1 GLY 1 N -0.0001 0.0148 -0.0170 2 GLY 1 CA 0.0085 0.0197 -0.0068 3 GLY 1 C 0.0094 0.0117 0.0054 4 GLY 1 O 0.0048 0.0040 0.0068 5 ARG 2 N 0.0073 0.0055 0.0096 6 ARG 2 CA 0.0082 0.0044 0.0112 7 ARG 2 C 0.0089 0.0060 0.0127 8 ARG 2 O 0.0087 0.0075 0.0125 9 ARG 2 CB 0.0080 0.0031 0.0108 10 ARG 2 CG 0.0089 0.0016 0.0122 11 ARG 2 CD 0.0088 0.0003 0.0119 12 ARG 2 NE 0.0080 -0.0012 0.0103 13 ARG 2 CZ 0.0080 -0.0030 0.0101 14 ARG 2 NH1 0.0086 -0.0036 0.0112 15 ARG 2 NH2 0.0073 -0.0043 0.0087 16 ILE 3 N 0.0107 0.0109 0.0349 17 ILE 3 CA -0.0005 -0.0083 0.0099 18 ILE 3 C -0.0056 -0.0087 -0.0063 19 ILE 3 O -0.0022 0.0149 -0.0090 20 ILE 3 CB -0.0049 0.0020 -0.0105 21 ILE 3 CG1 -0.0010 -0.0039 0.0057 22 ILE 3 CG2 -0.0170 -0.0141 -0.0399 23 ILE 3 CD1 -0.0037 0.0097 -0.0108 24 ALA 4 N 0.0012 -0.0336 -0.0127 25 ALA 4 CA 0.0017 -0.0323 -0.0107 26 ALA 4 C -0.0075 -0.0196 -0.0135 27 ALA 4 O -0.0158 -0.0172 -0.0247 28 ALA 4 CB 0.0042 -0.0453 -0.0191 29 SER 5 N -0.0048 -0.0118 -0.0025 30 SER 5 CA -0.0162 0.0043 0.0015 31 SER 5 C -0.0181 0.0114 0.0060 32 SER 5 O -0.0293 0.0237 0.0069 33 SER 5 CB -0.0114 0.0142 0.0144 34 SER 5 OG 0.0035 0.0132 0.0266 35 ILE 6 N -0.0019 -0.0021 0.0103 36 ILE 6 CA -0.0008 -0.0006 0.0137 37 ILE 6 C -0.0001 -0.0022 0.0115 38 ILE 6 O 0.0025 -0.0048 0.0088 39 ILE 6 CB 0.0036 -0.0005 0.0170 40 ILE 6 CG1 0.0026 0.0013 0.0195 41 ILE 6 CG2 0.0051 0.0007 0.0202 42 ILE 6 CD1 0.0069 0.0008 0.0217 43 PRO 7 N 0.0032 -0.0018 0.0098 44 PRO 7 CA 0.0028 -0.0072 0.0036 45 PRO 7 C 0.0088 -0.0150 0.0061 46 PRO 7 O 0.0122 -0.0143 0.0126 47 PRO 7 CB -0.0013 -0.0013 0.0027 48 PRO 7 CG -0.0054 0.0073 0.0043 49 PRO 7 CD -0.0013 0.0071 0.0111 50 GLY 8 N 0.0165 -0.0325 0.0054 51 GLY 8 CA 0.0213 -0.0351 0.0056 52 GLY 8 C 0.0221 -0.0355 0.0049 53 GLY 8 O 0.0259 -0.0376 0.0037 54 GLU 9 N 0.0240 -0.0359 0.0004 55 GLU 9 CA 0.0215 -0.0344 0.0016 56 GLU 9 C 0.0233 -0.0323 -0.0032 57 GLU 9 O 0.0247 -0.0338 -0.0030 58 GLU 9 CB 0.0160 -0.0307 0.0037 59 GLU 9 CG 0.0125 -0.0289 0.0057 60 GLU 9 CD 0.0071 -0.0253 0.0079 61 GLU 9 OE1 0.0061 -0.0242 0.0077 62 GLU 9 OE2 0.0039 -0.0236 0.0096 63 ALA 10 N 0.0206 -0.0460 -0.0013 64 ALA 10 CA 0.0221 -0.0428 -0.0025 65 ALA 10 C 0.0263 -0.0365 0.0011 66 ALA 10 O 0.0283 -0.0317 -0.0020 67 ALA 10 CB 0.0201 -0.0474 0.0001 68 GLU 11 N 0.0332 -0.0344 0.0151 69 GLU 11 CA 0.0341 -0.0303 0.0183 70 GLU 11 C 0.0345 -0.0256 0.0156 71 GLU 11 O 0.0352 -0.0216 0.0166 72 GLU 11 CB 0.0343 -0.0316 0.0221 73 GLU 11 CG 0.0352 -0.0280 0.0263 74 GLU 11 CD 0.0354 -0.0291 0.0293 75 GLU 11 OE1 0.0347 -0.0329 0.0283 76 GLU 11 OE2 0.0361 -0.0261 0.0325 77 TYR 12 N 0.0295 -0.0226 0.0082 78 TYR 12 CA 0.0267 -0.0187 0.0050 79 TYR 12 C 0.0276 -0.0192 0.0034 80 TYR 12 O 0.0261 -0.0166 -0.0003 81 TYR 12 CB 0.0268 -0.0173 -0.0003 82 TYR 12 CG 0.0250 -0.0158 0.0013 83 TYR 12 CD1 0.0209 -0.0117 0.0027 84 TYR 12 CD2 0.0273 -0.0184 0.0015 85 TYR 12 CE1 0.0192 -0.0104 0.0045 86 TYR 12 CE2 0.0256 -0.0171 0.0034 87 TYR 12 CZ 0.0216 -0.0131 0.0050 88 TYR 12 OH 0.0200 -0.0120 0.0073 89 LEU 13 N 0.0236 -0.0239 0.0052 90 LEU 13 CA 0.0215 -0.0216 -0.0012 91 LEU 13 C 0.0238 -0.0144 -0.0028 92 LEU 13 O 0.0267 -0.0112 0.0004 93 LEU 13 CB 0.0197 -0.0243 -0.0027 94 LEU 13 CG 0.0168 -0.0233 -0.0097 95 LEU 13 CD1 0.0136 -0.0267 -0.0134 96 LEU 13 CD2 0.0155 -0.0255 -0.0105 97 GLY 14 N 0.0197 -0.0098 -0.0082 98 GLY 14 CA 0.0170 0.0008 -0.0085 99 GLY 14 C 0.0182 0.0025 -0.0065 100 GLY 14 O 0.0165 0.0111 -0.0061 101 ARG 15 N 0.0148 0.0008 0.0058 102 ARG 15 CA 0.0127 0.0019 0.0041 103 ARG 15 C 0.0132 -0.0018 -0.0029 104 ARG 15 O 0.0142 -0.0035 -0.0043 105 ARG 15 CB 0.0159 0.0014 0.0091 106 ARG 15 CG 0.0152 0.0054 0.0162 107 ARG 15 CD 0.0171 0.0056 0.0203 108 ARG 15 NE 0.0231 0.0006 0.0216 109 ARG 15 CZ 0.0258 -0.0016 0.0224 110 ARG 15 NH1 0.0233 0.0006 0.0220 111 ARG 15 NH2 0.0312 -0.0060 0.0237 112 GLY 16 N 0.0111 -0.0027 -0.0041 113 GLY 16 CA 0.0091 -0.0062 -0.0040 114 GLY 16 C 0.0063 -0.0080 -0.0053 115 GLY 16 O 0.0036 -0.0097 -0.0065 116 VAL 17 N 0.0066 -0.0163 -0.0036 117 VAL 17 CA 0.0065 -0.0192 -0.0049 118 VAL 17 C 0.0044 -0.0162 -0.0062 119 VAL 17 O 0.0047 -0.0124 -0.0042 120 VAL 17 CB 0.0099 -0.0216 -0.0019 121 VAL 17 CG1 0.0096 -0.0245 -0.0033 122 VAL 17 CG2 0.0119 -0.0249 -0.0009 123 SER 18 N -0.0036 -0.0184 -0.0022 124 SER 18 CA -0.0058 -0.0163 -0.0032 125 SER 18 C -0.0064 -0.0184 -0.0047 126 SER 18 O -0.0058 -0.0217 -0.0056 127 SER 18 CB -0.0087 -0.0145 -0.0049 128 SER 18 OG -0.0109 -0.0123 -0.0057 129 TYR 19 N -0.0044 -0.0282 -0.0049 130 TYR 19 CA -0.0071 -0.0287 -0.0057 131 TYR 19 C -0.0065 -0.0283 -0.0072 132 TYR 19 O -0.0084 -0.0285 -0.0087 133 TYR 19 CB -0.0093 -0.0288 -0.0078 134 TYR 19 CG -0.0099 -0.0291 -0.0066 135 TYR 19 CD1 -0.0118 -0.0300 -0.0042 136 TYR 19 CD2 -0.0086 -0.0286 -0.0079 137 TYR 19 CE1 -0.0124 -0.0302 -0.0031 138 TYR 19 CE2 -0.0092 -0.0289 -0.0069 139 TYR 19 CZ -0.0110 -0.0297 -0.0044 140 TYR 19 OH -0.0116 -0.0300 -0.0034 141 CYS 20 N -0.0123 -0.0278 -0.0005 142 CYS 20 CA -0.0073 -0.0269 -0.0061 143 CYS 20 C -0.0097 -0.0151 -0.0116 144 CYS 20 O -0.0166 -0.0096 -0.0083 145 CYS 20 CB -0.0095 -0.0329 0.0001 146 CYS 20 SG -0.0016 -0.0344 -0.0069 147 ALA 21 N -0.0174 -0.0141 -0.0063 148 ALA 21 CA -0.0171 -0.0070 -0.0096 149 ALA 21 C -0.0163 -0.0017 -0.0144 150 ALA 21 O -0.0169 0.0057 -0.0144 151 ALA 21 CB -0.0157 -0.0092 -0.0147 152 THR 22 N -0.0137 0.0031 -0.0331 153 THR 22 CA -0.0117 0.0146 -0.0445 154 THR 22 C -0.0256 0.0250 -0.0235 155 THR 22 O -0.0283 0.0444 -0.0306 156 THR 22 CB 0.0028 -0.0065 -0.0599 157 THR 22 OG1 0.0035 -0.0340 -0.0435 158 THR 22 CG2 0.0172 -0.0119 -0.0854 159 CYS 23 N -0.0442 0.0212 -0.0256 160 CYS 23 CA -0.0397 0.0435 -0.0076 161 CYS 23 C -0.0360 0.0406 -0.0061 162 CYS 23 O -0.0474 0.0579 -0.0052 163 CYS 23 CB -0.0184 0.0467 0.0133 164 CYS 23 SG -0.0182 0.0801 0.0346 165 ASP 24 N -0.0279 0.0171 -0.0173 166 ASP 24 CA -0.0258 0.0181 -0.0134 167 ASP 24 C -0.0271 0.0170 -0.0158 168 ASP 24 O -0.0256 0.0181 -0.0132 169 ASP 24 CB -0.0227 0.0137 -0.0085 170 ASP 24 CG -0.0209 0.0149 -0.0054 171 ASP 24 OD1 -0.0219 0.0193 -0.0066 172 ASP 24 OD2 -0.0185 0.0112 -0.0016 173 GLY 25 N -0.0234 0.0149 -0.0112 174 GLY 25 CA -0.0224 0.0149 -0.0061 175 GLY 25 C -0.0175 0.0137 -0.0046 176 GLY 25 O -0.0164 0.0135 -0.0010 177 ALA 26 N -0.0182 0.0124 -0.0060 178 ALA 26 CA -0.0136 0.0105 -0.0049 179 ALA 26 C -0.0116 0.0096 -0.0051 180 ALA 26 O -0.0084 0.0084 -0.0026 181 ALA 26 CB -0.0114 0.0093 -0.0083 182 PHE 27 N -0.0179 0.0109 0.0003 183 PHE 27 CA -0.0182 0.0072 -0.0083 184 PHE 27 C -0.0211 0.0137 -0.0039 185 PHE 27 O -0.0200 0.0101 -0.0081 186 PHE 27 CB -0.0237 0.0086 -0.0226 187 PHE 27 CG -0.0210 0.0023 -0.0271 188 PHE 27 CD1 -0.0242 0.0081 -0.0251 189 PHE 27 CD2 -0.0156 -0.0091 -0.0337 190 PHE 27 CE1 -0.0219 0.0027 -0.0292 191 PHE 27 CE2 -0.0133 -0.0146 -0.0380 192 PHE 27 CZ -0.0165 -0.0087 -0.0356 193 TYR 28 N -0.0120 0.0098 -0.0029 194 TYR 28 CA -0.0131 0.0086 0.0015 195 TYR 28 C -0.0119 0.0081 0.0040 196 TYR 28 O -0.0136 0.0071 0.0073 197 TYR 28 CB -0.0179 0.0077 0.0019 198 TYR 28 CG -0.0188 0.0080 -0.0000 199 TYR 28 CD1 -0.0177 0.0077 0.0021 200 TYR 28 CD2 -0.0206 0.0087 -0.0041 201 TYR 28 CE1 -0.0182 0.0081 0.0001 202 TYR 28 CE2 -0.0211 0.0091 -0.0061 203 TYR 28 CZ -0.0199 0.0088 -0.0040 204 TYR 28 OH -0.0203 0.0093 -0.0061 205 ARG 29 N -0.0118 0.0136 0.0096 206 ARG 29 CA -0.0058 0.0139 0.0161 207 ARG 29 C -0.0069 0.0167 0.0177 208 ARG 29 O -0.0081 0.0135 0.0134 209 ARG 29 CB 0.0010 0.0066 0.0162 210 ARG 29 CG 0.0075 0.0073 0.0237 211 ARG 29 CD 0.0145 0.0001 0.0240 212 ARG 29 NE 0.0150 -0.0039 0.0206 213 ARG 29 CZ 0.0168 -0.0025 0.0238 214 ARG 29 NH1 0.0186 0.0025 0.0306 215 ARG 29 NH2 0.0168 -0.0063 0.0201 216 ASN 30 N -0.0043 0.0158 0.0178 217 ASN 30 CA -0.0049 0.0186 0.0216 218 ASN 30 C -0.0095 0.0189 0.0219 219 ASN 30 O -0.0097 0.0203 0.0238 220 ASN 30 CB -0.0003 0.0196 0.0228 221 ASN 30 CG 0.0037 0.0203 0.0238 222 ASN 30 OD1 0.0073 0.0187 0.0217 223 ASN 30 ND2 0.0032 0.0228 0.0271 224 ARG 31 N -0.0098 0.0109 0.0084 225 ARG 31 CA -0.0119 0.0093 0.0114 226 ARG 31 C -0.0117 0.0067 0.0108 227 ARG 31 O -0.0100 0.0054 0.0081 228 ARG 31 CB -0.0131 0.0069 0.0129 229 ARG 31 CG -0.0135 0.0094 0.0138 230 ARG 31 CD -0.0149 0.0072 0.0158 231 ARG 31 NE -0.0150 0.0097 0.0160 232 ARG 31 CZ -0.0162 0.0127 0.0182 233 ARG 31 NH1 -0.0175 0.0137 0.0203 234 ARG 31 NH2 -0.0159 0.0149 0.0181 235 GLU 32 N -0.0040 -0.0040 0.0061 236 GLU 32 CA -0.0047 -0.0035 0.0065 237 GLU 32 C -0.0048 -0.0016 0.0058 238 GLU 32 O -0.0036 -0.0009 0.0048 239 GLU 32 CB -0.0038 -0.0047 0.0063 240 GLU 32 CG -0.0037 -0.0068 0.0070 241 GLU 32 CD -0.0050 -0.0075 0.0081 242 GLU 32 OE1 -0.0059 -0.0083 0.0089 243 GLU 32 OE2 -0.0051 -0.0073 0.0081 244 VAL 33 N -0.0055 -0.0002 0.0010 245 VAL 33 CA -0.0046 0.0008 0.0018 246 VAL 33 C -0.0036 0.0004 0.0014 247 VAL 33 O -0.0040 -0.0006 0.0007 248 VAL 33 CB -0.0056 0.0019 0.0028 249 VAL 33 CG1 -0.0066 0.0024 0.0032 250 VAL 33 CG2 -0.0067 0.0015 0.0025 251 VAL 34 N -0.0043 0.0007 -0.0038 252 VAL 34 CA -0.0058 0.0035 -0.0034 253 VAL 34 C -0.0053 0.0026 -0.0035 254 VAL 34 O -0.0055 0.0001 -0.0052 255 VAL 34 CB -0.0090 0.0047 -0.0053 256 VAL 34 CG1 -0.0105 0.0075 -0.0049 257 VAL 34 CG2 -0.0095 0.0057 -0.0052 258 VAL 35 N -0.0024 0.0084 -0.0045 259 VAL 35 CA -0.0010 0.0072 -0.0039 260 VAL 35 C -0.0025 0.0101 -0.0044 261 VAL 35 O -0.0024 0.0137 -0.0041 262 VAL 35 CB 0.0030 0.0071 -0.0019 263 VAL 35 CG1 0.0044 0.0062 -0.0012 264 VAL 35 CG2 0.0045 0.0039 -0.0014 265 VAL 36 N -0.0027 0.0118 -0.0069 266 VAL 36 CA -0.0048 0.0133 -0.0071 267 VAL 36 C -0.0048 0.0134 -0.0071 268 VAL 36 O -0.0045 0.0118 -0.0082 269 VAL 36 CB -0.0067 0.0129 -0.0089 270 VAL 36 CG1 -0.0088 0.0149 -0.0087 271 VAL 36 CG2 -0.0065 0.0121 -0.0094 272 GLY 37 N -0.0007 0.0217 -0.0083 273 GLY 37 CA 0.0016 0.0207 -0.0076 274 GLY 37 C 0.0071 0.0233 -0.0051 275 GLY 37 O 0.0102 0.0239 -0.0038 276 LEU 38 N 0.0127 0.0242 -0.0033 277 LEU 38 CA 0.0095 0.0232 -0.0027 278 LEU 38 C 0.0084 0.0268 -0.0009 279 LEU 38 O 0.0103 0.0284 -0.0007 280 LEU 38 CB 0.0107 0.0205 -0.0042 281 LEU 38 CG 0.0076 0.0193 -0.0039 282 LEU 38 CD1 0.0037 0.0175 -0.0035 283 LEU 38 CD2 0.0093 0.0166 -0.0055 284 ASN 39 N 0.0303 0.0325 0.0045 285 ASN 39 CA 0.0331 0.0293 0.0058 286 ASN 39 C 0.0373 0.0257 0.0079 287 ASN 39 O 0.0372 0.0255 0.0078 288 ASN 39 CB 0.0296 0.0254 0.0032 289 ASN 39 CG 0.0262 0.0219 0.0007 290 ASN 39 OD1 0.0280 0.0182 0.0013 291 ASN 39 ND2 0.0211 0.0233 -0.0022 292 PRO 40 N 0.0468 0.0314 0.0112 293 PRO 40 CA 0.0465 0.0272 0.0149 294 PRO 40 C 0.0462 0.0223 0.0127 295 PRO 40 O 0.0459 0.0181 0.0141 296 PRO 40 CB 0.0466 0.0297 0.0191 297 PRO 40 CG 0.0470 0.0354 0.0190 298 PRO 40 CD 0.0472 0.0364 0.0132 299 GLU 41 N 0.0496 0.0143 0.0094 300 GLU 41 CA 0.0420 0.0048 0.0076 301 GLU 41 C 0.0348 0.0098 0.0027 302 GLU 41 O 0.0341 0.0053 0.0033 303 GLU 41 CB 0.0345 -0.0013 0.0050 304 GLU 41 CG 0.0273 -0.0132 0.0040 305 GLU 41 CD 0.0194 -0.0181 0.0010 306 GLU 41 OE1 0.0184 -0.0116 -0.0010 307 GLU 41 OE2 0.0143 -0.0285 0.0007 308 ALA 42 N 0.0253 0.0104 0.0000 309 ALA 42 CA 0.0232 0.0120 -0.0020 310 ALA 42 C 0.0253 0.0130 -0.0007 311 ALA 42 O 0.0239 0.0119 -0.0014 312 ALA 42 CB 0.0218 0.0162 -0.0041 313 VAL 43 N 0.0362 0.0144 0.0023 314 VAL 43 CA 0.0353 0.0136 0.0025 315 VAL 43 C 0.0340 0.0129 0.0036 316 VAL 43 O 0.0331 0.0117 0.0032 317 VAL 43 CB 0.0357 0.0142 0.0032 318 VAL 43 CG1 0.0346 0.0134 0.0037 319 VAL 43 CG2 0.0368 0.0148 0.0020 320 GLU 44 N 0.0372 0.0179 0.0076 321 GLU 44 CA 0.0362 0.0124 0.0115 322 GLU 44 C 0.0299 0.0083 0.0096 323 GLU 44 O 0.0278 0.0056 0.0101 324 GLU 44 CB 0.0399 0.0100 0.0168 325 GLU 44 CG 0.0463 0.0138 0.0191 326 GLU 44 CD 0.0504 0.0124 0.0239 327 GLU 44 OE1 0.0498 0.0073 0.0277 328 GLU 44 OE2 0.0543 0.0165 0.0238 329 GLU 45 N 0.0138 0.0008 0.0021 330 GLU 45 CA 0.0088 -0.0007 0.0011 331 GLU 45 C 0.0079 0.0074 0.0033 332 GLU 45 O 0.0087 0.0068 0.0032 333 GLU 45 CB -0.0007 -0.0044 -0.0010 334 GLU 45 CG -0.0001 -0.0140 -0.0037 335 GLU 45 CD 0.0026 -0.0209 -0.0054 336 GLU 45 OE1 -0.0039 -0.0251 -0.0073 337 GLU 45 OE2 0.0108 -0.0218 -0.0048 338 ALA 46 N 0.0179 0.0092 0.0049 339 ALA 46 CA 0.0184 0.0084 0.0059 340 ALA 46 C 0.0185 0.0082 0.0062 341 ALA 46 O 0.0195 0.0078 0.0066 342 ALA 46 CB 0.0177 0.0079 0.0067 343 GLN 47 N 0.0273 0.0125 0.0112 344 GLN 47 CA 0.0205 0.0140 0.0084 345 GLN 47 C 0.0163 0.0193 0.0121 346 GLN 47 O 0.0104 0.0209 0.0100 347 GLN 47 CB 0.0194 0.0133 0.0067 348 GLN 47 CG 0.0229 0.0080 0.0025 349 GLN 47 CD 0.0194 0.0073 -0.0007 350 GLN 47 OE1 0.0145 0.0068 -0.0047 351 GLN 47 NE2 0.0219 0.0073 0.0010 352 VAL 48 N 0.0053 0.0177 0.0109 353 VAL 48 CA 0.0051 0.0180 0.0111 354 VAL 48 C 0.0042 0.0198 0.0121 355 VAL 48 O 0.0047 0.0211 0.0119 356 VAL 48 CB 0.0044 0.0161 0.0114 357 VAL 48 CG1 0.0041 0.0165 0.0117 358 VAL 48 CG2 0.0056 0.0145 0.0102 359 LEU 49 N 0.0016 0.0088 0.0094 360 LEU 49 CA -0.0007 0.0095 0.0082 361 LEU 49 C 0.0013 0.0120 0.0103 362 LEU 49 O 0.0007 0.0112 0.0097 363 LEU 49 CB -0.0052 0.0120 0.0061 364 LEU 49 CG -0.0078 0.0091 0.0034 365 LEU 49 CD1 -0.0118 0.0122 0.0017 366 LEU 49 CD2 -0.0087 0.0048 0.0013 367 THR 50 N 0.0103 0.0077 0.0163 368 THR 50 CA 0.0078 0.0054 0.0134 369 THR 50 C 0.0034 0.0064 0.0137 370 THR 50 O 0.0010 0.0048 0.0115 371 THR 50 CB 0.0075 0.0035 0.0114 372 THR 50 OG1 0.0061 0.0052 0.0129 373 THR 50 CG2 0.0117 0.0019 0.0105 374 LYS 51 N 0.0000 0.0101 0.0186 375 LYS 51 CA -0.0049 0.0135 0.0186 376 LYS 51 C -0.0015 0.0154 0.0200 377 LYS 51 O -0.0049 0.0179 0.0201 378 LYS 51 CB -0.0079 0.0199 0.0200 379 LYS 51 CG -0.0115 0.0185 0.0187 380 LYS 51 CD -0.0132 0.0248 0.0205 381 LYS 51 CE -0.0173 0.0235 0.0190 382 LYS 51 NZ -0.0131 0.0240 0.0202 383 PHE 52 N -0.0085 0.0180 0.0210 384 PHE 52 CA -0.0070 0.0169 0.0194 385 PHE 52 C -0.0071 0.0169 0.0200 386 PHE 52 O -0.0055 0.0156 0.0204 387 PHE 52 CB -0.0075 0.0173 0.0164 388 PHE 52 CG -0.0075 0.0173 0.0156 389 PHE 52 CD1 -0.0056 0.0159 0.0156 390 PHE 52 CD2 -0.0094 0.0188 0.0148 391 PHE 52 CE1 -0.0057 0.0159 0.0148 392 PHE 52 CE2 -0.0094 0.0188 0.0140 393 PHE 52 CZ -0.0075 0.0174 0.0140 394 ALA 53 N -0.0062 0.0094 0.0161 395 ALA 53 CA -0.0042 0.0075 0.0164 396 ALA 53 C -0.0046 0.0043 0.0178 397 ALA 53 O -0.0070 0.0034 0.0187 398 ALA 53 CB -0.0046 0.0083 0.0162 399 SER 54 N -0.0040 -0.0013 0.0204 400 SER 54 CA -0.0043 -0.0038 0.0188 401 SER 54 C -0.0034 -0.0083 0.0174 402 SER 54 O -0.0050 -0.0103 0.0146 403 SER 54 CB -0.0020 -0.0036 0.0212 404 SER 54 OG -0.0031 0.0003 0.0221 405 THR 55 N 0.0019 -0.0128 0.0132 406 THR 55 CA 0.0018 -0.0121 0.0133 407 THR 55 C 0.0023 -0.0091 0.0132 408 THR 55 O 0.0037 -0.0079 0.0123 409 THR 55 CB 0.0035 -0.0134 0.0121 410 THR 55 OG1 0.0033 -0.0163 0.0121 411 THR 55 CG2 0.0033 -0.0126 0.0122 412 VAL 56 N 0.0100 -0.0077 0.0097 413 VAL 56 CA 0.0097 -0.0051 0.0089 414 VAL 56 C 0.0095 -0.0033 0.0084 415 VAL 56 O 0.0089 -0.0025 0.0102 416 VAL 56 CB 0.0090 -0.0040 0.0110 417 VAL 56 CG1 0.0086 -0.0012 0.0102 418 VAL 56 CG2 0.0092 -0.0059 0.0116 419 HIS 57 N -0.0028 -0.0035 -0.0002 420 HIS 57 CA -0.0048 -0.0001 -0.0005 421 HIS 57 C -0.0056 0.0007 -0.0009 422 HIS 57 O -0.0066 -0.0009 -0.0030 423 HIS 57 CB -0.0072 0.0001 -0.0030 424 HIS 57 CG -0.0066 -0.0006 -0.0029 425 HIS 57 ND1 -0.0063 0.0017 -0.0011 426 HIS 57 CD2 -0.0064 -0.0034 -0.0043 427 HIS 57 CE1 -0.0059 0.0004 -0.0014 428 HIS 57 NE2 -0.0059 -0.0027 -0.0033 429 TRP 58 N -0.0037 0.0138 -0.0033 430 TRP 58 CA -0.0011 0.0110 -0.0025 431 TRP 58 C -0.0026 0.0133 -0.0032 432 TRP 58 O -0.0016 0.0178 -0.0043 433 TRP 58 CB 0.0051 0.0110 -0.0022 434 TRP 58 CG 0.0080 0.0073 -0.0011 435 TRP 58 CD1 0.0061 0.0030 -0.0001 436 TRP 58 CD2 0.0136 0.0077 -0.0009 437 TRP 58 NE1 0.0100 0.0008 0.0007 438 TRP 58 CE2 0.0147 0.0035 0.0002 439 TRP 58 CE3 0.0176 0.0111 -0.0016 440 TRP 58 CZ2 0.0198 0.0028 0.0006 441 TRP 58 CZ3 0.0228 0.0105 -0.0012 442 TRP 58 CH2 0.0238 0.0063 -0.0001 443 ILE 59 N -0.0122 0.0224 -0.0018 444 ILE 59 CA -0.0150 0.0232 -0.0014 445 ILE 59 C -0.0149 0.0221 -0.0020 446 ILE 59 O -0.0149 0.0196 -0.0031 447 ILE 59 CB -0.0177 0.0222 -0.0020 448 ILE 59 CG1 -0.0178 0.0235 -0.0014 449 ILE 59 CG2 -0.0206 0.0229 -0.0017 450 ILE 59 CD1 -0.0203 0.0224 -0.0020 451 THR 60 N -0.0154 0.0207 -0.0010 452 THR 60 CA -0.0163 0.0197 -0.0019 453 THR 60 C -0.0201 0.0207 -0.0006 454 THR 60 O -0.0209 0.0231 0.0017 455 THR 60 CB -0.0132 0.0205 -0.0014 456 THR 60 OG1 -0.0127 0.0235 0.0012 457 THR 60 CG2 -0.0093 0.0195 -0.0027 458 PRO 61 N -0.0182 0.0267 0.0052 459 PRO 61 CA -0.0164 0.0226 0.0067 460 PRO 61 C -0.0179 0.0187 0.0042 461 PRO 61 O -0.0166 0.0150 0.0052 462 PRO 61 CB -0.0153 0.0232 0.0080 463 PRO 61 CG -0.0178 0.0261 0.0056 464 PRO 61 CD -0.0188 0.0292 0.0049 465 LYS 62 N -0.0159 0.0186 -0.0018 466 LYS 62 CA -0.0243 0.0160 0.0053 467 LYS 62 C -0.0184 0.0155 0.0073 468 LYS 62 O -0.0089 0.0176 0.0022 469 LYS 62 CB -0.0372 0.0173 -0.0005 470 LYS 62 CG -0.0375 0.0208 -0.0114 471 LYS 62 CD -0.0500 0.0223 -0.0177 472 LYS 62 CE -0.0523 0.0248 -0.0260 473 LYS 62 NZ -0.0641 0.0264 -0.0323 474 ASP 63 N -0.0184 0.0143 -0.0072 475 ASP 63 CA -0.0208 0.0137 -0.0073 476 ASP 63 C -0.0214 0.0130 -0.0026 477 ASP 63 O -0.0184 0.0135 0.0001 478 ASP 63 CB -0.0184 0.0147 -0.0105 479 ASP 63 CG -0.0198 0.0143 -0.0104 480 ASP 63 OD1 -0.0185 0.0142 -0.0070 481 ASP 63 OD2 -0.0221 0.0141 -0.0136 482 PRO 64 N -0.0064 0.0077 -0.0004 483 PRO 64 CA -0.0019 0.0021 -0.0046 484 PRO 64 C 0.0032 0.0024 -0.0038 485 PRO 64 O 0.0064 -0.0024 -0.0075 486 PRO 64 CB 0.0030 0.0008 -0.0052 487 PRO 64 CG -0.0002 0.0053 -0.0018 488 PRO 64 CD -0.0036 0.0106 0.0022 489 HIS 65 N -0.0079 -0.0067 0.0016 490 HIS 65 CA -0.0124 -0.0056 0.0055 491 HIS 65 C -0.0149 -0.0001 0.0047 492 HIS 65 O -0.0186 0.0020 0.0072 493 HIS 65 CB -0.0139 -0.0094 0.0093 494 HIS 65 CG -0.0119 -0.0149 0.0105 495 HIS 65 ND1 -0.0088 -0.0183 0.0094 496 HIS 65 CD2 -0.0125 -0.0172 0.0126 497 HIS 65 CE1 -0.0076 -0.0227 0.0109 498 HIS 65 NE2 -0.0098 -0.0223 0.0128 499 THR 66 N -0.0036 0.0061 0.0049 500 THR 66 CA -0.0056 0.0051 0.0032 501 THR 66 C -0.0026 -0.0017 0.0028 502 THR 66 O -0.0022 -0.0021 0.0029 503 THR 66 CB -0.0125 0.0054 -0.0013 504 THR 66 OG1 -0.0145 0.0007 -0.0043 505 THR 66 CG2 -0.0161 0.0126 -0.0011 506 LEU 67 N 0.0105 -0.0046 0.0064 507 LEU 67 CA 0.0075 0.0022 0.0033 508 LEU 67 C 0.0004 0.0012 0.0022 509 LEU 67 O -0.0018 0.0063 -0.0001 510 LEU 67 CB 0.0132 0.0073 0.0028 511 LEU 67 CG 0.0195 0.0113 0.0027 512 LEU 67 CD1 0.0238 0.0168 0.0017 513 LEU 67 CD2 0.0164 0.0152 0.0007 514 ASP 68 N 0.0060 -0.0127 0.0104 515 ASP 68 CA -0.0134 -0.0190 -0.0139 516 ASP 68 C -0.0567 0.0001 -0.0169 517 ASP 68 O -0.0707 0.0139 -0.0061 518 ASP 68 CB 0.0098 -0.0258 -0.0069 519 ASP 68 CG 0.0007 -0.0428 -0.0400 520 ASP 68 OD1 -0.0187 -0.0329 -0.0393 521 ASP 68 OD2 0.0132 -0.0660 -0.0666 522 GLY 69 N -0.0223 -0.0097 -0.0093 523 GLY 69 CA -0.0275 -0.0159 -0.0053 524 GLY 69 C -0.0210 -0.0102 -0.0099 525 GLY 69 O -0.0222 -0.0171 -0.0079 526 HIS 70 N 0.0080 -0.0038 -0.0076 527 HIS 70 CA 0.0068 0.0009 -0.0034 528 HIS 70 C 0.0071 -0.0088 -0.0109 529 HIS 70 O 0.0004 -0.0101 -0.0079 530 HIS 70 CB 0.0183 0.0136 -0.0006 531 HIS 70 CG 0.0155 0.0226 0.0078 532 HIS 70 ND1 0.0184 0.0215 0.0053 533 HIS 70 CD2 0.0101 0.0323 0.0181 534 HIS 70 CE1 0.0146 0.0306 0.0142 535 HIS 70 NE2 0.0096 0.0374 0.0222 536 ALA 71 N 0.0094 -0.0064 -0.0045 537 ALA 71 CA 0.0175 -0.0120 -0.0051 538 ALA 71 C 0.0150 -0.0215 -0.0023 539 ALA 71 O 0.0214 -0.0267 -0.0026 540 ALA 71 CB 0.0248 -0.0141 -0.0064 541 ASP 72 N 0.0026 -0.0281 -0.0066 542 ASP 72 CA -0.0038 -0.0442 -0.0039 543 ASP 72 C -0.0050 -0.0501 -0.0034 544 ASP 72 O -0.0012 -0.0639 -0.0048 545 ASP 72 CB -0.0195 -0.0449 0.0023 546 ASP 72 CG -0.0188 -0.0439 0.0020 547 ASP 72 OD1 -0.0065 -0.0408 -0.0028 548 ASP 72 OD2 -0.0311 -0.0461 0.0069 549 GLU 73 N -0.0430 -0.0418 -0.0070 550 GLU 73 CA -0.0122 -0.0268 -0.0128 551 GLU 73 C 0.0139 -0.0216 0.0013 552 GLU 73 O 0.0380 -0.0180 0.0172 553 GLU 73 CB -0.0119 -0.0125 -0.0488 554 GLU 73 CG 0.0180 0.0036 -0.0582 555 GLU 73 CD 0.0177 0.0176 -0.0940 556 GLU 73 OE1 -0.0059 0.0150 -0.1121 557 GLU 73 OE2 0.0415 0.0310 -0.1031 558 LEU 74 N 0.0157 -0.0144 0.0080 559 LEU 74 CA 0.0218 -0.0145 0.0085 560 LEU 74 C 0.0240 -0.0202 0.0103 561 LEU 74 O 0.0275 -0.0215 0.0110 562 LEU 74 CB 0.0243 -0.0113 0.0078 563 LEU 74 CG 0.0307 -0.0111 0.0082 564 LEU 74 CD1 0.0334 -0.0083 0.0077 565 LEU 74 CD2 0.0326 -0.0082 0.0076 566 LEU 75 N 0.0272 -0.0377 0.0068 567 LEU 75 CA 0.0278 -0.0392 0.0061 568 LEU 75 C 0.0278 -0.0446 0.0105 569 LEU 75 O 0.0288 -0.0474 0.0095 570 LEU 75 CB 0.0260 -0.0335 0.0070 571 LEU 75 CG 0.0264 -0.0284 0.0018 572 LEU 75 CD1 0.0242 -0.0224 0.0037 573 LEU 75 CD2 0.0287 -0.0304 -0.0040 574 ALA 76 N 0.0200 -0.0717 -0.0088 575 ALA 76 CA -0.0118 -0.0835 -0.0249 576 ALA 76 C -0.0247 -0.0704 -0.0180 577 ALA 76 O -0.0482 -0.0811 -0.0314 578 ALA 76 CB -0.0430 -0.0766 -0.0269 579 HIS 77 N 0.0046 -0.0352 -0.0013 580 HIS 77 CA 0.0046 -0.0264 0.0021 581 HIS 77 C 0.0093 -0.0289 0.0057 582 HIS 77 O 0.0159 -0.0341 0.0104 583 HIS 77 CB 0.0075 -0.0187 0.0080 584 HIS 77 CG 0.0051 -0.0083 0.0096 585 HIS 77 ND1 0.0087 -0.0061 0.0140 586 HIS 77 CD2 -0.0007 -0.0003 0.0069 587 HIS 77 CE1 0.0051 0.0032 0.0140 588 HIS 77 NE2 -0.0007 0.0071 0.0097 589 PRO 78 N 0.0014 -0.0396 0.0126 590 PRO 78 CA 0.0031 -0.0426 0.0102 591 PRO 78 C 0.0113 -0.0374 0.0299 592 PRO 78 O 0.0167 -0.0422 0.0298 593 PRO 78 CB -0.0161 -0.0328 -0.0010 594 PRO 78 CG -0.0264 -0.0302 -0.0111 595 PRO 78 CD -0.0173 -0.0289 0.0036 596 SER 79 N 0.0059 -0.0164 0.0202 597 SER 79 CA 0.0099 -0.0147 0.0204 598 SER 79 C 0.0119 -0.0148 0.0205 599 SER 79 O 0.0155 -0.0141 0.0207 600 SER 79 CB 0.0100 -0.0104 0.0203 601 SER 79 OG 0.0082 -0.0100 0.0202 602 VAL 80 N 0.0238 -0.0201 0.0173 603 VAL 80 CA 0.0232 -0.0194 0.0169 604 VAL 80 C 0.0227 -0.0185 0.0169 605 VAL 80 O 0.0230 -0.0179 0.0175 606 VAL 80 CB 0.0234 -0.0191 0.0173 607 VAL 80 CG1 0.0227 -0.0184 0.0170 608 VAL 80 CG2 0.0237 -0.0201 0.0172 609 LYS 81 N 0.0101 -0.0070 0.0153 610 LYS 81 CA 0.0051 0.0011 0.0147 611 LYS 81 C 0.0005 0.0048 0.0120 612 LYS 81 O -0.0028 0.0010 0.0065 613 LYS 81 CB 0.0008 0.0002 0.0097 614 LYS 81 CG 0.0048 -0.0016 0.0129 615 LYS 81 CD 0.0002 -0.0005 0.0087 616 LYS 81 CE 0.0040 -0.0014 0.0122 617 LYS 81 NZ 0.0076 -0.0106 0.0108 618 LEU 82 N -0.0003 0.0160 0.0032 619 LEU 82 CA -0.0054 0.0151 0.0017 620 LEU 82 C -0.0124 0.0183 0.0030 621 LEU 82 O -0.0131 0.0234 0.0069 622 LEU 82 CB -0.0030 0.0170 0.0036 623 LEU 82 CG -0.0083 0.0165 0.0023 624 LEU 82 CD1 -0.0096 0.0104 -0.0027 625 LEU 82 CD2 -0.0057 0.0192 0.0048 626 TRP 83 N -0.0216 0.0257 0.0047 627 TRP 83 CA -0.0244 0.0287 0.0016 628 TRP 83 C -0.0259 0.0327 0.0016 629 TRP 83 O -0.0274 0.0327 -0.0015 630 TRP 83 CB -0.0256 0.0259 -0.0032 631 TRP 83 CG -0.0240 0.0218 -0.0033 632 TRP 83 CD1 -0.0220 0.0172 -0.0030 633 TRP 83 CD2 -0.0242 0.0224 -0.0033 634 TRP 83 NE1 -0.0210 0.0148 -0.0029 635 TRP 83 CE2 -0.0223 0.0178 -0.0031 636 TRP 83 CE3 -0.0259 0.0263 -0.0035 637 TRP 83 CZ2 -0.0220 0.0172 -0.0031 638 TRP 83 CZ3 -0.0256 0.0256 -0.0035 639 TRP 83 CH2 -0.0237 0.0211 -0.0033 640 GLU 84 N -0.0419 0.0308 -0.0061 641 GLU 84 CA -0.0336 0.0254 -0.0057 642 GLU 84 C -0.0260 0.0210 -0.0030 643 GLU 84 O -0.0262 0.0204 -0.0059 644 GLU 84 CB -0.0325 0.0224 -0.0158 645 GLU 84 CG -0.0317 0.0199 -0.0249 646 GLU 84 CD -0.0279 0.0154 -0.0336 647 GLU 84 OE1 -0.0273 0.0150 -0.0335 648 GLU 84 OE2 -0.0246 0.0119 -0.0398 649 LYS 85 N -0.0426 0.0228 -0.0017 650 LYS 85 CA -0.0229 0.0118 0.0062 651 LYS 85 C -0.0341 0.0180 0.0216 652 LYS 85 O -0.0251 0.0130 0.0169 653 LYS 85 CB -0.0056 0.0022 -0.0203 654 LYS 85 CG 0.0073 -0.0049 -0.0382 655 LYS 85 CD 0.0306 -0.0179 -0.0569 656 LYS 85 CE 0.0320 -0.0185 -0.0882 657 LYS 85 NZ 0.0165 -0.0099 -0.1100 658 THR 86 N -0.0235 0.0190 0.0054 659 THR 86 CA -0.0245 0.0198 0.0073 660 THR 86 C -0.0243 0.0197 0.0106 661 THR 86 O -0.0242 0.0196 0.0113 662 THR 86 CB -0.0272 0.0216 0.0066 663 THR 86 OG1 -0.0290 0.0230 0.0074 664 THR 86 CG2 -0.0274 0.0217 0.0032 665 ARG 87 N -0.0223 0.0162 0.0003 666 ARG 87 CA -0.0195 0.0190 0.0153 667 ARG 87 C -0.0193 0.0436 0.0319 668 ARG 87 O -0.0171 0.0485 0.0452 669 ARG 87 CB -0.0123 -0.0047 0.0326 670 ARG 87 CG -0.0105 -0.0099 0.0374 671 ARG 87 CD -0.0032 -0.0193 0.0644 672 ARG 87 NE 0.0011 -0.0467 0.0663 673 ARG 87 CZ 0.0040 -0.0681 0.0651 674 ARG 87 NH1 0.0027 -0.0669 0.0599 675 ARG 87 NH2 0.0082 -0.0913 0.0692 676 LEU 88 N -0.0102 0.0230 0.0264 677 LEU 88 CA -0.0087 0.0208 0.0240 678 LEU 88 C -0.0117 0.0210 0.0209 679 LEU 88 O -0.0138 0.0211 0.0186 680 LEU 88 CB -0.0060 0.0182 0.0224 681 LEU 88 CG -0.0043 0.0156 0.0196 682 LEU 88 CD1 -0.0026 0.0153 0.0209 683 LEU 88 CD2 -0.0014 0.0133 0.0187 684 ILE 89 N -0.0042 0.0206 0.0247 685 ILE 89 CA -0.0008 0.0224 0.0213 686 ILE 89 C 0.0019 0.0232 0.0187 687 ILE 89 O 0.0037 0.0265 0.0161 688 ILE 89 CB 0.0016 0.0186 0.0206 689 ILE 89 CG1 -0.0010 0.0173 0.0232 690 ILE 89 CG2 0.0052 0.0203 0.0170 691 ILE 89 CD1 -0.0031 0.0216 0.0234 692 ARG 90 N 0.0055 0.0177 0.0076 693 ARG 90 CA 0.0051 0.0141 0.0051 694 ARG 90 C 0.0047 0.0092 0.0078 695 ARG 90 O 0.0047 0.0078 0.0102 696 ARG 90 CB 0.0049 0.0133 -0.0001 697 ARG 90 CG 0.0044 0.0103 -0.0038 698 ARG 90 CD 0.0043 0.0113 -0.0090 699 ARG 90 NE 0.0048 0.0165 -0.0103 700 ARG 90 CZ 0.0051 0.0201 -0.0110 701 ARG 90 NH1 0.0051 0.0193 -0.0111 702 ARG 90 NH2 0.0056 0.0246 -0.0117 703 ILE 91 N 0.0104 -0.0056 0.0043 704 ILE 91 CA 0.0143 -0.0085 0.0046 705 ILE 91 C 0.0150 -0.0102 0.0021 706 ILE 91 O 0.0128 -0.0102 -0.0013 707 ILE 91 CB 0.0154 -0.0102 0.0029 708 ILE 91 CG1 0.0147 -0.0084 0.0056 709 ILE 91 CG2 0.0194 -0.0134 0.0028 710 ILE 91 CD1 0.0147 -0.0094 0.0035 711 LYS 92 N 0.0130 -0.0025 -0.0097 712 LYS 92 CA 0.0097 -0.0007 -0.0083 713 LYS 92 C 0.0101 -0.0000 -0.0085 714 LYS 92 O 0.0131 0.0005 -0.0100 715 LYS 92 CB 0.0088 0.0035 -0.0081 716 LYS 92 CG 0.0080 0.0035 -0.0077 717 LYS 92 CD 0.0076 0.0078 -0.0078 718 LYS 92 CE 0.0042 0.0088 -0.0062 719 LYS 92 NZ 0.0046 0.0071 -0.0063 720 GLY 93 N 0.0203 0.0019 -0.0162 721 GLY 93 CA 0.0181 0.0022 -0.0155 722 GLY 93 C 0.0139 0.0025 -0.0140 723 GLY 93 O 0.0123 0.0032 -0.0139 724 GLU 94 N 0.0109 0.0015 -0.0139 725 GLU 94 CA -0.0007 0.0078 -0.0019 726 GLU 94 C -0.0021 0.0034 0.0084 727 GLU 94 O 0.0061 -0.0047 0.0062 728 GLU 94 CB -0.0105 0.0229 -0.0086 729 GLU 94 CG -0.0097 0.0287 -0.0200 730 GLU 94 CD -0.0192 0.0435 -0.0266 731 GLU 94 OE1 -0.0247 0.0503 -0.0274 732 GLU 94 OE2 -0.0210 0.0480 -0.0309 733 GLU 95 N 0.0117 -0.0267 -0.0366 734 GLU 95 CA 0.0061 -0.0175 -0.0157 735 GLU 95 C -0.0142 -0.0202 0.0087 736 GLU 95 O -0.0139 -0.0047 0.0302 737 GLU 95 CB 0.0009 -0.0289 -0.0247 738 GLU 95 CG -0.0028 -0.0187 -0.0051 739 GLU 95 CD 0.0196 0.0018 -0.0070 740 GLU 95 OE1 0.0319 -0.0010 -0.0280 741 GLU 95 OE2 0.0246 0.0202 0.0122 742 ALA 96 N -0.0045 -0.0092 -0.0033 743 ALA 96 CA -0.0037 -0.0100 -0.0016 744 ALA 96 C 0.0030 -0.0094 -0.0007 745 ALA 96 O 0.0047 -0.0111 0.0032 746 ALA 96 CB -0.0071 -0.0082 -0.0062 747 GLY 97 N 0.0083 -0.0023 -0.0062 748 GLY 97 CA 0.0125 -0.0010 -0.0049 749 GLY 97 C 0.0147 0.0013 -0.0085 750 GLY 97 O 0.0135 0.0021 -0.0119 751 VAL 98 N 0.0103 0.0000 -0.0074 752 VAL 98 CA 0.0115 -0.0004 -0.0092 753 VAL 98 C 0.0106 0.0018 -0.0109 754 VAL 98 O 0.0098 0.0034 -0.0119 755 VAL 98 CB 0.0134 -0.0019 -0.0109 756 VAL 98 CG1 0.0146 -0.0023 -0.0128 757 VAL 98 CG2 0.0143 -0.0041 -0.0092 758 THR 99 N 0.0077 0.0117 -0.0232 759 THR 99 CA 0.0068 0.0088 -0.0243 760 THR 99 C 0.0072 0.0094 -0.0244 761 THR 99 O 0.0060 0.0073 -0.0243 762 THR 99 CB 0.0078 0.0069 -0.0275 763 THR 99 OG1 0.0102 0.0088 -0.0297 764 THR 99 CG2 0.0072 0.0058 -0.0275 765 ALA 100 N -0.0015 0.0045 -0.0118 766 ALA 100 CA 0.0002 0.0052 -0.0131 767 ALA 100 C 0.0023 0.0050 -0.0123 768 ALA 100 O 0.0025 0.0044 -0.0107 769 ALA 100 CB -0.0004 0.0060 -0.0150 770 VAL 101 N -0.0081 0.0052 -0.0035 771 VAL 101 CA -0.0084 0.0065 -0.0035 772 VAL 101 C -0.0085 0.0070 -0.0038 773 VAL 101 O -0.0084 0.0065 -0.0034 774 VAL 101 CB -0.0086 0.0070 -0.0024 775 VAL 101 CG1 -0.0085 0.0067 -0.0023 776 VAL 101 CG2 -0.0086 0.0067 -0.0013 777 GLU 102 N -0.0090 0.0103 0.0055 778 GLU 102 CA -0.0060 0.0073 0.0035 779 GLU 102 C -0.0080 0.0089 0.0047 780 GLU 102 O -0.0074 0.0137 0.0061 781 GLU 102 CB 0.0002 0.0091 0.0019 782 GLU 102 CG 0.0040 0.0059 -0.0004 783 GLU 102 CD 0.0100 0.0084 -0.0017 784 GLU 102 OE1 0.0114 0.0112 -0.0013 785 GLU 102 OE2 0.0133 0.0075 -0.0031 786 VAL 103 N -0.0138 0.0111 0.0041 787 VAL 103 CA -0.0166 0.0093 0.0029 788 VAL 103 C -0.0130 0.0026 0.0012 789 VAL 103 O -0.0104 -0.0017 0.0001 790 VAL 103 CB -0.0246 0.0089 0.0012 791 VAL 103 CG1 -0.0283 0.0157 0.0030 792 VAL 103 CG2 -0.0272 0.0030 -0.0014 793 ARG 104 N -0.0125 -0.0071 0.0085 794 ARG 104 CA -0.0104 -0.0089 0.0069 795 ARG 104 C -0.0133 -0.0072 0.0089 796 ARG 104 O -0.0145 -0.0026 0.0109 797 ARG 104 CB -0.0050 -0.0065 0.0044 798 ARG 104 CG -0.0024 -0.0079 0.0025 799 ARG 104 CD 0.0024 -0.0044 0.0007 800 ARG 104 NE 0.0060 -0.0060 -0.0018 801 ARG 104 CZ 0.0105 -0.0034 -0.0037 802 ARG 104 NH1 0.0120 0.0012 -0.0033 803 ARG 104 NH2 0.0135 -0.0055 -0.0060 804 HIS 105 N -0.0170 0.0084 0.0171 805 HIS 105 CA -0.0144 0.0037 0.0129 806 HIS 105 C -0.0097 -0.0012 0.0165 807 HIS 105 O -0.0081 -0.0023 0.0195 808 HIS 105 CB -0.0150 0.0024 0.0066 809 HIS 105 CG -0.0150 0.0004 0.0004 810 HIS 105 ND1 -0.0189 0.0042 -0.0032 811 HIS 105 CD2 -0.0119 -0.0046 -0.0025 812 HIS 105 CE1 -0.0180 0.0013 -0.0083 813 HIS 105 NE2 -0.0137 -0.0041 -0.0081 814 PRO 106 N 0.0012 0.0028 0.0191 815 PRO 106 CA 0.0086 -0.0030 0.0237 816 PRO 106 C 0.0126 -0.0043 0.0174 817 PRO 106 O 0.0156 -0.0044 0.0081 818 PRO 106 CB 0.0156 -0.0077 0.0245 819 PRO 106 CG 0.0099 -0.0042 0.0254 820 PRO 106 CD 0.0025 0.0021 0.0182 821 GLY 107 N 0.0192 -0.0039 0.0171 822 GLY 107 CA 0.0225 -0.0010 0.0092 823 GLY 107 C 0.0175 -0.0033 0.0016 824 GLY 107 O 0.0195 -0.0013 -0.0052 825 GLU 108 N -0.0055 0.0143 -0.0116 826 GLU 108 CA 0.0098 -0.0059 -0.0041 827 GLU 108 C 0.0202 -0.0119 -0.0318 828 GLU 108 O 0.0233 -0.0164 -0.0286 829 GLU 108 CB 0.0269 -0.0299 0.0106 830 GLU 108 CG 0.0197 -0.0296 0.0462 831 GLU 108 CD 0.0173 -0.0318 0.0682 832 GLU 108 OE1 0.0244 -0.0378 0.0573 833 GLU 108 OE2 0.0085 -0.0279 0.0966 834 SER 109 N 0.0567 -0.0316 -0.0328 835 SER 109 CA 0.0060 -0.0393 -0.0246 836 SER 109 C 0.0226 -0.0233 -0.0198 837 SER 109 O -0.0027 -0.0479 -0.0272 838 SER 109 CB -0.0515 -0.0156 0.0028 839 SER 109 OG -0.1017 -0.0383 0.0026 840 ASP 110 N -0.0005 -0.0425 -0.0178 841 ASP 110 CA -0.0129 -0.0346 -0.0169 842 ASP 110 C 0.0239 -0.0657 -0.0190 843 ASP 110 O 0.0714 -0.0721 -0.0243 844 ASP 110 CB -0.0112 0.0249 -0.0217 845 ASP 110 CG -0.0594 0.0521 -0.0179 846 ASP 110 OD1 -0.1036 0.0383 -0.0114 847 ASP 110 OD2 -0.0529 0.0863 -0.0213 848 SER 111 N 0.0073 -0.0462 -0.0089 849 SER 111 CA 0.0008 -0.0354 -0.0117 850 SER 111 C -0.0024 -0.0398 -0.0111 851 SER 111 O 0.0044 -0.0484 -0.0088 852 SER 111 CB 0.0098 -0.0222 -0.0133 853 SER 111 OG 0.0133 -0.0163 -0.0140 854 GLN 112 N -0.0164 -0.0158 -0.0114 855 GLN 112 CA -0.0240 -0.0074 -0.0180 856 GLN 112 C -0.0299 -0.0024 -0.0103 857 GLN 112 O -0.0269 -0.0060 -0.0052 858 GLN 112 CB -0.0213 -0.0086 -0.0305 859 GLN 112 CG -0.0278 -0.0010 -0.0403 860 GLN 112 CD -0.0274 -0.0004 -0.0499 861 GLN 112 OE1 -0.0307 0.0027 -0.0478 862 GLN 112 NE2 -0.0232 -0.0033 -0.0609 863 GLU 113 N -0.0189 -0.0036 -0.0162 864 GLU 113 CA -0.0181 0.0008 -0.0170 865 GLU 113 C -0.0218 0.0009 -0.0173 866 GLU 113 O -0.0225 -0.0027 -0.0167 867 GLU 113 CB -0.0126 0.0011 -0.0167 868 GLU 113 CG -0.0113 0.0062 -0.0175 869 GLU 113 CD -0.0056 0.0074 -0.0173 870 GLU 113 OE1 -0.0034 0.0083 -0.0173 871 GLU 113 OE2 -0.0036 0.0077 -0.0172 872 LEU 114 N -0.0203 0.0063 -0.0147 873 LEU 114 CA -0.0221 0.0056 -0.0136 874 LEU 114 C -0.0211 0.0066 -0.0143 875 LEU 114 O -0.0208 0.0091 -0.0150 876 LEU 114 CB -0.0249 0.0072 -0.0124 877 LEU 114 CG -0.0264 0.0061 -0.0114 878 LEU 114 CD1 -0.0287 0.0082 -0.0106 879 LEU 114 CD2 -0.0272 0.0032 -0.0103 880 LEU 115 N -0.0067 0.0042 -0.0183 881 LEU 115 CA -0.0071 -0.0005 -0.0187 882 LEU 115 C -0.0078 -0.0003 -0.0127 883 LEU 115 O -0.0084 0.0001 -0.0072 884 LEU 115 CB -0.0076 -0.0074 -0.0198 885 LEU 115 CG -0.0069 -0.0081 -0.0258 886 LEU 115 CD1 -0.0075 -0.0140 -0.0252 887 LEU 115 CD2 -0.0062 -0.0087 -0.0322 888 ALA 116 N -0.0039 -0.0004 -0.0108 889 ALA 116 CA -0.0052 0.0008 -0.0089 890 ALA 116 C -0.0047 0.0015 -0.0093 891 ALA 116 O -0.0031 0.0020 -0.0110 892 ALA 116 CB -0.0053 0.0033 -0.0080 893 GLU 117 N -0.0023 0.0006 -0.0031 894 GLU 117 CA -0.0028 0.0011 -0.0016 895 GLU 117 C -0.0021 0.0008 -0.0007 896 GLU 117 O -0.0022 0.0009 0.0007 897 GLU 117 CB -0.0043 0.0019 -0.0018 898 GLU 117 CG -0.0052 0.0023 -0.0023 899 GLU 117 CD -0.0065 0.0029 -0.0030 900 GLU 117 OE1 -0.0065 0.0028 -0.0044 901 GLU 117 OE2 -0.0076 0.0036 -0.0023 902 GLY 118 N -0.0042 0.0003 -0.0037 903 GLY 118 CA -0.0040 -0.0016 -0.0049 904 GLY 118 C -0.0043 -0.0035 -0.0050 905 GLY 118 O -0.0041 -0.0033 -0.0054 906 VAL 119 N -0.0026 -0.0060 -0.0055 907 VAL 119 CA -0.0017 -0.0065 -0.0057 908 VAL 119 C -0.0011 -0.0071 -0.0053 909 VAL 119 O -0.0013 -0.0074 -0.0044 910 VAL 119 CB -0.0017 -0.0067 -0.0053 911 VAL 119 CG1 -0.0007 -0.0072 -0.0057 912 VAL 119 CG2 -0.0024 -0.0061 -0.0057 913 PHE 120 N -0.0094 -0.0081 -0.0079 914 PHE 120 CA -0.0081 -0.0092 -0.0072 915 PHE 120 C -0.0062 -0.0101 -0.0075 916 PHE 120 O -0.0053 -0.0096 -0.0090 917 PHE 120 CB -0.0078 -0.0087 -0.0082 918 PHE 120 CG -0.0096 -0.0081 -0.0078 919 PHE 120 CD1 -0.0111 -0.0067 -0.0087 920 PHE 120 CD2 -0.0099 -0.0087 -0.0065 921 PHE 120 CE1 -0.0127 -0.0061 -0.0083 922 PHE 120 CE2 -0.0115 -0.0081 -0.0061 923 PHE 120 CZ -0.0129 -0.0068 -0.0070 924 VAL 121 N -0.0062 -0.0092 -0.0064 925 VAL 121 CA -0.0062 -0.0095 -0.0064 926 VAL 121 C -0.0064 -0.0095 -0.0066 927 VAL 121 O -0.0064 -0.0092 -0.0066 928 VAL 121 CB -0.0059 -0.0095 -0.0061 929 VAL 121 CG1 -0.0059 -0.0098 -0.0061 930 VAL 121 CG2 -0.0057 -0.0095 -0.0059 931 TYR 122 N -0.0068 0.0018 -0.0108 932 TYR 122 CA -0.0011 0.0002 -0.0078 933 TYR 122 C 0.0001 0.0047 -0.0086 934 TYR 122 O 0.0040 0.0097 -0.0083 935 TYR 122 CB 0.0046 0.0010 -0.0055 936 TYR 122 CG 0.0033 -0.0033 -0.0048 937 TYR 122 CD1 0.0029 -0.0102 -0.0029 938 TYR 122 CD2 0.0020 -0.0006 -0.0062 939 TYR 122 CE1 0.0012 -0.0144 -0.0025 940 TYR 122 CE2 0.0003 -0.0047 -0.0057 941 TYR 122 CZ -0.0001 -0.0116 -0.0039 942 TYR 122 OH -0.0020 -0.0158 -0.0035 943 LEU 123 N 0.0006 0.0072 -0.0043 944 LEU 123 CA 0.0006 0.0062 -0.0040 945 LEU 123 C 0.0009 0.0041 -0.0040 946 LEU 123 O 0.0003 0.0033 -0.0033 947 LEU 123 CB -0.0009 0.0065 -0.0028 948 LEU 123 CG -0.0014 0.0086 -0.0027 949 LEU 123 CD1 -0.0029 0.0088 -0.0013 950 LEU 123 CD2 -0.0005 0.0094 -0.0037 951 GLN 124 N 0.0071 0.0055 -0.0031 952 GLN 124 CA 0.0035 0.0057 -0.0079 953 GLN 124 C 0.0041 0.0034 -0.0048 954 GLN 124 O 0.0052 -0.0007 0.0009 955 GLN 124 CB -0.0028 0.0017 -0.0119 956 GLN 124 CG -0.0034 0.0047 -0.0159 957 GLN 124 CD -0.0093 0.0003 -0.0190 958 GLN 124 OE1 -0.0114 -0.0055 -0.0157 959 GLN 124 NE2 -0.0121 0.0031 -0.0254 960 GLY 125 N -0.0030 -0.0081 -0.0077 961 GLY 125 CA -0.0034 -0.0149 0.0023 962 GLY 125 C -0.0086 -0.0164 -0.0104 963 GLY 125 O -0.0129 -0.0137 -0.0273 964 SER 126 N 0.0133 0.0012 0.0019 965 SER 126 CA 0.0175 0.0085 0.0081 966 SER 126 C 0.0150 0.0053 0.0104 967 SER 126 O 0.0188 0.0112 0.0117 968 SER 126 CB 0.0243 0.0176 0.0009 969 SER 126 OG 0.0243 0.0156 -0.0101 970 LYS 127 N -0.0134 -0.0036 0.0019 971 LYS 127 CA -0.0016 0.0041 -0.0101 972 LYS 127 C 0.0099 0.0124 -0.0262 973 LYS 127 O 0.0084 0.0120 -0.0272 974 LYS 127 CB 0.0136 0.0081 0.0052 975 LYS 127 CG 0.0042 0.0004 0.0230 976 LYS 127 CD -0.0050 -0.0023 0.0153 977 LYS 127 CE -0.0230 -0.0128 0.0273 978 LYS 127 NZ -0.0414 -0.0184 0.0131 979 LYS 127 OXT 0.0217 0.0199 -0.0369