1 GLY 1 N 0.0206 0.0099 -0.0115 2 GLY 1 CA 0.0210 0.0120 -0.0094 3 GLY 1 C 0.0201 0.0111 -0.0069 4 GLY 1 O 0.0192 0.0089 -0.0064 5 ARG 2 N 0.0165 0.0021 -0.0002 6 ARG 2 CA 0.0166 0.0029 -0.0024 7 ARG 2 C 0.0120 0.0027 -0.0011 8 ARG 2 O 0.0081 0.0030 -0.0017 9 ARG 2 CB 0.0171 0.0046 -0.0077 10 ARG 2 CG 0.0183 0.0054 -0.0103 11 ARG 2 CD 0.0187 0.0071 -0.0155 12 ARG 2 NE 0.0232 0.0073 -0.0169 13 ARG 2 CZ 0.0257 0.0085 -0.0208 14 ARG 2 NH1 0.0243 0.0096 -0.0241 15 ARG 2 NH2 0.0296 0.0085 -0.0215 16 ILE 3 N -0.0073 0.0036 -0.0102 17 ILE 3 CA -0.0103 -0.0001 -0.0147 18 ILE 3 C -0.0120 -0.0039 -0.0244 19 ILE 3 O -0.0077 -0.0014 -0.0293 20 ILE 3 CB -0.0049 0.0044 -0.0154 21 ILE 3 CG1 -0.0045 0.0071 -0.0052 22 ILE 3 CG2 -0.0072 0.0008 -0.0218 23 ILE 3 CD1 0.0015 0.0124 -0.0048 24 ALA 4 N -0.0205 -0.0177 -0.0198 25 ALA 4 CA -0.0203 -0.0191 -0.0206 26 ALA 4 C -0.0218 -0.0148 -0.0232 27 ALA 4 O -0.0231 -0.0130 -0.0277 28 ALA 4 CB -0.0197 -0.0245 -0.0240 29 SER 5 N -0.0180 -0.0167 -0.0162 30 SER 5 CA -0.0200 -0.0160 -0.0148 31 SER 5 C -0.0220 -0.0104 -0.0125 32 SER 5 O -0.0247 -0.0094 -0.0107 33 SER 5 CB -0.0160 -0.0163 -0.0174 34 SER 5 OG -0.0119 -0.0123 -0.0192 35 ILE 6 N -0.0145 -0.0367 -0.0085 36 ILE 6 CA -0.0148 -0.0319 -0.0061 37 ILE 6 C -0.0173 -0.0318 -0.0053 38 ILE 6 O -0.0158 -0.0340 -0.0068 39 ILE 6 CB -0.0096 -0.0291 -0.0062 40 ILE 6 CG1 -0.0074 -0.0289 -0.0067 41 ILE 6 CG2 -0.0098 -0.0241 -0.0036 42 ILE 6 CD1 -0.0017 -0.0277 -0.0077 43 PRO 7 N -0.0165 -0.0394 0.0086 44 PRO 7 CA -0.0196 -0.0353 0.0135 45 PRO 7 C -0.0184 -0.0287 0.0116 46 PRO 7 O -0.0166 -0.0241 0.0088 47 PRO 7 CB -0.0221 -0.0336 0.0175 48 PRO 7 CG -0.0215 -0.0399 0.0165 49 PRO 7 CD -0.0173 -0.0418 0.0099 50 GLY 8 N -0.0207 -0.0259 0.0131 51 GLY 8 CA -0.0185 -0.0213 0.0115 52 GLY 8 C -0.0171 -0.0214 0.0063 53 GLY 8 O -0.0154 -0.0181 0.0049 54 GLU 9 N -0.0163 -0.0208 -0.0072 55 GLU 9 CA -0.0158 -0.0211 -0.0085 56 GLU 9 C -0.0159 -0.0212 -0.0081 57 GLU 9 O -0.0158 -0.0203 -0.0087 58 GLU 9 CB -0.0153 -0.0227 -0.0094 59 GLU 9 CG -0.0146 -0.0231 -0.0110 60 GLU 9 CD -0.0142 -0.0247 -0.0117 61 GLU 9 OE1 -0.0144 -0.0255 -0.0110 62 GLU 9 OE2 -0.0137 -0.0251 -0.0130 63 ALA 10 N -0.0267 -0.0283 -0.0113 64 ALA 10 CA -0.0284 -0.0355 -0.0138 65 ALA 10 C -0.0291 -0.0304 -0.0110 66 ALA 10 O -0.0250 -0.0329 -0.0144 67 ALA 10 CB -0.0379 -0.0436 -0.0125 68 GLU 11 N -0.0270 -0.0294 0.0045 69 GLU 11 CA -0.0237 -0.0232 0.0095 70 GLU 11 C -0.0181 -0.0161 0.0061 71 GLU 11 O -0.0147 -0.0113 0.0059 72 GLU 11 CB -0.0256 -0.0231 0.0186 73 GLU 11 CG -0.0231 -0.0174 0.0255 74 GLU 11 CD -0.0245 -0.0169 0.0338 75 GLU 11 OE1 -0.0276 -0.0212 0.0343 76 GLU 11 OE2 -0.0222 -0.0119 0.0394 77 TYR 12 N -0.0082 -0.0095 0.0041 78 TYR 12 CA -0.0024 -0.0056 0.0030 79 TYR 12 C -0.0001 -0.0067 -0.0040 80 TYR 12 O 0.0043 -0.0039 -0.0055 81 TYR 12 CB -0.0016 -0.0029 0.0078 82 TYR 12 CG -0.0024 -0.0007 0.0146 83 TYR 12 CD1 0.0019 0.0032 0.0163 84 TYR 12 CD2 -0.0074 -0.0027 0.0193 85 TYR 12 CE1 0.0010 0.0051 0.0224 86 TYR 12 CE2 -0.0083 -0.0008 0.0254 87 TYR 12 CZ -0.0041 0.0030 0.0269 88 TYR 12 OH -0.0053 0.0046 0.0329 89 LEU 13 N -0.0113 -0.0129 -0.0133 90 LEU 13 CA -0.0068 -0.0159 -0.0233 91 LEU 13 C 0.0048 -0.0154 -0.0290 92 LEU 13 O 0.0057 -0.0162 -0.0316 93 LEU 13 CB -0.0165 -0.0217 -0.0319 94 LEU 13 CG -0.0138 -0.0251 -0.0417 95 LEU 13 CD1 -0.0131 -0.0231 -0.0373 96 LEU 13 CD2 -0.0233 -0.0309 -0.0503 97 GLY 14 N 0.0101 -0.0088 -0.0338 98 GLY 14 CA 0.0180 -0.0037 -0.0370 99 GLY 14 C 0.0246 -0.0009 -0.0296 100 GLY 14 O 0.0315 0.0034 -0.0313 101 ARG 15 N 0.0141 0.0034 -0.0068 102 ARG 15 CA 0.0165 0.0078 -0.0010 103 ARG 15 C 0.0158 0.0085 0.0023 104 ARG 15 O 0.0149 0.0102 0.0085 105 ARG 15 CB 0.0136 0.0074 0.0042 106 ARG 15 CG 0.0146 0.0073 0.0019 107 ARG 15 CD 0.0130 0.0084 0.0078 108 ARG 15 NE 0.0069 0.0043 0.0106 109 ARG 15 CZ 0.0043 0.0048 0.0171 110 ARG 15 NH1 0.0071 0.0090 0.0217 111 ARG 15 NH2 -0.0012 0.0009 0.0190 112 GLY 16 N 0.0176 0.0050 0.0015 113 GLY 16 CA 0.0163 0.0056 0.0063 114 GLY 16 C 0.0100 0.0020 0.0038 115 GLY 16 O 0.0100 0.0021 0.0039 116 VAL 17 N 0.0041 -0.0039 -0.0045 117 VAL 17 CA 0.0006 -0.0066 -0.0064 118 VAL 17 C 0.0014 -0.0072 -0.0116 119 VAL 17 O 0.0027 -0.0068 -0.0140 120 VAL 17 CB -0.0031 -0.0088 -0.0049 121 VAL 17 CG1 -0.0067 -0.0116 -0.0071 122 VAL 17 CG2 -0.0040 -0.0083 0.0005 123 SER 18 N 0.0067 -0.0009 -0.0020 124 SER 18 CA 0.0050 0.0009 -0.0039 125 SER 18 C 0.0026 -0.0006 -0.0049 126 SER 18 O 0.0021 -0.0031 -0.0042 127 SER 18 CB 0.0044 0.0020 -0.0048 128 SER 18 OG 0.0028 0.0038 -0.0067 129 TYR 19 N -0.0011 -0.0080 -0.0084 130 TYR 19 CA -0.0032 -0.0077 -0.0085 131 TYR 19 C -0.0001 -0.0084 -0.0091 132 TYR 19 O -0.0014 -0.0087 -0.0103 133 TYR 19 CB -0.0068 -0.0086 -0.0118 134 TYR 19 CG -0.0099 -0.0081 -0.0116 135 TYR 19 CD1 -0.0129 -0.0066 -0.0087 136 TYR 19 CD2 -0.0098 -0.0092 -0.0145 137 TYR 19 CE1 -0.0158 -0.0062 -0.0086 138 TYR 19 CE2 -0.0127 -0.0088 -0.0144 139 TYR 19 CZ -0.0157 -0.0073 -0.0115 140 TYR 19 OH -0.0185 -0.0069 -0.0114 141 CYS 20 N -0.0026 0.0116 -0.0007 142 CYS 20 CA -0.0120 0.0161 -0.0031 143 CYS 20 C -0.0142 0.0115 -0.0033 144 CYS 20 O -0.0100 0.0149 -0.0026 145 CYS 20 CB -0.0111 0.0283 -0.0039 146 CYS 20 SG -0.0236 0.0343 -0.0073 147 ALA 21 N -0.0132 0.0095 0.0032 148 ALA 21 CA -0.0158 0.0053 0.0029 149 ALA 21 C -0.0201 0.0088 0.0027 150 ALA 21 O -0.0202 0.0074 0.0027 151 ALA 21 CB -0.0194 -0.0004 0.0024 152 THR 22 N -0.0251 0.0225 0.0015 153 THR 22 CA -0.0326 0.0275 0.0030 154 THR 22 C -0.0291 0.0332 0.0046 155 THR 22 O -0.0344 0.0349 0.0052 156 THR 22 CB -0.0386 0.0334 0.0048 157 THR 22 OG1 -0.0329 0.0394 0.0065 158 THR 22 CG2 -0.0440 0.0273 0.0030 159 CYS 23 N -0.0411 0.0387 0.0036 160 CYS 23 CA -0.0279 0.0490 0.0033 161 CYS 23 C -0.0160 0.0333 0.0020 162 CYS 23 O -0.0168 0.0337 0.0021 163 CYS 23 CB -0.0128 0.0642 0.0032 164 CYS 23 SG -0.0034 0.0851 0.0036 165 ASP 24 N -0.0125 0.0218 -0.0052 166 ASP 24 CA -0.0060 0.0179 -0.0035 167 ASP 24 C -0.0062 0.0120 0.0019 168 ASP 24 O -0.0009 0.0084 0.0038 169 ASP 24 CB -0.0045 0.0178 -0.0039 170 ASP 24 CG -0.0035 0.0234 -0.0093 171 ASP 24 OD1 -0.0034 0.0273 -0.0129 172 ASP 24 OD2 -0.0027 0.0237 -0.0098 173 GLY 25 N -0.0088 0.0107 0.0117 174 GLY 25 CA -0.0080 0.0097 0.0178 175 GLY 25 C -0.0021 0.0078 0.0196 176 GLY 25 O -0.0006 0.0068 0.0239 177 ALA 26 N -0.0013 0.0037 0.0246 178 ALA 26 CA 0.0054 -0.0017 0.0265 179 ALA 26 C 0.0020 -0.0027 0.0224 180 ALA 26 O 0.0062 -0.0035 0.0258 181 ALA 26 CB 0.0107 -0.0113 0.0237 182 PHE 27 N 0.0168 0.0005 0.0366 183 PHE 27 CA 0.0069 -0.0055 0.0169 184 PHE 27 C -0.0019 0.0187 0.0257 185 PHE 27 O -0.0061 0.0145 0.0157 186 PHE 27 CB -0.0122 -0.0091 -0.0143 187 PHE 27 CG -0.0038 -0.0327 -0.0232 188 PHE 27 CD1 -0.0051 -0.0248 -0.0180 189 PHE 27 CD2 0.0049 -0.0628 -0.0374 190 PHE 27 CE1 0.0022 -0.0457 -0.0261 191 PHE 27 CE2 0.0122 -0.0841 -0.0458 192 PHE 27 CZ 0.0109 -0.0756 -0.0400 193 TYR 28 N 0.0025 0.0093 0.0136 194 TYR 28 CA 0.0018 0.0083 0.0166 195 TYR 28 C 0.0022 0.0069 0.0196 196 TYR 28 O 0.0009 0.0062 0.0223 197 TYR 28 CB -0.0018 0.0094 0.0170 198 TYR 28 CG -0.0020 0.0106 0.0142 199 TYR 28 CD1 -0.0006 0.0101 0.0143 200 TYR 28 CD2 -0.0035 0.0123 0.0115 201 TYR 28 CE1 -0.0005 0.0112 0.0116 202 TYR 28 CE2 -0.0034 0.0134 0.0088 203 TYR 28 CZ -0.0019 0.0129 0.0088 204 TYR 28 OH -0.0018 0.0140 0.0060 205 ARG 29 N -0.0051 0.0098 0.0260 206 ARG 29 CA -0.0037 0.0118 0.0256 207 ARG 29 C -0.0070 0.0152 0.0224 208 ARG 29 O -0.0116 0.0139 0.0211 209 ARG 29 CB -0.0036 0.0077 0.0277 210 ARG 29 CG -0.0009 0.0097 0.0278 211 ARG 29 CD -0.0010 0.0059 0.0298 212 ARG 29 NE 0.0010 0.0017 0.0328 213 ARG 29 CZ 0.0059 0.0015 0.0349 214 ARG 29 NH1 0.0095 0.0052 0.0345 215 ARG 29 NH2 0.0072 -0.0024 0.0375 216 ASN 30 N -0.0080 0.0211 0.0227 217 ASN 30 CA -0.0107 0.0245 0.0172 218 ASN 30 C -0.0104 0.0229 0.0214 219 ASN 30 O -0.0155 0.0262 0.0206 220 ASN 30 CB -0.0191 0.0305 0.0144 221 ASN 30 CG -0.0180 0.0323 0.0074 222 ASN 30 OD1 -0.0206 0.0333 0.0092 223 ASN 30 ND2 -0.0140 0.0328 -0.0009 224 ARG 31 N -0.0044 0.0187 0.0127 225 ARG 31 CA -0.0034 0.0155 0.0181 226 ARG 31 C -0.0003 0.0095 0.0157 227 ARG 31 O 0.0012 0.0073 0.0108 228 ARG 31 CB -0.0035 0.0146 0.0242 229 ARG 31 CG -0.0066 0.0206 0.0271 230 ARG 31 CD -0.0068 0.0198 0.0338 231 ARG 31 NE -0.0099 0.0258 0.0357 232 ARG 31 CZ -0.0122 0.0301 0.0384 233 ARG 31 NH1 -0.0120 0.0294 0.0399 234 ARG 31 NH2 -0.0148 0.0354 0.0395 235 GLU 32 N 0.0061 0.0099 0.0103 236 GLU 32 CA 0.0090 0.0080 0.0090 237 GLU 32 C 0.0118 0.0086 0.0118 238 GLU 32 O 0.0128 0.0096 0.0143 239 GLU 32 CB 0.0109 0.0062 0.0070 240 GLU 32 CG 0.0084 0.0054 0.0040 241 GLU 32 CD 0.0086 0.0035 0.0007 242 GLU 32 OE1 0.0057 0.0037 -0.0008 243 GLU 32 OE2 0.0115 0.0018 -0.0002 244 VAL 33 N 0.0075 0.0023 0.0058 245 VAL 33 CA 0.0097 0.0025 0.0082 246 VAL 33 C 0.0126 0.0008 0.0070 247 VAL 33 O 0.0125 -0.0005 0.0043 248 VAL 33 CB 0.0084 0.0039 0.0099 249 VAL 33 CG1 0.0055 0.0057 0.0112 250 VAL 33 CG2 0.0076 0.0032 0.0078 251 VAL 34 N 0.0112 -0.0020 -0.0005 252 VAL 34 CA 0.0114 -0.0035 -0.0006 253 VAL 34 C 0.0106 -0.0027 -0.0009 254 VAL 34 O 0.0109 -0.0011 -0.0006 255 VAL 34 CB 0.0132 -0.0041 0.0005 256 VAL 34 CG1 0.0133 -0.0056 0.0004 257 VAL 34 CG2 0.0139 -0.0050 0.0008 258 VAL 35 N 0.0069 -0.0082 -0.0054 259 VAL 35 CA 0.0064 -0.0065 -0.0047 260 VAL 35 C 0.0078 -0.0067 -0.0050 261 VAL 35 O 0.0080 -0.0083 -0.0056 262 VAL 35 CB 0.0041 -0.0066 -0.0042 263 VAL 35 CG1 0.0038 -0.0049 -0.0036 264 VAL 35 CG2 0.0028 -0.0063 -0.0039 265 VAL 36 N 0.0066 -0.0092 -0.0095 266 VAL 36 CA 0.0065 -0.0096 -0.0094 267 VAL 36 C 0.0056 -0.0092 -0.0098 268 VAL 36 O 0.0055 -0.0083 -0.0102 269 VAL 36 CB 0.0075 -0.0092 -0.0094 270 VAL 36 CG1 0.0075 -0.0099 -0.0090 271 VAL 36 CG2 0.0086 -0.0093 -0.0091 272 GLY 37 N 0.0066 -0.0041 -0.0136 273 GLY 37 CA 0.0067 -0.0022 -0.0122 274 GLY 37 C 0.0054 -0.0026 -0.0111 275 GLY 37 O 0.0042 -0.0042 -0.0107 276 LEU 38 N 0.0007 0.0040 -0.0088 277 LEU 38 CA 0.0000 0.0041 -0.0075 278 LEU 38 C 0.0009 0.0065 -0.0037 279 LEU 38 O 0.0039 0.0088 -0.0034 280 LEU 38 CB 0.0021 0.0043 -0.0105 281 LEU 38 CG 0.0018 0.0045 -0.0095 282 LEU 38 CD1 -0.0019 0.0021 -0.0086 283 LEU 38 CD2 0.0039 0.0046 -0.0129 284 ASN 39 N -0.0050 0.0086 -0.0007 285 ASN 39 CA -0.0056 0.0101 0.0006 286 ASN 39 C -0.0060 0.0082 0.0024 287 ASN 39 O -0.0058 0.0059 0.0021 288 ASN 39 CB -0.0051 0.0115 -0.0012 289 ASN 39 CG -0.0043 0.0097 -0.0031 290 ASN 39 OD1 -0.0044 0.0078 -0.0025 291 ASN 39 ND2 -0.0036 0.0103 -0.0055 292 PRO 40 N -0.0104 0.0135 0.0065 293 PRO 40 CA -0.0137 0.0112 0.0092 294 PRO 40 C -0.0138 0.0091 0.0082 295 PRO 40 O -0.0159 0.0054 0.0088 296 PRO 40 CB -0.0152 0.0150 0.0129 297 PRO 40 CG -0.0135 0.0180 0.0125 298 PRO 40 CD -0.0100 0.0180 0.0083 299 GLU 41 N -0.0142 0.0095 0.0051 300 GLU 41 CA -0.0126 0.0068 0.0027 301 GLU 41 C -0.0114 0.0044 0.0023 302 GLU 41 O -0.0099 0.0014 0.0028 303 GLU 41 CB -0.0129 0.0083 -0.0012 304 GLU 41 CG -0.0114 0.0058 -0.0039 305 GLU 41 CD -0.0118 0.0075 -0.0078 306 GLU 41 OE1 -0.0132 0.0104 -0.0085 307 GLU 41 OE2 -0.0108 0.0058 -0.0100 308 ALA 42 N -0.0063 0.0031 0.0007 309 ALA 42 CA -0.0049 -0.0005 -0.0003 310 ALA 42 C -0.0071 -0.0037 0.0012 311 ALA 42 O -0.0066 -0.0064 0.0009 312 ALA 42 CB -0.0030 -0.0008 -0.0015 313 VAL 43 N -0.0092 -0.0026 0.0028 314 VAL 43 CA -0.0099 -0.0036 0.0034 315 VAL 43 C -0.0109 -0.0048 0.0046 316 VAL 43 O -0.0118 -0.0062 0.0042 317 VAL 43 CB -0.0094 -0.0025 0.0045 318 VAL 43 CG1 -0.0102 -0.0034 0.0054 319 VAL 43 CG2 -0.0084 -0.0014 0.0032 320 GLU 44 N -0.0134 -0.0041 0.0081 321 GLU 44 CA -0.0166 -0.0035 0.0102 322 GLU 44 C -0.0147 -0.0048 0.0086 323 GLU 44 O -0.0172 -0.0076 0.0091 324 GLU 44 CB -0.0181 0.0020 0.0127 325 GLU 44 CG -0.0212 0.0024 0.0146 326 GLU 44 CD -0.0222 0.0079 0.0170 327 GLU 44 OE1 -0.0239 0.0104 0.0187 328 GLU 44 OE2 -0.0214 0.0096 0.0170 329 GLU 45 N -0.0206 -0.0041 0.0048 330 GLU 45 CA -0.0174 -0.0035 0.0050 331 GLU 45 C -0.0158 -0.0054 0.0070 332 GLU 45 O -0.0137 -0.0050 0.0071 333 GLU 45 CB -0.0162 -0.0027 0.0046 334 GLU 45 CG -0.0170 -0.0003 0.0024 335 GLU 45 CD -0.0154 0.0017 0.0011 336 GLU 45 OE1 -0.0131 0.0028 0.0006 337 GLU 45 OE2 -0.0162 0.0020 0.0006 338 ALA 46 N -0.0077 -0.0048 0.0094 339 ALA 46 CA -0.0074 -0.0058 0.0099 340 ALA 46 C -0.0071 -0.0071 0.0116 341 ALA 46 O -0.0065 -0.0086 0.0116 342 ALA 46 CB -0.0079 -0.0046 0.0103 343 GLN 47 N -0.0097 -0.0121 0.0186 344 GLN 47 CA -0.0082 -0.0097 0.0156 345 GLN 47 C -0.0100 -0.0091 0.0171 346 GLN 47 O -0.0097 -0.0063 0.0151 347 GLN 47 CB -0.0039 -0.0121 0.0128 348 GLN 47 CG -0.0016 -0.0127 0.0108 349 GLN 47 CD 0.0024 -0.0133 0.0071 350 GLN 47 OE1 0.0031 -0.0099 0.0044 351 GLN 47 NE2 0.0051 -0.0176 0.0069 352 VAL 48 N -0.0235 -0.0020 0.0178 353 VAL 48 CA -0.0208 0.0019 0.0172 354 VAL 48 C -0.0169 0.0012 0.0198 355 VAL 48 O -0.0156 0.0029 0.0196 356 VAL 48 CB -0.0199 0.0050 0.0159 357 VAL 48 CG1 -0.0167 0.0089 0.0155 358 VAL 48 CG2 -0.0239 0.0060 0.0129 359 LEU 49 N -0.0073 0.0009 0.0184 360 LEU 49 CA -0.0059 -0.0002 0.0182 361 LEU 49 C -0.0056 -0.0015 0.0198 362 LEU 49 O -0.0043 -0.0026 0.0197 363 LEU 49 CB -0.0059 0.0004 0.0175 364 LEU 49 CG -0.0059 0.0016 0.0158 365 LEU 49 CD1 -0.0062 0.0023 0.0152 366 LEU 49 CD2 -0.0043 0.0011 0.0146 367 THR 50 N -0.0050 -0.0013 0.0218 368 THR 50 CA -0.0064 -0.0024 0.0199 369 THR 50 C -0.0091 -0.0025 0.0205 370 THR 50 O -0.0106 -0.0034 0.0191 371 THR 50 CB -0.0057 -0.0027 0.0190 372 THR 50 OG1 -0.0059 -0.0019 0.0208 373 THR 50 CG2 -0.0031 -0.0027 0.0180 374 LYS 51 N -0.0109 -0.0035 0.0285 375 LYS 51 CA -0.0118 -0.0009 0.0276 376 LYS 51 C -0.0090 0.0008 0.0290 377 LYS 51 O -0.0093 0.0029 0.0285 378 LYS 51 CB -0.0134 0.0020 0.0263 379 LYS 51 CG -0.0163 0.0005 0.0248 380 LYS 51 CD -0.0176 0.0032 0.0237 381 LYS 51 CE -0.0206 0.0018 0.0221 382 LYS 51 NZ -0.0201 0.0010 0.0225 383 PHE 52 N -0.0051 0.0075 0.0269 384 PHE 52 CA -0.0052 0.0067 0.0260 385 PHE 52 C -0.0049 0.0065 0.0247 386 PHE 52 O -0.0052 0.0055 0.0242 387 PHE 52 CB -0.0049 0.0073 0.0257 388 PHE 52 CG -0.0051 0.0076 0.0268 389 PHE 52 CD1 -0.0056 0.0067 0.0275 390 PHE 52 CD2 -0.0048 0.0088 0.0273 391 PHE 52 CE1 -0.0058 0.0069 0.0286 392 PHE 52 CE2 -0.0050 0.0091 0.0283 393 PHE 52 CZ -0.0055 0.0081 0.0290 394 ALA 53 N -0.0060 0.0049 0.0193 395 ALA 53 CA -0.0045 0.0041 0.0166 396 ALA 53 C -0.0059 0.0031 0.0122 397 ALA 53 O -0.0065 0.0027 0.0105 398 ALA 53 CB 0.0002 0.0039 0.0169 399 SER 54 N -0.0055 0.0062 0.0081 400 SER 54 CA -0.0062 0.0040 0.0039 401 SER 54 C -0.0030 -0.0016 0.0009 402 SER 54 O -0.0045 -0.0035 -0.0043 403 SER 54 CB -0.0050 0.0047 0.0067 404 SER 54 OG -0.0085 0.0098 0.0085 405 THR 55 N 0.0007 -0.0019 -0.0007 406 THR 55 CA 0.0044 -0.0028 -0.0023 407 THR 55 C 0.0074 -0.0014 0.0012 408 THR 55 O 0.0081 -0.0003 0.0037 409 THR 55 CB 0.0069 -0.0042 -0.0052 410 THR 55 OG1 0.0044 -0.0057 -0.0086 411 THR 55 CG2 0.0108 -0.0051 -0.0067 412 VAL 56 N 0.0032 -0.0051 -0.0010 413 VAL 56 CA 0.0060 -0.0044 0.0011 414 VAL 56 C 0.0091 -0.0048 -0.0010 415 VAL 56 O 0.0100 -0.0053 -0.0027 416 VAL 56 CB 0.0061 -0.0038 0.0032 417 VAL 56 CG1 0.0092 -0.0031 0.0053 418 VAL 56 CG2 0.0029 -0.0034 0.0053 419 HIS 57 N 0.0157 -0.0009 -0.0058 420 HIS 57 CA 0.0168 -0.0023 -0.0058 421 HIS 57 C 0.0172 -0.0025 -0.0056 422 HIS 57 O 0.0177 -0.0017 -0.0046 423 HIS 57 CB 0.0179 -0.0025 -0.0049 424 HIS 57 CG 0.0176 -0.0023 -0.0050 425 HIS 57 ND1 0.0175 -0.0035 -0.0059 426 HIS 57 CD2 0.0175 -0.0012 -0.0045 427 HIS 57 CE1 0.0173 -0.0030 -0.0058 428 HIS 57 NE2 0.0172 -0.0017 -0.0050 429 TRP 58 N 0.0148 -0.0090 -0.0082 430 TRP 58 CA 0.0128 -0.0070 -0.0089 431 TRP 58 C 0.0126 -0.0072 -0.0087 432 TRP 58 O 0.0118 -0.0090 -0.0072 433 TRP 58 CB 0.0098 -0.0068 -0.0080 434 TRP 58 CG 0.0077 -0.0044 -0.0089 435 TRP 58 CD1 0.0082 -0.0021 -0.0106 436 TRP 58 CD2 0.0047 -0.0041 -0.0080 437 TRP 58 NE1 0.0057 -0.0005 -0.0109 438 TRP 58 CE2 0.0035 -0.0016 -0.0094 439 TRP 58 CE3 0.0029 -0.0058 -0.0063 440 TRP 58 CZ2 0.0006 -0.0008 -0.0089 441 TRP 58 CZ3 -0.0001 -0.0049 -0.0059 442 TRP 58 CH2 -0.0012 -0.0024 -0.0072 443 ILE 59 N 0.0149 -0.0072 -0.0130 444 ILE 59 CA 0.0133 -0.0073 -0.0123 445 ILE 59 C 0.0115 -0.0075 -0.0133 446 ILE 59 O 0.0112 -0.0074 -0.0150 447 ILE 59 CB 0.0136 -0.0073 -0.0129 448 ILE 59 CG1 0.0154 -0.0072 -0.0118 449 ILE 59 CG2 0.0119 -0.0075 -0.0123 450 ILE 59 CD1 0.0160 -0.0071 -0.0124 451 THR 60 N 0.0094 -0.0034 -0.0161 452 THR 60 CA 0.0083 -0.0028 -0.0161 453 THR 60 C 0.0070 -0.0020 -0.0158 454 THR 60 O 0.0070 -0.0019 -0.0150 455 THR 60 CB 0.0085 -0.0027 -0.0148 456 THR 60 OG1 0.0086 -0.0025 -0.0133 457 THR 60 CG2 0.0098 -0.0035 -0.0150 458 PRO 61 N 0.0038 -0.0008 -0.0158 459 PRO 61 CA 0.0036 -0.0007 -0.0157 460 PRO 61 C -0.0000 -0.0021 -0.0129 461 PRO 61 O -0.0004 -0.0023 -0.0125 462 PRO 61 CB 0.0031 0.0036 -0.0183 463 PRO 61 CG 0.0007 0.0058 -0.0185 464 PRO 61 CD 0.0026 0.0031 -0.0178 465 LYS 62 N 0.0100 -0.0020 -0.0213 466 LYS 62 CA 0.0105 -0.0019 -0.0218 467 LYS 62 C 0.0077 -0.0033 -0.0210 468 LYS 62 O 0.0056 -0.0042 -0.0199 469 LYS 62 CB 0.0126 0.0002 -0.0199 470 LYS 62 CG 0.0114 0.0008 -0.0164 471 LYS 62 CD 0.0135 0.0029 -0.0144 472 LYS 62 CE 0.0155 0.0044 -0.0137 473 LYS 62 NZ 0.0173 0.0063 -0.0116 474 ASP 63 N 0.0147 -0.0044 -0.0225 475 ASP 63 CA 0.0103 -0.0043 -0.0241 476 ASP 63 C 0.0081 -0.0025 -0.0205 477 ASP 63 O 0.0107 -0.0020 -0.0181 478 ASP 63 CB 0.0115 -0.0062 -0.0285 479 ASP 63 CG 0.0077 -0.0062 -0.0303 480 ASP 63 OD1 0.0075 -0.0053 -0.0280 481 ASP 63 OD2 0.0051 -0.0071 -0.0338 482 PRO 64 N 0.0052 -0.0039 -0.0141 483 PRO 64 CA 0.0028 -0.0008 -0.0119 484 PRO 64 C -0.0005 -0.0007 -0.0112 485 PRO 64 O -0.0023 0.0020 -0.0093 486 PRO 64 CB 0.0010 -0.0013 -0.0118 487 PRO 64 CG 0.0031 -0.0042 -0.0139 488 PRO 64 CD 0.0044 -0.0065 -0.0154 489 HIS 65 N 0.0009 -0.0035 -0.0156 490 HIS 65 CA -0.0044 -0.0019 -0.0101 491 HIS 65 C -0.0053 0.0062 -0.0097 492 HIS 65 O -0.0096 0.0092 -0.0054 493 HIS 65 CB -0.0066 -0.0072 -0.0075 494 HIS 65 CG -0.0064 -0.0152 -0.0072 495 HIS 65 ND1 -0.0027 -0.0201 -0.0107 496 HIS 65 CD2 -0.0094 -0.0187 -0.0038 497 HIS 65 CE1 -0.0035 -0.0265 -0.0094 498 HIS 65 NE2 -0.0076 -0.0260 -0.0052 499 THR 66 N 0.0031 0.0048 -0.0146 500 THR 66 CA 0.0074 0.0091 -0.0110 501 THR 66 C 0.0047 0.0122 -0.0049 502 THR 66 O 0.0070 0.0155 -0.0015 503 THR 66 CB 0.0130 0.0105 -0.0124 504 THR 66 OG1 0.0113 0.0099 -0.0123 505 THR 66 CG2 0.0171 0.0082 -0.0181 506 LEU 67 N -0.0013 0.0108 -0.0048 507 LEU 67 CA -0.0046 0.0128 0.0014 508 LEU 67 C -0.0097 0.0109 0.0055 509 LEU 67 O -0.0135 0.0110 0.0102 510 LEU 67 CB -0.0066 0.0106 0.0014 511 LEU 67 CG -0.0023 0.0138 -0.0002 512 LEU 67 CD1 -0.0052 0.0117 0.0010 513 LEU 67 CD2 0.0010 0.0204 0.0034 514 ASP 68 N -0.0167 0.0126 0.0091 515 ASP 68 CA -0.0056 0.0144 0.0003 516 ASP 68 C -0.0284 0.0138 0.0064 517 ASP 68 O -0.0236 0.0087 0.0256 518 ASP 68 CB 0.0283 0.0096 0.0127 519 ASP 68 CG 0.0456 0.0137 -0.0063 520 ASP 68 OD1 0.0504 0.0104 0.0057 521 ASP 68 OD2 0.0540 0.0202 -0.0333 522 GLY 69 N -0.0326 0.0040 -0.0000 523 GLY 69 CA -0.0359 0.0004 0.0024 524 GLY 69 C -0.0318 0.0043 -0.0005 525 GLY 69 O -0.0325 0.0002 0.0007 526 HIS 70 N -0.0184 0.0031 0.0021 527 HIS 70 CA -0.0211 0.0015 0.0045 528 HIS 70 C -0.0239 -0.0071 -0.0035 529 HIS 70 O -0.0296 -0.0122 -0.0010 530 HIS 70 CB -0.0141 0.0102 0.0054 531 HIS 70 CG -0.0167 0.0117 0.0122 532 HIS 70 ND1 -0.0178 0.0076 0.0080 533 HIS 70 CD2 -0.0182 0.0166 0.0226 534 HIS 70 CE1 -0.0200 0.0101 0.0160 535 HIS 70 NE2 -0.0204 0.0155 0.0249 536 ALA 71 N -0.0153 -0.0037 -0.0022 537 ALA 71 CA -0.0125 -0.0046 -0.0014 538 ALA 71 C -0.0118 -0.0062 0.0006 539 ALA 71 O -0.0095 -0.0070 0.0014 540 ALA 71 CB -0.0122 -0.0051 -0.0007 541 ASP 72 N -0.0121 -0.0033 -0.0011 542 ASP 72 CA -0.0086 -0.0035 0.0058 543 ASP 72 C 0.0034 0.0038 0.0046 544 ASP 72 O 0.0100 0.0047 0.0137 545 ASP 72 CB -0.0171 -0.0071 0.0016 546 ASP 72 CG -0.0285 -0.0152 0.0058 547 ASP 72 OD1 -0.0306 -0.0180 0.0107 548 ASP 72 OD2 -0.0355 -0.0186 0.0039 549 GLU 73 N 0.0048 0.0036 0.0064 550 GLU 73 CA 0.0387 0.0088 0.0004 551 GLU 73 C 0.0400 0.0131 0.0096 552 GLU 73 O 0.0619 0.0252 0.0258 553 GLU 73 CB 0.0514 -0.0038 -0.0352 554 GLU 73 CG 0.0891 0.0010 -0.0440 555 GLU 73 CD 0.1007 -0.0118 -0.0795 556 GLU 73 OE1 0.0800 -0.0246 -0.0979 557 GLU 73 OE2 0.1311 -0.0086 -0.0881 558 LEU 74 N 0.0143 -0.0006 0.0051 559 LEU 74 CA 0.0096 -0.0001 0.0058 560 LEU 74 C 0.0075 0.0059 0.0094 561 LEU 74 O 0.0073 0.0081 0.0106 562 LEU 74 CB 0.0038 -0.0041 0.0042 563 LEU 74 CG -0.0017 -0.0040 0.0049 564 LEU 74 CD1 0.0003 -0.0059 0.0037 565 LEU 74 CD2 -0.0073 -0.0079 0.0034 566 LEU 75 N 0.0125 0.0032 0.0038 567 LEU 75 CA 0.0108 0.0070 0.0087 568 LEU 75 C 0.0156 0.0113 0.0103 569 LEU 75 O 0.0150 0.0148 0.0144 570 LEU 75 CB 0.0067 0.0060 0.0101 571 LEU 75 CG 0.0010 0.0025 0.0098 572 LEU 75 CD1 -0.0023 0.0010 0.0102 573 LEU 75 CD2 -0.0022 0.0043 0.0136 574 ALA 76 N 0.0315 0.0358 0.0302 575 ALA 76 CA 0.0621 0.0503 0.0435 576 ALA 76 C 0.0648 0.0333 0.0372 577 ALA 76 O 0.0854 0.0464 0.0475 578 ALA 76 CB 0.1024 0.0416 0.0496 579 HIS 77 N 0.0199 0.0061 0.0082 580 HIS 77 CA 0.0124 0.0023 0.0086 581 HIS 77 C 0.0085 0.0019 0.0005 582 HIS 77 O 0.0115 0.0041 -0.0034 583 HIS 77 CB 0.0117 0.0008 0.0149 584 HIS 77 CG 0.0042 -0.0035 0.0177 585 HIS 77 ND1 -0.0013 -0.0053 0.0127 586 HIS 77 CD2 0.0015 -0.0061 0.0245 587 HIS 77 CE1 -0.0073 -0.0090 0.0165 588 HIS 77 NE2 -0.0059 -0.0096 0.0237 589 PRO 78 N -0.0002 -0.0113 0.0039 590 PRO 78 CA -0.0066 -0.0140 -0.0173 591 PRO 78 C -0.0087 -0.0147 -0.0166 592 PRO 78 O -0.0099 -0.0156 -0.0342 593 PRO 78 CB -0.0283 -0.0211 -0.0223 594 PRO 78 CG -0.0286 -0.0208 -0.0084 595 PRO 78 CD -0.0159 -0.0161 0.0122 596 SER 79 N -0.0050 -0.0085 -0.0054 597 SER 79 CA -0.0030 -0.0077 -0.0052 598 SER 79 C 0.0040 -0.0053 -0.0062 599 SER 79 O 0.0066 -0.0047 -0.0072 600 SER 79 CB -0.0055 -0.0060 0.0009 601 SER 79 OG -0.0122 -0.0081 0.0021 602 VAL 80 N 0.0043 -0.0039 -0.0053 603 VAL 80 CA 0.0079 -0.0016 -0.0058 604 VAL 80 C 0.0096 -0.0016 -0.0099 605 VAL 80 O 0.0094 -0.0022 -0.0117 606 VAL 80 CB 0.0097 0.0003 -0.0028 607 VAL 80 CG1 0.0135 0.0027 -0.0035 608 VAL 80 CG2 0.0083 0.0005 0.0013 609 LYS 81 N 0.0144 -0.0059 -0.0092 610 LYS 81 CA 0.0168 -0.0065 -0.0118 611 LYS 81 C 0.0199 -0.0043 -0.0109 612 LYS 81 O 0.0211 -0.0028 -0.0096 613 LYS 81 CB 0.0174 -0.0077 -0.0140 614 LYS 81 CG 0.0146 -0.0101 -0.0155 615 LYS 81 CD 0.0155 -0.0115 -0.0182 616 LYS 81 CE 0.0129 -0.0140 -0.0199 617 LYS 81 NZ 0.0102 -0.0143 -0.0184 618 LEU 82 N 0.0179 -0.0044 -0.0107 619 LEU 82 CA 0.0166 -0.0039 -0.0112 620 LEU 82 C 0.0166 -0.0042 -0.0107 621 LEU 82 O 0.0165 -0.0050 -0.0093 622 LEU 82 CB 0.0149 -0.0040 -0.0107 623 LEU 82 CG 0.0133 -0.0036 -0.0111 624 LEU 82 CD1 0.0132 -0.0026 -0.0128 625 LEU 82 CD2 0.0118 -0.0038 -0.0103 626 TRP 83 N 0.0170 -0.0036 -0.0099 627 TRP 83 CA 0.0173 -0.0035 -0.0102 628 TRP 83 C 0.0156 -0.0022 -0.0106 629 TRP 83 O 0.0156 -0.0010 -0.0120 630 TRP 83 CB 0.0191 -0.0034 -0.0117 631 TRP 83 CG 0.0209 -0.0048 -0.0114 632 TRP 83 CD1 0.0217 -0.0049 -0.0119 633 TRP 83 CD2 0.0218 -0.0062 -0.0103 634 TRP 83 NE1 0.0232 -0.0063 -0.0112 635 TRP 83 CE2 0.0233 -0.0071 -0.0103 636 TRP 83 CE3 0.0215 -0.0068 -0.0095 637 TRP 83 CZ2 0.0245 -0.0086 -0.0094 638 TRP 83 CZ3 0.0227 -0.0083 -0.0086 639 TRP 83 CH2 0.0242 -0.0092 -0.0085 640 GLU 84 N 0.0125 0.0026 -0.0115 641 GLU 84 CA 0.0108 -0.0004 -0.0125 642 GLU 84 C 0.0080 -0.0018 -0.0099 643 GLU 84 O 0.0073 -0.0003 -0.0070 644 GLU 84 CB 0.0117 -0.0004 -0.0139 645 GLU 84 CG 0.0114 0.0014 -0.0113 646 GLU 84 CD 0.0115 0.0006 -0.0123 647 GLU 84 OE1 0.0123 -0.0008 -0.0153 648 GLU 84 OE2 0.0105 0.0012 -0.0101 649 LYS 85 N 0.0036 -0.0009 -0.0109 650 LYS 85 CA -0.0031 -0.0047 -0.0061 651 LYS 85 C -0.0053 -0.0023 -0.0003 652 LYS 85 O -0.0096 -0.0020 0.0059 653 LYS 85 CB -0.0056 -0.0045 -0.0024 654 LYS 85 CG -0.0037 -0.0068 -0.0076 655 LYS 85 CD -0.0080 -0.0089 -0.0042 656 LYS 85 CE -0.0045 -0.0063 -0.0060 657 LYS 85 NZ -0.0023 0.0008 -0.0009 658 THR 86 N -0.0044 -0.0005 -0.0043 659 THR 86 CA -0.0026 -0.0011 -0.0059 660 THR 86 C -0.0027 -0.0004 -0.0096 661 THR 86 O -0.0032 0.0000 -0.0108 662 THR 86 CB 0.0006 -0.0028 -0.0050 663 THR 86 OG1 0.0026 -0.0035 -0.0062 664 THR 86 CG2 0.0007 -0.0035 -0.0013 665 ARG 87 N -0.0152 0.0029 0.0381 666 ARG 87 CA -0.0126 0.0123 0.0213 667 ARG 87 C -0.0116 -0.0257 -0.0047 668 ARG 87 O -0.0092 -0.0429 -0.0321 669 ARG 87 CB -0.0069 0.0531 -0.0071 670 ARG 87 CG -0.0057 0.0773 -0.0062 671 ARG 87 CD 0.0006 0.0976 -0.0488 672 ARG 87 NE 0.0036 0.1351 -0.0569 673 ARG 87 CZ 0.0053 0.1766 -0.0517 674 ARG 87 NH1 0.0039 0.1880 -0.0353 675 ARG 87 NH2 0.0084 0.2072 -0.0634 676 LEU 88 N 0.0014 -0.0135 -0.0103 677 LEU 88 CA 0.0021 -0.0143 -0.0112 678 LEU 88 C 0.0014 -0.0140 -0.0125 679 LEU 88 O 0.0007 -0.0137 -0.0132 680 LEU 88 CB 0.0029 -0.0150 -0.0117 681 LEU 88 CG 0.0037 -0.0158 -0.0128 682 LEU 88 CD1 0.0044 -0.0163 -0.0124 683 LEU 88 CD2 0.0044 -0.0165 -0.0130 684 ILE 89 N 0.0045 -0.0152 -0.0158 685 ILE 89 CA 0.0020 -0.0162 -0.0142 686 ILE 89 C -0.0072 -0.0207 -0.0068 687 ILE 89 O -0.0073 -0.0241 -0.0010 688 ILE 89 CB -0.0021 -0.0107 -0.0237 689 ILE 89 CG1 0.0065 -0.0056 -0.0321 690 ILE 89 CG2 -0.0051 -0.0117 -0.0222 691 ILE 89 CD1 0.0182 -0.0067 -0.0297 692 ARG 90 N -0.0080 -0.0257 0.0043 693 ARG 90 CA -0.0099 -0.0226 0.0083 694 ARG 90 C -0.0058 -0.0148 0.0036 695 ARG 90 O -0.0025 -0.0088 -0.0000 696 ARG 90 CB -0.0148 -0.0184 0.0175 697 ARG 90 CG -0.0182 -0.0162 0.0236 698 ARG 90 CD -0.0237 -0.0152 0.0328 699 ARG 90 NE -0.0266 -0.0251 0.0349 700 ARG 90 CZ -0.0280 -0.0273 0.0366 701 ARG 90 NH1 -0.0273 -0.0208 0.0373 702 ARG 90 NH2 -0.0302 -0.0366 0.0376 703 ILE 91 N -0.0060 -0.0136 0.0125 704 ILE 91 CA -0.0050 -0.0088 0.0107 705 ILE 91 C -0.0062 -0.0056 0.0154 706 ILE 91 O -0.0075 -0.0077 0.0191 707 ILE 91 CB -0.0041 -0.0100 0.0073 708 ILE 91 CG1 -0.0028 -0.0133 0.0026 709 ILE 91 CG2 -0.0032 -0.0049 0.0058 710 ILE 91 CD1 -0.0022 -0.0160 -0.0003 711 LYS 92 N -0.0013 0.0025 0.0215 712 LYS 92 CA -0.0021 0.0054 0.0254 713 LYS 92 C -0.0004 0.0092 0.0242 714 LYS 92 O 0.0015 0.0106 0.0206 715 LYS 92 CB -0.0025 0.0075 0.0278 716 LYS 92 CG -0.0042 0.0043 0.0296 717 LYS 92 CD -0.0042 0.0069 0.0315 718 LYS 92 CE -0.0065 0.0061 0.0360 719 LYS 92 NZ -0.0078 0.0016 0.0360 720 GLY 93 N 0.0021 0.0179 0.0243 721 GLY 93 CA 0.0033 0.0145 0.0244 722 GLY 93 C 0.0064 0.0125 0.0203 723 GLY 93 O 0.0079 0.0129 0.0176 724 GLU 94 N 0.0248 0.0091 0.0018 725 GLU 94 CA 0.0263 -0.0033 -0.0133 726 GLU 94 C 0.0202 0.0157 0.0146 727 GLU 94 O 0.0166 0.0384 0.0430 728 GLU 94 CB 0.0015 -0.0425 -0.0238 729 GLU 94 CG 0.0042 -0.0649 -0.0507 730 GLU 94 CD -0.0220 -0.1028 -0.0582 731 GLU 94 OE1 -0.0149 -0.1242 -0.0896 732 GLU 94 OE2 -0.0492 -0.1106 -0.0323 733 GLU 95 N -0.0136 0.0396 0.0614 734 GLU 95 CA -0.0059 0.0194 0.0345 735 GLU 95 C 0.0212 0.0111 0.0356 736 GLU 95 O 0.0202 0.0010 0.0197 737 GLU 95 CB 0.0023 0.0079 0.0210 738 GLU 95 CG 0.0075 -0.0134 -0.0089 739 GLU 95 CD -0.0229 -0.0165 -0.0290 740 GLU 95 OE1 -0.0389 -0.0120 -0.0303 741 GLU 95 OE2 -0.0304 -0.0230 -0.0429 742 ALA 96 N -0.0047 0.0069 0.0251 743 ALA 96 CA -0.0092 0.0083 0.0231 744 ALA 96 C 0.0045 0.0049 0.0204 745 ALA 96 O 0.0045 0.0043 0.0269 746 ALA 96 CB -0.0204 0.0125 0.0087 747 GLY 97 N 0.0083 0.0116 0.0263 748 GLY 97 CA 0.0092 0.0095 0.0247 749 GLY 97 C 0.0086 0.0109 0.0258 750 GLY 97 O 0.0068 0.0127 0.0280 751 VAL 98 N 0.0107 0.0085 0.0202 752 VAL 98 CA 0.0097 0.0075 0.0213 753 VAL 98 C 0.0108 0.0088 0.0226 754 VAL 98 O 0.0121 0.0103 0.0217 755 VAL 98 CB 0.0088 0.0063 0.0193 756 VAL 98 CG1 0.0077 0.0052 0.0205 757 VAL 98 CG2 0.0076 0.0048 0.0181 758 THR 99 N 0.0103 0.0088 0.0302 759 THR 99 CA 0.0095 0.0117 0.0282 760 THR 99 C 0.0116 0.0114 0.0258 761 THR 99 O 0.0118 0.0135 0.0234 762 THR 99 CB 0.0070 0.0134 0.0296 763 THR 99 OG1 0.0069 0.0119 0.0313 764 THR 99 CG2 0.0047 0.0141 0.0318 765 ALA 100 N 0.0108 0.0133 0.0158 766 ALA 100 CA 0.0109 0.0121 0.0151 767 ALA 100 C 0.0100 0.0066 0.0143 768 ALA 100 O 0.0089 0.0036 0.0149 769 ALA 100 CB 0.0091 0.0142 0.0191 770 VAL 101 N 0.0089 0.0024 0.0039 771 VAL 101 CA 0.0108 -0.0022 0.0042 772 VAL 101 C 0.0110 -0.0025 0.0041 773 VAL 101 O 0.0106 0.0006 0.0022 774 VAL 101 CB 0.0135 -0.0046 0.0007 775 VAL 101 CG1 0.0134 -0.0049 0.0012 776 VAL 101 CG2 0.0147 -0.0022 -0.0040 777 GLU 102 N 0.0062 -0.0069 -0.0032 778 GLU 102 CA 0.0052 -0.0061 -0.0023 779 GLU 102 C 0.0083 -0.0092 -0.0047 780 GLU 102 O 0.0088 -0.0140 -0.0046 781 GLU 102 CB 0.0012 -0.0080 0.0016 782 GLU 102 CG -0.0006 -0.0071 0.0031 783 GLU 102 CD -0.0043 -0.0096 0.0069 784 GLU 102 OE1 -0.0062 -0.0107 0.0088 785 GLU 102 OE2 -0.0054 -0.0107 0.0081 786 VAL 103 N 0.0110 -0.0119 -0.0097 787 VAL 103 CA 0.0116 -0.0124 -0.0102 788 VAL 103 C 0.0114 -0.0122 -0.0100 789 VAL 103 O 0.0110 -0.0114 -0.0097 790 VAL 103 CB 0.0125 -0.0121 -0.0111 791 VAL 103 CG1 0.0127 -0.0123 -0.0113 792 VAL 103 CG2 0.0126 -0.0108 -0.0112 793 ARG 104 N 0.0071 -0.0125 -0.0186 794 ARG 104 CA 0.0057 -0.0108 -0.0176 795 ARG 104 C 0.0038 -0.0086 -0.0150 796 ARG 104 O 0.0028 -0.0072 -0.0156 797 ARG 104 CB 0.0050 -0.0093 -0.0209 798 ARG 104 CG 0.0034 -0.0073 -0.0203 799 ARG 104 CD 0.0023 -0.0053 -0.0235 800 ARG 104 NE 0.0040 -0.0070 -0.0262 801 ARG 104 CZ 0.0037 -0.0060 -0.0295 802 ARG 104 NH1 0.0018 -0.0033 -0.0308 803 ARG 104 NH2 0.0052 -0.0077 -0.0316 804 HIS 105 N -0.0041 -0.0130 -0.0027 805 HIS 105 CA -0.0158 -0.0067 0.0048 806 HIS 105 C -0.0247 0.0022 -0.0018 807 HIS 105 O -0.0228 0.0019 -0.0050 808 HIS 105 CB -0.0167 -0.0110 0.0196 809 HIS 105 CG -0.0241 -0.0089 0.0302 810 HIS 105 ND1 -0.0192 -0.0143 0.0355 811 HIS 105 CD2 -0.0354 -0.0023 0.0360 812 HIS 105 CE1 -0.0277 -0.0109 0.0444 813 HIS 105 NE2 -0.0377 -0.0036 0.0451 814 PRO 106 N -0.0322 0.0049 0.0008 815 PRO 106 CA -0.0386 0.0160 -0.0065 816 PRO 106 C -0.0417 0.0157 -0.0008 817 PRO 106 O -0.0475 0.0139 0.0122 818 PRO 106 CB -0.0496 0.0263 -0.0045 819 PRO 106 CG -0.0459 0.0214 -0.0029 820 PRO 106 CD -0.0377 0.0077 0.0055 821 GLY 107 N -0.0196 0.0097 -0.0070 822 GLY 107 CA -0.0129 0.0009 -0.0101 823 GLY 107 C -0.0067 -0.0141 -0.0130 824 GLY 107 O 0.0025 -0.0199 -0.0170 825 GLU 108 N -0.0040 -0.0136 -0.0105 826 GLU 108 CA -0.0071 -0.0177 -0.0163 827 GLU 108 C -0.0017 -0.0170 -0.0140 828 GLU 108 O 0.0014 -0.0222 -0.0194 829 GLU 108 CB -0.0194 -0.0158 -0.0174 830 GLU 108 CG -0.0255 -0.0195 -0.0235 831 GLU 108 CD -0.0241 -0.0275 -0.0329 832 GLU 108 OE1 -0.0199 -0.0302 -0.0350 833 GLU 108 OE2 -0.0276 -0.0309 -0.0379 834 SER 109 N 0.0000 -0.0151 -0.0162 835 SER 109 CA -0.0145 -0.0165 -0.0091 836 SER 109 C -0.0039 -0.0059 -0.0059 837 SER 109 O -0.0099 -0.0117 -0.0075 838 SER 109 CB -0.0352 -0.0127 0.0063 839 SER 109 OG -0.0503 -0.0195 0.0091 840 ASP 110 N -0.0090 -0.0059 -0.0052 841 ASP 110 CA -0.0022 -0.0003 -0.0043 842 ASP 110 C 0.0125 -0.0064 -0.0135 843 ASP 110 O 0.0223 -0.0090 -0.0186 844 ASP 110 CB 0.0017 0.0163 0.0043 845 ASP 110 CG -0.0136 0.0223 0.0136 846 ASP 110 OD1 -0.0216 0.0200 0.0151 847 ASP 110 OD2 -0.0174 0.0292 0.0192 848 SER 111 N 0.0091 -0.0065 -0.0112 849 SER 111 CA 0.0121 -0.0091 -0.0126 850 SER 111 C 0.0161 -0.0093 -0.0108 851 SER 111 O 0.0164 -0.0082 -0.0094 852 SER 111 CB 0.0115 -0.0119 -0.0163 853 SER 111 OG 0.0079 -0.0121 -0.0183 854 GLN 112 N 0.0170 -0.0108 -0.0060 855 GLN 112 CA 0.0172 -0.0079 -0.0075 856 GLN 112 C 0.0166 -0.0077 -0.0068 857 GLN 112 O 0.0173 -0.0101 -0.0068 858 GLN 112 CB 0.0193 -0.0077 -0.0107 859 GLN 112 CG 0.0194 -0.0042 -0.0123 860 GLN 112 CD 0.0215 -0.0040 -0.0153 861 GLN 112 OE1 0.0219 -0.0042 -0.0159 862 GLN 112 NE2 0.0227 -0.0037 -0.0172 863 GLU 113 N 0.0155 0.0032 -0.0011 864 GLU 113 CA 0.0141 0.0057 0.0006 865 GLU 113 C 0.0154 0.0106 -0.0057 866 GLU 113 O 0.0153 0.0160 -0.0087 867 GLU 113 CB 0.0102 0.0097 0.0075 868 GLU 113 CG 0.0086 0.0112 0.0103 869 GLU 113 CD 0.0050 0.0125 0.0182 870 GLU 113 OE1 0.0045 0.0070 0.0227 871 GLU 113 OE2 0.0027 0.0189 0.0198 872 LEU 114 N 0.0213 0.0006 -0.0005 873 LEU 114 CA 0.0198 0.0030 -0.0034 874 LEU 114 C 0.0179 0.0058 -0.0005 875 LEU 114 O 0.0185 0.0047 0.0023 876 LEU 114 CB 0.0213 0.0009 -0.0062 877 LEU 114 CG 0.0231 -0.0015 -0.0099 878 LEU 114 CD1 0.0249 -0.0041 -0.0116 879 LEU 114 CD2 0.0216 0.0008 -0.0137 880 LEU 115 N 0.0189 0.0094 0.0028 881 LEU 115 CA 0.0156 0.0116 0.0061 882 LEU 115 C 0.0176 0.0099 0.0045 883 LEU 115 O 0.0202 0.0102 -0.0010 884 LEU 115 CB 0.0114 0.0180 0.0047 885 LEU 115 CG 0.0091 0.0201 0.0062 886 LEU 115 CD1 0.0064 0.0263 0.0024 887 LEU 115 CD2 0.0059 0.0195 0.0132 888 ALA 116 N 0.0144 0.0080 0.0117 889 ALA 116 CA 0.0141 0.0084 0.0114 890 ALA 116 C 0.0131 0.0100 0.0150 891 ALA 116 O 0.0136 0.0098 0.0181 892 ALA 116 CB 0.0166 0.0054 0.0110 893 GLU 117 N 0.0128 0.0088 0.0211 894 GLU 117 CA 0.0130 0.0109 0.0225 895 GLU 117 C 0.0128 0.0101 0.0217 896 GLU 117 O 0.0132 0.0111 0.0232 897 GLU 117 CB 0.0122 0.0140 0.0215 898 GLU 117 CG 0.0125 0.0153 0.0229 899 GLU 117 CD 0.0116 0.0178 0.0212 900 GLU 117 OE1 0.0109 0.0171 0.0189 901 GLU 117 OE2 0.0115 0.0204 0.0222 902 GLY 118 N 0.0113 0.0088 0.0127 903 GLY 118 CA 0.0112 0.0056 0.0101 904 GLY 118 C 0.0103 0.0010 0.0099 905 GLY 118 O 0.0104 0.0005 0.0090 906 VAL 119 N 0.0070 -0.0015 0.0025 907 VAL 119 CA 0.0060 -0.0037 0.0024 908 VAL 119 C 0.0054 -0.0045 0.0005 909 VAL 119 O 0.0055 -0.0042 0.0004 910 VAL 119 CB 0.0056 -0.0049 0.0046 911 VAL 119 CG1 0.0045 -0.0072 0.0044 912 VAL 119 CG2 0.0062 -0.0040 0.0066 913 PHE 120 N 0.0040 -0.0039 0.0006 914 PHE 120 CA 0.0033 -0.0034 0.0001 915 PHE 120 C 0.0035 -0.0048 -0.0000 916 PHE 120 O 0.0032 -0.0061 -0.0006 917 PHE 120 CB 0.0019 -0.0030 -0.0011 918 PHE 120 CG 0.0017 -0.0015 -0.0009 919 PHE 120 CD1 0.0019 -0.0016 -0.0008 920 PHE 120 CD2 0.0013 -0.0000 -0.0010 921 PHE 120 CE1 0.0016 -0.0002 -0.0008 922 PHE 120 CE2 0.0010 0.0013 -0.0010 923 PHE 120 CZ 0.0012 0.0012 -0.0008 924 VAL 121 N -0.0016 -0.0102 -0.0088 925 VAL 121 CA -0.0019 -0.0098 -0.0088 926 VAL 121 C -0.0026 -0.0091 -0.0088 927 VAL 121 O -0.0026 -0.0086 -0.0092 928 VAL 121 CB -0.0014 -0.0095 -0.0095 929 VAL 121 CG1 -0.0018 -0.0090 -0.0095 930 VAL 121 CG2 -0.0007 -0.0101 -0.0096 931 TYR 122 N 0.0025 -0.0000 -0.0081 932 TYR 122 CA 0.0015 0.0016 -0.0068 933 TYR 122 C 0.0028 0.0023 -0.0072 934 TYR 122 O 0.0021 0.0015 -0.0072 935 TYR 122 CB -0.0008 0.0006 -0.0060 936 TYR 122 CG -0.0020 -0.0001 -0.0056 937 TYR 122 CD1 -0.0023 0.0014 -0.0047 938 TYR 122 CD2 -0.0026 -0.0024 -0.0063 939 TYR 122 CE1 -0.0033 0.0007 -0.0045 940 TYR 122 CE2 -0.0036 -0.0031 -0.0061 941 TYR 122 CZ -0.0039 -0.0015 -0.0052 942 TYR 122 OH -0.0048 -0.0022 -0.0050 943 LEU 123 N 0.0055 0.0008 -0.0096 944 LEU 123 CA 0.0075 0.0012 -0.0101 945 LEU 123 C 0.0079 0.0046 -0.0088 946 LEU 123 O 0.0088 0.0069 -0.0081 947 LEU 123 CB 0.0110 0.0001 -0.0116 948 LEU 123 CG 0.0110 -0.0034 -0.0130 949 LEU 123 CD1 0.0146 -0.0040 -0.0143 950 LEU 123 CD2 0.0096 -0.0059 -0.0136 951 GLN 124 N 0.0212 0.0093 -0.0019 952 GLN 124 CA 0.0084 0.0230 -0.0138 953 GLN 124 C 0.0240 0.0219 -0.0053 954 GLN 124 O 0.0368 0.0016 0.0092 955 GLN 124 CB -0.0228 0.0088 -0.0245 956 GLN 124 CG -0.0392 0.0142 -0.0351 957 GLN 124 CD -0.0688 -0.0039 -0.0434 958 GLN 124 OE1 -0.0730 -0.0305 -0.0354 959 GLN 124 NE2 -0.0898 0.0110 -0.0601 960 GLY 125 N 0.0392 0.0398 0.0173 961 GLY 125 CA 0.0338 0.0421 0.0099 962 GLY 125 C 0.0338 0.0405 0.0090 963 GLY 125 O 0.0379 0.0385 0.0144 964 SER 126 N 0.0109 0.0089 -0.0088 965 SER 126 CA 0.0026 -0.0108 -0.0217 966 SER 126 C 0.0048 -0.0122 -0.0276 967 SER 126 O -0.0055 -0.0280 -0.0313 968 SER 126 CB -0.0163 -0.0256 -0.0083 969 SER 126 OG -0.0236 -0.0209 0.0119 970 LYS 127 N 0.0155 0.0079 -0.0203 971 LYS 127 CA 0.0187 0.0156 -0.0186 972 LYS 127 C 0.0186 0.0242 -0.0272 973 LYS 127 O 0.0160 0.0239 -0.0344 974 LYS 127 CB 0.0237 0.0201 -0.0088 975 LYS 127 CG 0.0243 0.0122 0.0004 976 LYS 127 CD 0.0246 0.0088 0.0045 977 LYS 127 CE 0.0224 -0.0021 0.0092 978 LYS 127 NZ 0.0180 -0.0085 0.0027 979 LYS 127 OXT 0.0215 0.0317 -0.0265