 LEU 18 N 0.0012 -0.0202 -0.0114 126 LEU 18 CA 0.0034 -0.0211 -0.0126 127 LEU 18 C 0.0077 -0.0164 -0.0098 128 LEU 18 O 0.0071 -0.0148 -0.0084 129 LEU 18 CB 0.0071 -0.0257 -0.0169 130 LEU 18 CG 0.0027 -0.0308 -0.0200 131 LEU 18 CD1 0.0064 -0.0352 -0.0242 132 LEU 18 CD2 -0.0033 -0.0307 -0.0188 133 MET 19 N 0.0137 -0.0114 -0.0104 134 MET 19 CA 0.0138 -0.0122 -0.0080 135 MET 19 C 0.0111 -0.0180 0.0010 136 MET 19 O 0.0063 -0.0221 0.0018 137 MET 19 CB 0.0221 -0.0057 -0.0078 138 MET 19 CG 0.0238 -0.0050 -0.0063 139 MET 19 SD 0.0338 0.0032 -0.0065 140 MET 19 CE 0.0340 0.0065 -0.0145 141 ALA 20 N 0.0027 -0.0316 -0.0103 142 ALA 20 CA 0.0017 -0.0319 -0.0082 143 ALA 20 C -0.0103 -0.0193 -0.0046 144 ALA 20 O -0.0157 -0.0199 0.0056 145 ALA 20 CB 0.0110 -0.0333 -0.0224 146 SER 21 N -0.0208 -0.0225 0.0028 147 SER 21 CA -0.0308 -0.0230 0.0026 148 SER 21 C -0.0165 -0.0187 0.0057 149 SER 21 O -0.0203 -0.0096 0.0129 150 SER 21 CB -0.0412 -0.0389 -0.0096 151 SER 21 OG -0.0487 -0.0397 -0.0100 152 HIS 22 N -0.0092 -0.0143 0.0077 153 HIS 22 CA -0.0062 -0.0131 0.0128 154 HIS 22 C -0.0036 -0.0106 0.0194 155 HIS 22 O -0.0028 -0.0078 0.0243 156 HIS 22 CB -0.0015 -0.0180 0.0112 157 HIS 22 CG -0.0049 -0.0186 0.0064 158 HIS 22 ND1 -0.0067 -0.0159 0.0083 159 HIS 22 CD2 -0.0073 -0.0214 -0.0002 160 HIS 22 CE1 -0.0099 -0.0171 0.0030 161 HIS 22 NE2 -0.0103 -0.0204 -0.0022 162 PHE 23 N 0.0026 -0.0116 0.0121 163 PHE 23 CA 0.0036 -0.0085 0.0127 164 PHE 23 C 0.0021 -0.0020 0.0102 165 PHE 23 O 0.0044 0.0030 0.0119 166 PHE 23 CB 0.0012 -0.0123 0.0109 167 PHE 23 CG 0.0015 -0.0091 0.0107 168 PHE 23 CD1 0.0054 -0.0088 0.0146 169 PHE 23 CD2 -0.0021 -0.0063 0.0068 170 PHE 23 CE1 0.0059 -0.0060 0.0146 171 PHE 23 CE2 -0.0017 -0.0036 0.0067 172 PHE 23 CZ 0.0022 -0.0034 0.0106 173 GLY 24 N -0.0084 -0.0018 0.0078 174 GLY 24 CA -0.0070 0.0128 -0.0072 175 GLY 24 C 0.0020 0.0319 -0.0018 176 GLY 24 O 0.0049 0.0449 -0.0095 177 ARG 25 N -0.0154 0.0474 0.0065 178 ARG 25 CA -0.0092 0.0573 0.0093 179 ARG 25 C 0.0083 0.0741 0.0175 180 ARG 25 O 0.0131 0.0871 0.0195 181 ARG 25 CB -0.0047 0.0404 0.0120 182 ARG 25 CG 0.0144 0.0281 0.0217 183 ARG 25 CD 0.0185 0.0094 0.0242 184 ARG 25 NE 0.0018 -0.0059 0.0163 185 ARG 25 CZ -0.0003 -0.0205 0.0157 186 ARG 25 NH1 0.0127 -0.0218 0.0221 187 ARG 25 NH2 -0.0166 -0.0337 0.0080 188 MET 26 N -0.0064 0.0347 0.0120 189 MET 26 CA -0.0063 0.0365 0.0196 190 MET 26 C -0.0064 0.0368 0.0167 191 MET 26 O -0.0063 0.0390 0.0223 192 MET 26 CB -0.0062 0.0287 0.0270 193 MET 26 CG -0.0062 0.0278 0.0298 194 MET 26 SD -0.0060 0.0209 0.0404 195 MET 26 CE -0.0060 0.0096 0.0350 196 THR 27 N -0.0001 0.0453 0.0141 197 THR 27 CA 0.0072 0.0255 -0.0001 198 THR 27 C 0.0108 0.0314 -0.0009 199 THR 27 O 0.0025 0.0149 -0.0003 200 THR 27 CB 0.0263 0.0184 -0.0194 201 THR 27 OG1 0.0221 0.0133 -0.0179 202 THR 27 CG2 0.0293 -0.0061 -0.0319 203 PRO 28 N 0.0213 0.0298 -0.0014 204 PRO 28 CA 0.0160 0.0230 -0.0001 205 PRO 28 C -0.0058 0.0194 0.0042 206 PRO 28 O -0.0113 0.0060 0.0060 207 PRO 28 CB 0.0237 0.0383 -0.0024 208 PRO 28 CG 0.0355 0.0530 -0.0054 209 PRO 28 CD 0.0315 0.0495 -0.0045 210 VAL 29 N -0.0054 0.0108 0.0093 211 VAL 29 CA -0.0079 0.0101 0.0062 212 VAL 29 C -0.0117 0.0089 0.0016 213 VAL 29 O -0.0122 0.0065 -0.0026 214 VAL 29 CB -0.0107 0.0133 0.0090 215 VAL 29 CG1 -0.0135 0.0125 0.0055 216 VAL 29 CG2 -0.0068 0.0143 0.0135 217 VAL 30 N -0.0256 0.0044 0.0041 218 VAL 30 CA -0.0266 -0.0019 0.0053 219 VAL 30 C -0.0250 -0.0049 0.0037 220 VAL 30 O -0.0268 -0.0092 0.0058 221 VAL 30 CB -0.0249 -0.0047 0.0036 222 VAL 30 CG1 -0.0230 -0.0110 0.0017 223 VAL 30 CG2 -0.0285 -0.0051 0.0075 224 LYS 31 N -0.0119 0.0009 0.0100 225 LYS 31 CA -0.0062 -0.0098 0.0067 226 LYS 31 C -0.0133 -0.0034 0.0113 227 LYS 31 O -0.0106 -0.0108 0.0099 228 LYS 31 CB 0.0102 -0.0085 -0.0049 229 LYS 31 CG 0.0189 -0.0136 -0.0107 230 LYS 31 CD 0.0350 -0.0164 -0.0218 231 GLY 32 N -0.0092 0.0064 -0.0029 232 GLY 32 CA 0.0009 0.0079 -0.0054 233 GLY 32 C 0.0043 0.0064 -0.0035 234 GLY 32 O 0.0124 0.0075 -0.0053 235 GLN 33 N 0.0044 0.0153 0.0037 236 GLN 33 CA -0.0042 0.0129 0.0031 237 GLN 33 C -0.0051 0.0057 -0.0018 238 GLN 33 O -0.0116 0.0037 -0.0023 239 GLN 33 CB -0.0101 0.0131 0.0041 240 GLN 33 CG -0.0088 0.0204 0.0090 241 GLN 33 CD -0.0145 0.0209 0.0101 242 GLN 33 OE1 -0.0138 0.0168 0.0072 243 GLN 33 NE2 -0.0205 0.0256 0.0143 244 ALA 34 N 0.0349 -0.0282 0.0059 245 ALA 34 CA 0.0356 -0.0310 0.0050 246 ALA 34 C 0.0354 -0.0304 -0.0026 247 ALA 34 O 0.0342 -0.0260 -0.0059 248 ALA 34 CB 0.0347 -0.0274 0.0092 249 PRO 35 N 0.0265 -0.0285 -0.0054 250 PRO 35 CA 0.0078 -0.0311 0.0291 251 PRO 35 C 0.0433 -0.0472 0.0158 252 PRO 35 O 0.0713 -0.0453 -0.0308 253 PRO 35 CB -0.0476 0.0061 0.0197 254 PRO 35 CG -0.0542 0.0314 -0.0334 255 PRO 35 CD -0.0106 0.0095 -0.0443 256 TYR 36 N 0.0167 -0.0288 0.0061 257 TYR 36 CA 0.0142 -0.0248 0.0046 258 TYR 36 C 0.0108 -0.0229 0.0024 259 TYR 36 O 0.0078 -0.0255 0.0001 260 TYR 36 CB 0.0123 -0.0264 0.0032 261 TYR 36 CG 0.0094 -0.0222 0.0015 262 TYR 36 CD1 0.0106 -0.0171 0.0026 263 TYR 36 CD2 0.0055 -0.0232 -0.0014 264 TYR 36 CE1 0.0080 -0.0134 0.0011 265 TYR 36 CE2 0.0028 -0.0195 -0.0031 266 TYR 36 CZ 0.0040 -0.0145 -0.0018 267 TYR 36 OH 0.0013 -0.0108 -0.0034 268 ASP 37 N 0.0131 -0.0338 -0.0042 269 ASP 37 CA -0.0047 -0.0187 -0.0077 270 ASP 37 C -0.0031 -0.0157 -0.0094 271 ASP 37 O 0.0125 -0.0074 -0.0165 272 ASP 37 CB -0.0025 0.0011 -0.0174 273 ASP 37 CG -0.0225 0.0163 -0.0205 274 ASP 37 OD1 -0.0220 0.0266 -0.0255 275 ASP 37 OD2 -0.0366 0.0190 -0.0190 276 ALA 38 N -0.0036 -0.0047 -0.0083 277 ALA 38 CA -0.0042 -0.0023 -0.0091 278 ALA 38 C -0.0035 0.0049 -0.0109 279 ALA 38 O -0.0006 0.0071 -0.0112 280 ALA 38 CB -0.0107 -0.0041 -0.0091 281 ALA 39 N 0.0088 0.0021 -0.0286 282 ALA 39 CA 0.0100 -0.0097 -0.0348 283 ALA 39 C -0.0063 -0.0100 -0.0035 284 ALA 39 O -0.0041 0.0037 -0.0033 285 ALA 39 CB 0.0127 -0.0478 -0.0528 286 GLN 40 N 0.0041 0.0077 0.0024 287 GLN 40 CA 0.0061 0.0083 0.0020 288 GLN 40 C -0.0069 0.0029 -0.0032 289 GLN 40 O -0.0124 0.0025 0.0030 290 GLN 40 CB 0.0193 0.0101 -0.0080 291 GLN 40 CG 0.0210 0.0098 -0.0115 292 GLN 40 CD 0.0334 0.0111 -0.0227 293 GLN 40 OE1 0.0417 0.0142 -0.0212 294 GLN 40 NE2 0.0354 0.0091 -0.0338 295 ILE 41 N -0.0022 0.0038 0.0011 296 ILE 41 CA -0.0051 0.0066 0.0010 297 ILE 41 C -0.0070 0.0086 0.0011 298 ILE 41 O -0.0092 0.0102 0.0033 299 ILE 41 CB -0.0054 0.0077 -0.0024 300 ILE 41 CG1 -0.0039 0.0062 -0.0020 301 ILE 41 CG2 -0.0085 0.0110 -0.0028 302 ILE 41 CD1 -0.0046 0.0060 0.0018 303 LYS 42 N -0.0164 0.0007 -0.0009 304 LYS 42 CA -0.0149 0.0041 -0.0044 305 LYS 42 C -0.0180 0.0002 0.0017 306 LYS 42 O -0.0206 0.0051 0.0038 307 LYS 42 CB -0.0082 0.0002 -0.0129 308 LYS 42 CG -0.0058 0.0043 -0.0180 309 LYS 42 CD 0.0008 0.0025 -0.0273 310 ALA 43 N -0.0269 0.0010 0.0138 311 ALA 43 CA -0.0258 0.0048 0.0234 312 ALA 43 C -0.0271 0.0000 0.0114 313 ALA 43 O -0.0343 -0.0033 0.0177 314 ALA 43 CB -0.0106 0.0182 0.0304 315 ASN 44 N -0.0231 0.0022 0.0146 316 ASN 44 CA -0.0198 0.0015 0.0130 317 ASN 44 C -0.0210 -0.0010 0.0128 318 ASN 44 O -0.0195 -0.0002 0.0124 319 ASN 44 CB -0.0170 -0.0009 0.0112 320 ASN 44 CG -0.0134 -0.0016 0.0095 321 ASN 44 OD1 -0.0128 -0.0051 0.0083 322 ASN 44 ND2 -0.0112 0.0017 0.0094 323 VAL 45 N -0.0271 -0.0077 0.0088 324 VAL 45 CA -0.0242 -0.0058 0.0093 325 VAL 45 C -0.0204 -0.0126 0.0076 326 VAL 45 O -0.0211 -0.0136 0.0073 327 VAL 45 CB -0.0188 0.0009 0.0110 328 VAL 45 CG1 -0.0151 0.0020 0.0113 329 VAL 45 CG2 -0.0233 0.0080 0.0128 330 GLU 46 N -0.0302 -0.0099 0.0073 331 GLU 46 CA -0.0291 -0.0102 0.0056 332 GLU 46 C -0.0246 -0.0096 -0.0033 333 GLU 46 O -0.0206 -0.0137 -0.0056 334 GLU 46 CB -0.0344 -0.0050 0.0088 335 VAL 47 N -0.0263 -0.0149 -0.0032 336 VAL 47 CA -0.0182 -0.0099 -0.0061 337 VAL 47 C -0.0070 -0.0121 -0.0010 338 VAL 47 O 0.0010 -0.0071 -0.0040 339 VAL 47 CB -0.0214 -0.0113 -0.0056 340 VAL 47 CG1 -0.0118 -0.0078 -0.0066 341 VAL 47 CG2 -0.0310 -0.0074 -0.0120 342 LEU 48 N -0.0042 -0.0138 -0.0022 343 LEU 48 CA 0.0003 -0.0148 0.0006 344 LEU 48 C 0.0054 -0.0149 -0.0001 345 LEU 48 O 0.0099 -0.0151 -0.0006 346 LEU 48 CB -0.0011 -0.0161 0.0065 347 LEU 48 CG 0.0034 -0.0172 0.0098 348 LEU 48 CD1 0.0054 -0.0168 0.0078 349 LEU 48 CD2 0.0014 -0.0184 0.0154 350 LYS 49 N -0.0117 -0.0181 0.0004 351 LYS 49 CA -0.0069 -0.0128 -0.0026 352 LYS 49 C -0.0044 -0.0096 -0.0067 353 LYS 49 O 0.0004 -0.0047 -0.0065 354 LYS 49 CB -0.0085 -0.0137 -0.0078 355 LYS 49 CG -0.0039 -0.0086 -0.0110 356 LYS 49 CD -0.0047 -0.0083 -0.0196 357 THR 50 N -0.0178 -0.0166 -0.0088 358 THR 50 CA -0.0131 0.0148 -0.0014 359 THR 50 C 0.0214 0.0141 -0.0101 360 THR 50 O 0.0234 0.0197 -0.0091 361 THR 50 CB -0.0130 0.0473 0.0074 362 THR 50 OG1 -0.0478 0.0510 0.0169 363 THR 50 CG2 -0.0002 0.0800 0.0131 364 LEU 51 N 0.0277 0.0008 -0.0135 365 LEU 51 CA 0.0307 0.0019 -0.0096 366 LEU 51 C 0.0347 0.0044 -0.0064 367 LEU 51 O 0.0382 0.0072 -0.0046 368 LEU 51 CB 0.0288 -0.0025 -0.0055 369 LEU 51 CG 0.0251 -0.0050 -0.0081 370 LEU 51 CD1 0.0225 -0.0098 -0.0043 371 LEU 51 CD2 0.0268 -0.0026 -0.0091 372 THR 52 N 0.0193 0.0044 -0.0015 373 THR 52 CA 0.0204 0.0046 -0.0006 374 THR 52 C 0.0187 0.0123 -0.0015 375 THR 52 O 0.0205 0.0139 0.0001 376 THR 52 CB 0.0172 -0.0019 -0.0037 377 THR 52 OG1 0.0109 -0.0012 -0.0088 378 THR 52 CG2 0.0201 -0.0099 -0.0018 379 ALA 53 N 0.0200 0.0154 0.0003 380 ALA 53 CA 0.0123 0.0206 0.0028 381 ALA 53 C 0.0165 0.0272 0.0097 382 ALA 53 O 0.0115 0.0313 0.0120 383 ALA 53 CB 0.0061 0.0247 0.0047 384 LEU 54 N 0.0156 0.0182 0.0138 385 LEU 54 CA 0.0168 0.0202 0.0168 386 LEU 54 C 0.0150 0.0160 0.0092 387 LEU 54 O 0.0111 0.0149 0.0135 388 LEU 54 CB 0.0275 0.0283 0.0183 389 LEU 54 CG 0.0293 0.0340 0.0302 390 LEU 54 CD1 0.0216 0.0319 0.0389 391 LEU 54 CD2 0.0393 0.0411 0.0302 392 PRO 55 N 0.0138 0.0124 0.0067 393 PRO 55 CA 0.0056 0.0121 0.0047 394 PRO 55 C -0.0026 0.0100 0.0053 395 PRO 55 O -0.0090 0.0075 0.0070 396 PRO 55 CB 0.0054 0.0174 -0.0033 397 PRO 55 CG 0.0146 0.0207 -0.0053 398 PRO 55 CD 0.0190 0.0177 0.0005 399 TRP 56 N 0.0065 0.0105 0.0092 400 TRP 56 CA 0.0020 0.0102 0.0088 401 TRP 56 C -0.0008 0.0079 0.0128 402 TRP 56 O -0.0051 0.0076 0.0125 403 TRP 56 CB 0.0027 0.0114 0.0066 404 TRP 56 CG 0.0065 0.0133 0.0036 405 TRP 56 CD1 0.0107 0.0137 0.0036 406 TRP 56 CD2 0.0065 0.0149 0.0003 407 TRP 56 NE1 0.0134 0.0156 0.0005 408 TRP 56 CE2 0.0109 0.0163 -0.0016 409 TRP 56 CE3 0.0033 0.0153 -0.0010 410 TRP 56 CZ2 0.0120 0.0181 -0.0048 411 TRP 56 CZ3 0.0044 0.0170 -0.0043 412 TRP 56 CH2 0.0087 0.0184 -0.0061 413 ALA 57 N -0.0123 -0.0021 0.0239 414 ALA 57 CA -0.0171 -0.0105 0.0317 415 ALA 57 C -0.0169 -0.0100 0.0178 416 ALA 57 O -0.0220 -0.0189 0.0200 417 ALA 57 CB -0.0123 -0.0023 0.0508 418 ALA 58 N -0.0174 -0.0109 0.0103 419 ALA 58 CA -0.0181 -0.0106 0.0055 420 ALA 58 C -0.0209 -0.0135 -0.0007 421 ALA 58 O -0.0213 -0.0127 -0.0059 422 ALA 58 CB -0.0148 -0.0045 0.0040 423 PHE 59 N -0.0113 -0.0104 -0.0031 424 PHE 59 CA -0.0117 -0.0133 -0.0061 425 PHE 59 C -0.0098 -0.0206 -0.0055 426 PHE 59 O -0.0086 -0.0237 -0.0041 427 PHE 59 CB -0.0110 -0.0109 -0.0028 428 PHE 59 CG -0.0131 -0.0041 -0.0041 429 PHE 59 CD1 -0.0154 -0.0029 -0.0096 430 PHE 59 CD2 -0.0128 0.0011 -0.0000 431 PHE 59 CE1 -0.0173 0.0034 -0.0109 432 PHE 59 CE2 -0.0147 0.0074 -0.0012 433 PHE 59 CZ -0.0169 0.0086 -0.0066 434 GLY 60 N -0.0240 -0.0183 -0.0034 435 GLY 60 CA -0.0192 -0.0194 -0.0055 436 GLY 60 C -0.0069 -0.0224 -0.0107 437 GLY 60 O -0.0015 -0.0230 -0.0134 438 PRO 61 N -0.0156 -0.0041 -0.0273 439 PRO 61 CA -0.0225 0.0059 -0.0157 440 PRO 61 C -0.0157 0.0029 0.0035 441 PRO 61 O -0.0107 -0.0006 0.0119 442 PRO 61 CB -0.0358 0.0199 -0.0175 443 PRO 61 CG -0.0373 0.0177 -0.0338 444 PRO 61 CD -0.0241 0.0025 -0.0384 445 GLY 62 N 0.0121 -0.0079 -0.0192 446 GLY 62 CA 0.0226 -0.0013 -0.0246 447 GLY 62 C 0.0139 -0.0021 -0.0238 448 GLY 62 O 0.0199 0.0056 -0.0300 449 THR 63 N 0.0019 -0.0159 -0.0140 450 THR 63 CA 0.0025 -0.0132 -0.0147 451 THR 63 C 0.0054 -0.0167 -0.0161 452 THR 63 O 0.0048 -0.0163 -0.0158 453 THR 63 CB -0.0021 -0.0111 -0.0120 454 THR 63 OG1 -0.0049 -0.0157 -0.0099 455 THR 63 CG2 -0.0045 -0.0073 -0.0110 456 GLU 64 N 0.0135 -0.0155 -0.0177 457 GLU 64 CA 0.0137 -0.0153 -0.0203 458 GLU 64 C 0.0136 -0.0113 -0.0233 459 GLU 64 O 0.0136 -0.0100 -0.0250 460 GLU 64 CB 0.0144 -0.0195 -0.0231 461 GLU 64 CG 0.0145 -0.0235 -0.0203 462 GLU 64 CD 0.0145 -0.0251 -0.0176 463 GLU 64 OE1 0.0144 -0.0241 -0.0185 464 GLU 64 OE2 0.0145 -0.0281 -0.0148 465 GLY 65 N 0.0175 -0.0058 -0.0218 466 GLY 65 CA 0.0141 0.0007 -0.0268 467 GLY 65 C 0.0095 0.0054 -0.0208 468 GLY 65 O 0.0088 0.0036 -0.0128 469 GLY 66 N 0.0118 0.0008 -0.0262 470 GLY 66 CA 0.0069 0.0035 -0.0221 471 GLY 66 C 0.0077 0.0104 -0.0143 472 GLY 66 O 0.0078 0.0127 -0.0117 473 ASP 67 N 0.0041 0.0280 -0.0073 474 ASP 67 CA 0.0055 0.0265 0.0001 475 ASP 67 C 0.0084 0.0310 -0.0031 476 ASP 67 O 0.0082 0.0293 0.0006 477 ASP 67 CB -0.0009 0.0178 0.0035 478 ASP 67 CG -0.0025 0.0133 0.0098 479 ASP 67 OD1 0.0031 0.0175 0.0149 480 ASP 67 OD2 -0.0084 0.0068 0.0097 481 ALA 68 N 0.0040 0.0227 -0.0003 482 ALA 68 CA 0.0048 0.0217 0.0009 483 ALA 68 C 0.0077 0.0204 0.0014 484 ALA 68 O 0.0096 0.0208 -0.0003 485 ALA 68 CB 0.0046 0.0228 -0.0008 486 ARG 69 N 0.0084 0.0213 0.0026 487 ARG 69 CA 0.0109 0.0169 0.0013 488 ARG 69 C 0.0081 0.0182 0.0026 489 ARG 69 O 0.0028 0.0200 0.0049 490 ARG 69 CB 0.0093 0.0098 0.0015 491 ARG 69 CG 0.0124 0.0074 0.0001 492 ARG 69 CD 0.0128 0.0001 -0.0006 493 ARG 69 NE 0.0144 -0.0035 -0.0015 494 ARG 69 CZ 0.0142 -0.0101 -0.0018 495 ARG 69 NH1 0.0126 -0.0133 -0.0013 496 ARG 69 NH2 0.0157 -0.0135 -0.0026 497 PRO 70 N 0.0139 0.0104 0.0068 498 PRO 70 CA 0.0135 0.0115 0.0066 499 PRO 70 C 0.0110 0.0095 0.0078 500 PRO 70 O 0.0096 0.0109 0.0078 501 PRO 70 CB 0.0169 0.0110 0.0058 502 PRO 70 CG 0.0194 0.0098 0.0054 503 PRO 70 CD 0.0175 0.0093 0.0060 504 GLU 71 N 0.0112 0.0107 0.0024 505 GLU 71 CA 0.0067 0.0072 0.0032 506 GLU 71 C 0.0014 0.0098 0.0043 507 GLU 71 O -0.0027 0.0086 0.0051 508 GLU 71 CB 0.0069 0.0014 0.0030 509 GLU 71 CG 0.0115 -0.0020 0.0019 510 GLU 71 CD 0.0169 -0.0005 0.0009 511 GLU 71 OE1 0.0166 0.0040 0.0011 512 GLU 71 OE2 0.0209 -0.0034 0.0000 513 ILE 72 N 0.0009 0.0090 0.0112 514 ILE 72 CA 0.0026 0.0085 0.0121 515 ILE 72 C 0.0059 0.0047 0.0110 516 ILE 72 O 0.0090 0.0040 0.0128 517 ILE 72 CB -0.0006 0.0091 0.0102 518 ILE 72 CG1 -0.0030 0.0132 0.0122 519 ILE 72 CG2 0.0013 0.0073 0.0098 520 ILE 72 CD1 -0.0070 0.0141 0.0100 521 TRP 73 N 0.0094 -0.0005 0.0048 522 TRP 73 CA 0.0104 -0.0052 0.0050 523 TRP 73 C 0.0105 -0.0035 0.0050 524 TRP 73 O 0.0136 -0.0061 0.0054 525 TRP 73 CB 0.0063 -0.0105 0.0046 526 TRP 73 CG 0.0071 -0.0134 0.0047 527 TRP 73 CD1 0.0105 -0.0180 0.0052 528 TRP 73 CD2 0.0044 -0.0117 0.0044 529 TRP 73 NE1 0.0101 -0.0193 0.0051 530 TRP 73 CE2 0.0065 -0.0155 0.0047 531 TRP 73 CE3 0.0004 -0.0074 0.0038 532 TRP 73 CZ2 0.0048 -0.0150 0.0044 533 TRP 73 CZ3 -0.0013 -0.0069 0.0036 534 TRP 73 CH2 0.0007 -0.0108 0.0039 535 SER 74 N 0.0013 0.0162 0.0172 536 SER 74 CA -0.0055 0.0076 0.0125 537 SER 74 C -0.0214 -0.0022 0.0074 538 SER 74 O -0.0344 -0.0038 0.0067 539 SER 74 CB 0.0083 -0.0038 0.0059 540 SER 74 OG 0.0251 0.0028 0.0092 541 ASP 75 N -0.0170 -0.0015 0.0121 542 ASP 75 CA -0.0146 -0.0000 0.0072 543 ASP 75 C -0.0036 0.0032 0.0188 544 ASP 75 O 0.0074 0.0082 0.0141 545 ASP 75 CB -0.0076 0.0045 -0.0096 546 ASP 75 CG -0.0166 0.0021 -0.0223 547 ASP 75 OD1 -0.0267 -0.0026 -0.0159 548 ASP 75 OD2 -0.0146 0.0044 -0.0368 549 ALA 76 N -0.0032 0.0038 0.0199 550 ALA 76 CA 0.0061 0.0044 0.0289 551 ALA 76 C 0.0116 0.0069 0.0268 552 ALA 76 O 0.0223 0.0098 0.0299 553 ALA 76 CB 0.0022 -0.0009 0.0416 554 ALA 77 N -0.0180 0.0143 0.0605 555 ALA 77 CA -0.0292 0.0079 0.0508 556 ALA 77 C 0.0252 0.0194 -0.0128 557 ALA 77 O 0.0562 0.0343 -0.0020 558 ALA 77 CB -0.1089 -0.0287 0.0334 559 SER 78 N 0.0263 0.0177 0.0072 560 SER 78 CA 0.0274 0.0205 0.0055 561 SER 78 C 0.0299 0.0082 0.0075 562 SER 78 O 0.0354 0.0069 0.0037 563 SER 78 CB 0.0177 0.0291 0.0100 564 SER 78 OG 0.0161 0.0393 0.0080 565 PHE 79 N 0.0299 0.0129 0.0202 566 PHE 79 CA 0.0247 0.0110 0.0184 567 PHE 79 C 0.0266 0.0098 0.0166 568 PHE 79 O 0.0237 0.0102 0.0175 569 PHE 79 CB 0.0224 0.0076 0.0143 570 PHE 79 CG 0.0170 0.0056 0.0124 571 PHE 79 CD1 0.0115 0.0071 0.0150 572 PHE 79 CD2 0.0174 0.0021 0.0079 573 PHE 79 CE1 0.0063 0.0052 0.0132 574 PHE 79 CE2 0.0123 0.0003 0.0062 575 PHE 79 CZ 0.0067 0.0018 0.0088 576 LYS 80 N 0.0347 0.0096 0.0100 577 LYS 80 CA 0.0248 0.0122 0.0079 578 LYS 80 C 0.0189 0.0010 0.0013 579 LYS 80 O 0.0162 -0.0012 -0.0005 580 LYS 80 CB 0.0156 0.0215 0.0088 581 LYS 80 CG 0.0068 0.0279 0.0086 582 LYS 80 CD 0.0134 0.0361 0.0142 583 GLN 81 N 0.0216 0.0073 -0.0061 584 GLN 81 CA 0.0157 -0.0038 -0.0109 585 GLN 81 C 0.0130 -0.0230 -0.0052 586 GLN 81 O 0.0050 -0.0347 -0.0135 587 GLN 81 CB 0.0208 0.0011 -0.0042 588 LYS 82 N 0.0229 -0.0194 -0.0024 589 LYS 82 CA 0.0184 -0.0199 -0.0008 590 LYS 82 C 0.0138 -0.0197 -0.0042 591 LYS 82 O 0.0096 -0.0201 -0.0024 592 LYS 82 CB 0.0194 -0.0199 0.0000 593 LYS 82 CG 0.0218 -0.0205 0.0052 594 LYS 82 CD 0.0198 -0.0210 0.0079 595 LYS 82 CE 0.0239 -0.0213 0.0114 596 LYS 82 NZ 0.0246 -0.0219 0.0160 597 GLN 83 N 0.0132 -0.0127 -0.0025 598 GLN 83 CA 0.0093 -0.0076 -0.0034 599 GLN 83 C -0.0047 -0.0104 -0.0089 600 GLN 83 O -0.0079 -0.0150 -0.0106 601 GLN 83 CB 0.0124 0.0071 -0.0005 602 GLN 83 CG 0.0026 0.0147 -0.0032 603 GLN 83 CD 0.0027 0.0288 -0.0014 604 GLN 83 OE1 -0.0058 0.0368 -0.0036 605 GLN 83 NE2 0.0125 0.0315 0.0025 606 GLN 84 N -0.0155 -0.0126 -0.0125 607 GLN 84 CA -0.0381 -0.0161 -0.0093 608 GLN 84 C -0.0387 -0.0343 -0.0162 609 GLN 84 O -0.0467 -0.0317 -0.0136 610 GLN 84 CB -0.0576 -0.0202 -0.0070 611 ALA 85 N -0.0216 -0.0344 -0.0133 612 ALA 85 CA -0.0226 -0.0299 -0.0101 613 ALA 85 C -0.0227 -0.0139 -0.0121 614 ALA 85 O -0.0248 -0.0066 -0.0048 615 ALA 85 CB -0.0200 -0.0372 -0.0194 616 PHE 86 N -0.0067 -0.0090 -0.0108 617 PHE 86 CA -0.0026 -0.0064 -0.0107 618 PHE 86 C -0.0075 -0.0019 -0.0087 619 PHE 86 O -0.0083 -0.0026 -0.0088 620 PHE 86 CB 0.0048 -0.0025 -0.0107 621 PHE 86 CG 0.0078 0.0021 -0.0099 622 PHE 86 CD1 0.0109 -0.0012 -0.0113 623 PHE 86 CD2 0.0077 0.0096 -0.0078 624 PHE 86 CE1 0.0136 0.0028 -0.0106 625 PHE 86 CE2 0.0102 0.0138 -0.0070 626 PHE 86 CZ 0.0131 0.0103 -0.0084 627 GLN 87 N -0.0104 -0.0209 -0.0129 628 GLN 87 CA -0.0159 -0.0171 -0.0135 629 GLN 87 C -0.0229 -0.0216 -0.0157 630 GLN 87 O -0.0264 -0.0214 -0.0164 631 GLN 87 CB -0.0176 -0.0092 -0.0125 632 GLN 87 CG -0.0100 -0.0048 -0.0101 633 GLN 87 CD -0.0113 0.0038 -0.0090 634 GLN 87 OE1 -0.0128 0.0069 -0.0088 635 GLN 87 NE2 -0.0108 0.0076 -0.0083 636 ASP 88 N -0.0301 -0.0286 -0.0224 637 ASP 88 CA -0.0110 -0.0147 -0.0111 638 ASP 88 C -0.0298 0.0003 0.0027 639 ASP 88 O -0.0221 0.0049 0.0064 640 ASP 88 CB 0.0095 0.0005 0.0013 641 ASP 88 CG 0.0374 -0.0115 -0.0103 642 ASP 88 OD1 0.0432 -0.0313 -0.0278 643 ASP 88 OD2 0.0538 0.0017 0.0005 644 ASN 89 N -0.0287 0.0091 0.0003 645 ASN 89 CA -0.0267 0.0129 -0.0017 646 ASN 89 C -0.0240 0.0147 0.0004 647 ASN 89 O -0.0214 0.0177 0.0005 648 ASN 89 CB -0.0287 0.0137 -0.0062 649 ASN 89 CG -0.0301 0.0137 -0.0085 650 ASN 89 OD1 -0.0283 0.0158 -0.0084 651 ASN 89 ND2 -0.0331 0.0110 -0.0098 652 ILE 90 N -0.0133 -0.0060 -0.0101 653 ILE 90 CA -0.0113 -0.0049 -0.0082 654 ILE 90 C -0.0110 -0.0046 -0.0065 655 ILE 90 O -0.0089 -0.0035 -0.0059 656 ILE 90 CB -0.0116 -0.0050 -0.0063 657 ILE 90 CG1 -0.0113 -0.0049 -0.0078 658 ILE 90 CG2 -0.0099 -0.0039 -0.0037 659 ILE 90 CD1 -0.0088 -0.0036 -0.0090 660 VAL 91 N -0.0240 -0.0174 -0.0037 661 VAL 91 CA 0.0196 -0.0222 -0.0056 662 VAL 91 C 0.0193 0.0174 0.0245 663 VAL 91 O 0.0250 0.0154 0.0232 664 VAL 91 CB 0.0753 -0.0320 -0.0107 665 VAL 91 CG1 0.1226 -0.0275 -0.0053 666 VAL 91 CG2 0.0785 -0.0775 -0.0450 667 LYS 92 N -0.0147 0.0167 0.0230 668 LYS 92 CA -0.0088 0.0203 0.0130 669 LYS 92 C 0.0065 0.0309 0.0105 670 LYS 92 O 0.0145 0.0366 0.0117 671 LYS 92 CB -0.0162 0.0142 -0.0031 672 LYS 92 CG -0.0144 0.0150 -0.0119 673 LYS 92 CD -0.0247 0.0070 -0.0255 674 LYS 92 CE -0.0195 0.0097 -0.0421 675 LYS 92 NZ -0.0294 0.0024 -0.0496 676 LEU 93 N -0.0121 0.0235 0.0110 677 LEU 93 CA -0.0097 0.0238 0.0110 678 LEU 93 C -0.0056 0.0220 0.0134 679 LEU 93 O -0.0020 0.0229 0.0129 680 LEU 93 CB -0.0129 0.0227 0.0118 681 LEU 93 CG -0.0107 0.0228 0.0119 682 LEU 93 CD1 -0.0099 0.0261 0.0086 683 LEU 93 CD2 -0.0137 0.0210 0.0133 684 SER 94 N 0.0041 0.0339 0.0171 685 SER 94 CA 0.0114 0.0244 0.0137 686 SER 94 C 0.0239 0.0308 0.0148 687 SER 94 O 0.0270 0.0284 0.0138 688 SER 94 CB 0.0157 0.0145 0.0105 689 SER 94 OG 0.0201 0.0036 0.0069 690 ALA 95 N 0.0568 0.0203 0.0037 691 ALA 95 CA 0.0719 0.0290 0.0067 692 ALA 95 C 0.0336 0.0277 0.0397 693 ALA 95 O 0.0236 0.0183 0.0304 694 ALA 95 CB 0.1178 0.0606 0.0262 695 ALA 96 N 0.0041 0.0223 0.0196 696 ALA 96 CA 0.0043 0.0199 0.0196 697 ALA 96 C 0.0049 0.0146 0.0199 698 ALA 96 O 0.0060 0.0120 0.0177 699 ALA 96 CB 0.0027 0.0215 0.0234 700 ALA 97 N 0.0123 0.0263 0.0197 701 ALA 97 CA 0.0051 0.0185 0.0159 702 ALA 97 C 0.0083 0.0149 0.0078 703 ALA 97 O 0.0033 0.0104 0.0064 704 ALA 97 CB 0.0016 0.0143 0.0134 705 ASP 98 N 0.0140 0.0187 0.0065 706 ASP 98 CA 0.0138 0.0167 -0.0035 707 ASP 98 C 0.0101 0.0184 0.0089 708 ASP 98 O 0.0025 0.0159 0.0042 709 ASP 98 CB 0.0317 0.0183 -0.0137 710 ASP 98 CG 0.0368 0.0167 -0.0266 711 ASP 98 OD1 0.0262 0.0129 -0.0340 712 ASP 98 OD2 0.0541 0.0197 -0.0293 713 ALA 99 N 0.0071 0.0196 0.0222 714 ALA 99 CA -0.0056 0.0061 0.0265 715 ALA 99 C -0.0049 0.0008 0.0277 716 ALA 99 O -0.0156 -0.0092 0.0310 717 ALA 99 CB -0.0020 -0.0100 0.0303 718 GLY 100 N 0.0073 -0.0026 0.0147 719 GLY 100 CA 0.0156 -0.0084 0.0137 720 GLY 100 C 0.0176 -0.0199 0.0080 721 GLY 100 O 0.0198 -0.0262 0.0052 722 ASP 101 N 0.0260 -0.0281 0.0110 723 ASP 101 CA 0.0268 -0.0319 -0.0064 724 ASP 101 C 0.0294 -0.0317 0.0054 725 ASP 101 O 0.0161 -0.0198 0.0152 726 ASP 101 CB 0.0085 -0.0212 -0.0243 727 ASP 101 CG 0.0091 -0.0250 -0.0426 728 ASP 101 OD1 0.0162 -0.0337 -0.0609 729 ASP 101 OD2 0.0018 -0.0181 -0.0358 730 LEU 102 N 0.0143 -0.0212 0.0038 731 LEU 102 CA 0.0042 -0.0190 0.0015 732 LEU 102 C 0.0001 -0.0140 0.0000 733 LEU 102 O -0.0082 -0.0153 -0.0014 734 LEU 102 CB 0.0021 -0.0125 0.0002 735 LEU 102 CG -0.0051 -0.0160 -0.0007 736 LEU 102 CD1 -0.0079 -0.0080 -0.0024 737 LEU 102 CD2 -0.0138 -0.0206 -0.0018 738 ASP 103 N -0.0074 -0.0237 -0.0069 739 ASP 103 CA -0.0033 -0.0105 0.0017 740 ASP 103 C 0.0062 -0.0137 -0.0032 741 ASP 103 O 0.0030 -0.0085 0.0015 742 ASP 103 CB 0.0092 0.0015 0.0072 743 ASP 103 CG -0.0012 0.0095 0.0160 744 ASP 103 OD1 -0.0125 0.0162 0.0242 745 ASP 103 OD2 0.0002 0.0089 0.0152 746 LYS 104 N 0.0051 -0.0107 -0.0043 747 LYS 104 CA 0.0037 -0.0135 -0.0035 748 LYS 104 C 0.0027 -0.0143 -0.0046 749 LYS 104 O 0.0011 -0.0161 -0.0057 750 LYS 104 CB 0.0046 -0.0144 -0.0004 751 LYS 104 CG 0.0054 -0.0142 0.0009 752 LYS 104 CD 0.0049 -0.0168 0.0032 753 LEU 105 N -0.0042 -0.0060 0.0056 754 LEU 105 CA -0.0027 -0.0048 0.0067 755 LEU 105 C -0.0017 -0.0060 0.0031 756 LEU 105 O -0.0027 -0.0063 0.0034 757 LEU 105 CB 0.0009 -0.0022 0.0084 758 LEU 105 CG 0.0022 -0.0005 0.0106 759 LEU 105 CD1 -0.0003 0.0001 0.0148 760 LEU 105 CD2 0.0065 0.0017 0.0109 761 ARG 106 N -0.0222 -0.0163 -0.0098 762 ARG 106 CA -0.0226 -0.0163 -0.0116 763 ARG 106 C -0.0090 -0.0265 -0.0105 764 ARG 106 O -0.0055 -0.0306 -0.0205 765 ARG 106 CB -0.0295 -0.0088 0.0028 766 ARG 106 CG -0.0382 -0.0029 -0.0013 767 ARG 106 CD -0.0469 0.0058 0.0121 768 ARG 106 NE -0.0403 0.0033 0.0286 769 ARG 106 CZ -0.0418 0.0059 0.0383 770 ARG 106 NH1 -0.0488 0.0103 0.0321 771 ARG 106 NH2 -0.0364 0.0042 0.0538 772 ALA 107 N -0.0141 -0.0275 -0.0225 773 ALA 107 CA -0.0204 -0.0394 -0.0247 774 ALA 107 C -0.0215 -0.0315 -0.0205 775 ALA 107 O -0.0172 -0.0371 -0.0253 776 ALA 107 CB -0.0370 -0.0487 -0.0205 777 ALA 108 N -0.0089 -0.0057 -0.0117 778 ALA 108 CA -0.0109 -0.0025 -0.0076 779 ALA 108 C -0.0045 0.0005 -0.0088 780 ALA 108 O -0.0051 0.0003 -0.0086 781 ALA 108 CB -0.0138 0.0026 -0.0012 782 PHE 109 N -0.0071 -0.0023 -0.0038 783 PHE 109 CA -0.0042 -0.0014 -0.0029 784 PHE 109 C -0.0022 -0.0025 -0.0027 785 PHE 109 O -0.0003 -0.0008 -0.0019 786 PHE 109 CB -0.0031 -0.0026 -0.0029 787 PHE 109 CG -0.0001 -0.0016 -0.0020 788 PHE 109 CD1 0.0003 0.0011 -0.0014 789 PHE 109 CD2 0.0024 -0.0034 -0.0017 790 PHE 109 CE1 0.0030 0.0020 -0.0005 791 PHE 109 CE2 0.0052 -0.0025 -0.0009 792 PHE 109 CZ 0.0055 0.0002 -0.0003 793 GLY 110 N -0.0053 -0.0287 -0.0237 794 GLY 110 CA 0.0077 -0.0440 -0.0297 795 GLY 110 C -0.0022 -0.0367 -0.0267 796 GLY 110 O 0.0130 -0.0343 -0.0261 797 ASP 111 N -0.0035 -0.0249 -0.0269 798 ASP 111 CA -0.0154 -0.0162 -0.0242 799 ASP 111 C -0.0095 -0.0000 -0.0121 800 ASP 111 O -0.0091 0.0045 -0.0090 801 ASP 111 CB -0.0352 -0.0141 -0.0278 802 ASP 111 CG -0.0449 -0.0284 -0.0396 803 ASP 111 OD1 -0.0368 -0.0404 -0.0454 804 ASP 111 OD2 -0.0593 -0.0289 -0.0436 805 VAL 112 N -0.0049 0.0037 -0.0076 806 VAL 112 CA -0.0019 0.0103 -0.0049 807 VAL 112 C 0.0054 0.0095 -0.0013 808 VAL 112 O 0.0079 0.0143 0.0009 809 VAL 112 CB -0.0030 0.0127 -0.0049 810 VAL 112 CG1 0.0017 0.0188 -0.0014 811 VAL 112 CG2 -0.0103 0.0154 -0.0082 812 GLY 113 N 0.0270 0.0144 -0.0033 813 GLY 113 CA 0.0504 0.0094 0.0048 814 GLY 113 C 0.0439 0.0104 0.0022 815 GLY 113 O 0.0561 0.0197 0.0154 816 ALA 114 N 0.0390 0.0082 0.0060 817 ALA 114 CA 0.0279 0.0115 0.0026 818 ALA 114 C 0.0108 0.0401 0.0209 819 ALA 114 O 0.0108 0.0483 0.0293 820 ALA 114 CB 0.0077 -0.0042 -0.0258 821 SER 115 N 0.0071 0.0044 -0.0071 822 SER 115 CA 0.0007 0.0088 -0.0003 823 SER 115 C 0.0046 0.0106 0.0080 824 SER 115 O -0.0003 0.0137 0.0123 825 SER 115 CB -0.0000 0.0103 0.0032 826 SER 115 OG -0.0088 0.0119 0.0004 827 CYS 116 N 0.0229 0.0168 0.0172 828 CYS 116 CA 0.0256 0.0179 0.0238 829 CYS 116 C 0.0233 0.0174 0.0204 830 CYS 116 O 0.0195 0.0188 0.0247 831 CYS 116 CB 0.0357 0.0171 0.0249 832 CYS 116 SG 0.0409 0.0169 0.0270 833 LYS 117 N 0.0287 0.0349 0.0291 834 LYS 117 CA 0.0088 0.0375 0.0022 835 LYS 117 C -0.0177 0.0218 -0.0013 836 LYS 117 O -0.0389 0.0146 -0.0130 837 LYS 117 CB 0.0191 0.0592 -0.0229 838 LYS 117 CG 0.0038 0.0631 -0.0468 839 LYS 117 CD -0.0016 0.0767 -0.0758 840 ALA 118 N -0.0018 0.0242 0.0084 841 ALA 118 CA -0.0084 0.0124 0.0080 842 ALA 118 C -0.0177 -0.0072 0.0087 843 ALA 118 O -0.0305 -0.0156 0.0013 844 ALA 118 CB 0.0048 0.0107 0.0204 845 CYS 119 N -0.0094 -0.0041 0.0080 846 CYS 119 CA -0.0115 -0.0107 0.0064 847 CYS 119 C -0.0171 -0.0106 0.0009 848 CYS 119 O -0.0201 -0.0150 -0.0017 849 CYS 119 CB -0.0087 -0.0134 0.0092 850 CYS 119 SG -0.0111 -0.0221 0.0076 851 HIS 120 N -0.0320 -0.0185 -0.0092 852 HIS 120 CA -0.0347 -0.0177 -0.0136 853 HIS 120 C -0.0359 -0.0187 -0.0158 854 HIS 120 O -0.0378 -0.0204 -0.0194 855 HIS 120 CB -0.0358 -0.0126 -0.0142 856 HIS 120 CG -0.0352 -0.0117 -0.0129 857 HIS 120 ND1 -0.0353 -0.0072 -0.0122 858 HIS 120 CD2 -0.0343 -0.0148 -0.0122 859 HIS 120 CE1 -0.0346 -0.0076 -0.0110 860 HIS 120 NE2 -0.0339 -0.0122 -0.0110 861 ASP 121 N -0.0269 -0.0007 -0.0395 862 ASP 121 CA -0.0315 -0.0112 -0.0558 863 ASP 121 C -0.0335 -0.0444 -0.0641 864 ASP 121 O -0.0404 -0.0531 -0.0886 865 ASP 121 CB -0.0270 -0.0052 -0.0399 866 ASP 121 CG -0.0274 0.0273 -0.0401 867 ASP 121 OD1 -0.0325 0.0456 -0.0574 868 ASP 121 OD2 -0.0212 0.0334 -0.0183 869 ALA 122 N -0.0263 -0.0325 -0.0141 870 ALA 122 CA -0.0241 -0.0265 -0.0143 871 ALA 122 C -0.0219 -0.0209 -0.0146 872 ALA 122 O -0.0179 -0.0170 -0.0127 873 ALA 122 CB -0.0284 -0.0241 -0.0185 874 TYR 123 N -0.0165 -0.0038 0.0107 875 TYR 123 CA -0.0155 -0.0024 0.0053 876 TYR 123 C -0.0192 -0.0034 0.0034 877 TYR 123 O -0.0186 -0.0022 -0.0017 878 TYR 123 CB -0.0158 -0.0016 0.0001 879 TYR 123 CG -0.0111 -0.0001 0.0008 880 TYR 123 CD1 -0.0053 0.0019 0.0008 881 TYR 123 CD2 -0.0124 -0.0007 0.0014 882 TYR 123 CE1 -0.0007 0.0034 0.0014 883 TYR 123 CE2 -0.0079 0.0008 0.0019 884 TYR 123 CZ -0.0021 0.0028 0.0017 885 TYR 123 OH 0.0024 0.0043 0.0023 886 ARG 124 N -0.0214 -0.0055 0.0042 887 ARG 124 CA -0.0105 0.0018 0.0056 888 ARG 124 C 0.0014 -0.0032 0.0013 889 ARG 124 O 0.0029 -0.0141 -0.0037 890 ARG 124 CB -0.0099 0.0017 0.0055 891 ARG 124 CG 0.0035 0.0059 0.0050 892 ARG 124 CD 0.0032 0.0126 0.0080 893 ARG 124 NE 0.0018 0.0048 0.0048 894 ARG 124 CZ 0.0077 0.0074 0.0049 895 ARG 124 NH1 0.0158 0.0171 0.0078 896 ARG 124 NH2 0.0058 0.0000 0.0020 897 LYS 125 N 0.0230 -0.0024 0.0172 898 LYS 125 CA 0.0348 -0.0059 0.0219 899 LYS 125 C 0.0337 -0.0150 0.0253 900 LYS 125 O 0.0290 -0.0132 0.0232 901 LYS 125 CB 0.0434 0.0039 0.0204 902 LYS 125 CG 0.0460 0.0136 0.0172 903 LYS 125 CD 0.0549 0.0223 0.0162 904 LYS 125 CE 0.0551 0.0335 0.0117 905 LYS 125 NZ 0.0666 0.0395 0.0125