1 PRO 1 N -0.0015 0.0035 0.0210 2 PRO 1 CA -0.0074 -0.0003 0.0121 3 PRO 1 C -0.0104 -0.0170 0.0051 4 PRO 1 O -0.0041 -0.0287 0.0119 5 PRO 1 CB -0.0014 0.0005 0.0207 6 PRO 1 CG 0.0087 0.0015 0.0349 7 PRO 1 CD 0.0085 -0.0020 0.0341 8 GLU 2 N -0.0082 -0.0268 -0.0179 9 GLU 2 CA -0.0133 -0.0200 -0.0082 10 GLU 2 C -0.0241 -0.0177 -0.0138 11 GLU 2 O -0.0230 -0.0217 -0.0214 12 GLU 2 CB -0.0037 -0.0205 0.0001 13 GLU 2 CG 0.0052 -0.0208 0.0080 14 GLU 2 CD 0.0156 -0.0219 0.0158 15 GLU 2 OE1 0.0185 -0.0182 0.0264 16 GLU 2 OE2 0.0208 -0.0266 0.0107 17 PHE 3 N -0.0129 -0.0130 -0.0060 18 PHE 3 CA -0.0030 -0.0224 -0.0039 19 PHE 3 C 0.0006 -0.0246 -0.0155 20 PHE 3 O 0.0021 -0.0249 -0.0263 21 PHE 3 CB 0.0029 -0.0279 -0.0027 22 PHE 3 CG 0.0006 -0.0271 0.0097 23 PHE 3 CD1 0.0058 -0.0329 0.0208 24 PHE 3 CD2 -0.0066 -0.0205 0.0103 25 PHE 3 CE1 0.0038 -0.0322 0.0323 26 PHE 3 CE2 -0.0086 -0.0197 0.0219 27 PHE 3 CZ -0.0035 -0.0256 0.0328 28 LEU 4 N -0.0180 -0.0003 -0.0115 29 LEU 4 CA -0.0251 0.0003 -0.0088 30 LEU 4 C -0.0247 0.0004 -0.0089 31 LEU 4 O -0.0214 0.0054 -0.0104 32 LEU 4 CB -0.0286 0.0073 -0.0077 33 LEU 4 CG -0.0297 0.0073 -0.0073 34 LEU 4 CD1 -0.0324 0.0150 -0.0065 35 LEU 4 CD2 -0.0349 0.0016 -0.0050 36 GLY 5 N -0.0024 0.0077 -0.0014 37 GLY 5 CA -0.0059 0.0131 0.0003 38 GLY 5 C -0.0110 0.0214 0.0027 39 GLY 5 O -0.0127 0.0219 0.0050 40 GLU 6 N -0.0212 0.0342 0.0072 41 GLU 6 CA -0.0112 0.0239 0.0063 42 GLU 6 C -0.0165 0.0257 -0.0139 43 GLU 6 O -0.0129 0.0221 -0.0136 44 GLU 6 CB 0.0061 0.0063 0.0061 45 GLU 6 CG 0.0136 0.0027 0.0285 46 GLU 6 CD 0.0311 -0.0150 0.0282 47 GLU 6 OE1 0.0410 -0.0223 0.0435 48 GLU 6 OE2 0.0346 -0.0212 0.0133 49 GLU 7 N -0.0167 0.0248 -0.0172 50 GLU 7 CA -0.0249 0.0207 -0.0075 51 GLU 7 C -0.0127 0.0257 -0.0200 52 GLU 7 O -0.0239 0.0272 -0.0189 53 GLU 7 CB -0.0201 0.0052 0.0170 54 GLU 7 CG -0.0330 -0.0001 0.0302 55 GLU 7 CD -0.0354 -0.0146 0.0554 56 GLU 7 OE1 -0.0552 -0.0170 0.0660 57 GLU 7 OE2 -0.0177 -0.0231 0.0639 58 ASP 8 N -0.0188 0.0225 -0.0026 59 ASP 8 CA -0.0156 0.0214 -0.0047 60 ASP 8 C -0.0174 0.0258 -0.0099 61 ASP 8 O -0.0149 0.0255 -0.0124 62 ASP 8 CB -0.0089 0.0178 -0.0069 63 ASP 8 CG -0.0065 0.0129 -0.0016 64 ASP 8 OD1 -0.0081 0.0110 0.0034 65 ASP 8 OD2 -0.0030 0.0109 -0.0027 66 ILE 9 N -0.0139 0.0269 -0.0103 67 ILE 9 CA -0.0126 0.0269 -0.0066 68 ILE 9 C -0.0140 0.0264 -0.0114 69 ILE 9 O -0.0123 0.0222 -0.0158 70 ILE 9 CB -0.0075 0.0224 -0.0024 71 ILE 9 CG1 -0.0063 0.0231 0.0024 72 ILE 9 CG2 -0.0063 0.0228 0.0015 73 ILE 9 CD1 -0.0012 0.0187 0.0066 74 PRO 10 N -0.0160 0.0266 -0.0155 75 PRO 10 CA -0.0133 0.0255 -0.0172 76 PRO 10 C -0.0083 0.0218 -0.0165 77 PRO 10 O -0.0075 0.0194 -0.0121 78 PRO 10 CB -0.0160 0.0260 -0.0141 79 PRO 10 CG -0.0209 0.0288 -0.0124 80 PRO 10 CD -0.0202 0.0280 -0.0117 81 ARG 11 N -0.0070 0.0265 -0.0145 82 ARG 11 CA -0.0042 0.0205 -0.0156 83 ARG 11 C -0.0050 0.0209 -0.0182 84 ARG 11 O -0.0030 0.0163 -0.0196 85 ARG 11 CB -0.0030 0.0160 -0.0200 86 ARG 11 CG -0.0016 0.0149 -0.0167 87 ARG 11 CD -0.0001 0.0098 -0.0209 88 ARG 11 NE 0.0011 0.0089 -0.0178 89 ARG 11 CZ 0.0032 0.0041 -0.0191 90 ARG 11 NH1 0.0045 -0.0004 -0.0235 91 ARG 11 NH2 0.0041 0.0039 -0.0158 92 GLU 12 N -0.0030 0.0321 -0.0036 93 GLU 12 CA 0.0057 0.0231 0.0012 94 GLU 12 C -0.0024 0.0155 -0.0159 95 GLU 12 O -0.0100 0.0086 -0.0319 96 GLU 12 CB 0.0216 0.0061 0.0100 97 GLU 12 CG 0.0305 0.0143 0.0289 98 GLU 12 CD 0.0473 -0.0014 0.0398 99 GLU 12 OE1 0.0556 0.0050 0.0564 100 GLU 12 OE2 0.0515 -0.0193 0.0316 101 PRO 13 N -0.0050 0.0157 -0.0101 102 PRO 13 CA -0.0051 0.0151 -0.0094 103 PRO 13 C -0.0044 0.0193 -0.0090 104 PRO 13 O -0.0041 0.0220 -0.0118 105 PRO 13 CB -0.0056 0.0125 -0.0131 106 PRO 13 CG -0.0060 0.0103 -0.0148 107 PRO 13 CD -0.0055 0.0136 -0.0140 108 ARG 14 N -0.0077 0.0152 0.0053 109 ARG 14 CA -0.0089 0.0178 0.0069 110 ARG 14 C -0.0074 0.0211 0.0097 111 ARG 14 O -0.0042 0.0210 0.0105 112 ARG 14 CB -0.0076 0.0166 0.0063 113 ARG 14 CG -0.0031 0.0158 0.0070 114 ARG 14 CD -0.0021 0.0138 0.0057 115 ARG 14 NE 0.0021 0.0133 0.0065 116 ARG 14 CZ 0.0050 0.0111 0.0058 117 ARG 14 NH1 0.0045 0.0090 0.0040 118 ARG 14 NH2 0.0086 0.0112 0.0068 119 ARG 15 N -0.0100 0.0325 0.0217 120 ARG 15 CA -0.0091 0.0450 0.0056 121 ARG 15 C 0.0132 0.0568 0.0200 122 ARG 15 O 0.0315 0.0715 0.0250 123 ARG 15 CB -0.0115 0.0619 -0.0212 124 ARG 15 CG -0.0104 0.0756 -0.0390 125 ARG 15 CD -0.0146 0.0910 -0.0662 126 ARG 15 NE -0.0142 0.1040 -0.0838 127 ARG 15 CZ 0.0036 0.1248 -0.0882 128 ARG 15 NH1 0.0235 0.1370 -0.0775 129 ARG 15 NH2 0.0015 0.1336 -0.1033 130 ILE 16 N -0.0035 0.0338 0.0227 131 ILE 16 CA 0.0002 0.0354 0.0249 132 ILE 16 C 0.0012 0.0401 0.0280 133 ILE 16 O 0.0019 0.0408 0.0287 134 ILE 16 CB 0.0052 0.0318 0.0244 135 ILE 16 CG1 0.0040 0.0270 0.0211 136 ILE 16 CG2 0.0090 0.0335 0.0267 137 ILE 16 CD1 0.0085 0.0231 0.0202 138 VAL 17 N 0.0085 0.0469 0.0275 139 VAL 17 CA 0.0080 0.0456 0.0222 140 VAL 17 C 0.0068 0.0455 0.0241 141 VAL 17 O 0.0101 0.0474 0.0267 142 VAL 17 CB 0.0131 0.0470 0.0179 143 VAL 17 CG1 0.0123 0.0455 0.0123 144 VAL 17 CG2 0.0141 0.0470 0.0160 145 ILE 18 N -0.0057 0.0081 0.0104 146 ILE 18 CA -0.0061 0.0084 0.0065 147 ILE 18 C -0.0061 0.0080 0.0084 148 ILE 18 O -0.0044 0.0100 0.0116 149 ILE 18 CB -0.0043 0.0126 0.0033 150 ILE 18 CG1 -0.0043 0.0130 0.0015 151 ILE 18 CG2 -0.0048 0.0128 -0.0009 152 ILE 18 CD1 -0.0025 0.0170 -0.0015 153 HIS 19 N -0.0093 -0.0023 -0.0038 154 HIS 19 CA -0.0103 -0.0051 -0.0035 155 HIS 19 C -0.0117 -0.0017 -0.0079 156 HIS 19 O -0.0143 -0.0008 -0.0126 157 HIS 19 CB -0.0132 -0.0116 -0.0039 158 HIS 19 CG -0.0117 -0.0151 0.0007 159 HIS 19 ND1 -0.0090 -0.0168 0.0060 160 HIS 19 CD2 -0.0125 -0.0168 0.0006 161 HIS 19 CE1 -0.0083 -0.0196 0.0089 162 HIS 19 NE2 -0.0104 -0.0197 0.0058 163 ARG 20 N -0.0099 -0.0119 -0.0035 164 ARG 20 CA -0.0150 -0.0106 -0.0056 165 ARG 20 C -0.0124 -0.0116 -0.0101 166 ARG 20 O -0.0095 -0.0128 -0.0151 167 ARG 20 CB -0.0203 -0.0094 -0.0090 168 ARG 20 CG -0.0262 -0.0078 -0.0106 169 ARG 20 CD -0.0313 -0.0067 -0.0145 170 ARG 20 NE -0.0336 -0.0058 -0.0107 171 ARG 20 CZ -0.0382 -0.0042 -0.0063 172 ARG 20 NH1 -0.0412 -0.0032 -0.0044 173 ARG 20 NH2 -0.0398 -0.0036 -0.0037 174 GLY 21 N -0.0048 -0.0121 -0.0185 175 GLY 21 CA 0.0008 -0.0095 -0.0172 176 GLY 21 C -0.0040 -0.0111 -0.0197 177 GLY 21 O -0.0118 -0.0143 -0.0226 178 SER 22 N 0.0192 0.0048 -0.0189 179 SER 22 CA 0.0008 -0.0119 -0.0179 180 SER 22 C -0.0288 -0.0458 0.0089 181 SER 22 O -0.0542 -0.0659 -0.0011 182 SER 22 CB 0.0264 0.0056 0.0022 183 SER 22 OG 0.0449 0.0108 0.0441 184 THR 23 N -0.0070 -0.0290 0.0219 185 THR 23 CA -0.0070 -0.0375 0.0237 186 THR 23 C -0.0068 -0.0423 0.0136 187 THR 23 O -0.0069 -0.0482 0.0138 188 THR 23 CB -0.0071 -0.0337 0.0307 189 THR 23 OG1 -0.0070 -0.0249 0.0262 190 THR 23 CG2 -0.0073 -0.0304 0.0416 191 GLY 24 N -0.0098 -0.0276 -0.0100 192 GLY 24 CA -0.0075 -0.0289 -0.0158 193 GLY 24 C -0.0040 -0.0215 -0.0173 194 GLY 24 O -0.0020 -0.0157 -0.0169 195 LEU 25 N -0.0045 -0.0006 -0.0115 196 LEU 25 CA -0.0062 -0.0077 -0.0071 197 LEU 25 C -0.0033 -0.0134 -0.0103 198 LEU 25 O -0.0038 -0.0202 -0.0079 199 LEU 25 CB -0.0108 -0.0052 -0.0003 200 LEU 25 CG -0.0142 -0.0006 0.0039 201 LEU 25 CD1 -0.0184 0.0024 0.0099 202 LEU 25 CD2 -0.0151 -0.0057 0.0065 203 GLY 26 N 0.0004 -0.0158 -0.0133 204 GLY 26 CA -0.0000 -0.0154 -0.0137 205 GLY 26 C 0.0001 -0.0143 -0.0131 206 GLY 26 O 0.0001 -0.0142 -0.0131 207 PHE 27 N 0.0073 -0.0114 -0.0060 208 PHE 27 CA 0.0085 -0.0136 -0.0091 209 PHE 27 C 0.0128 -0.0099 -0.0082 210 PHE 27 O 0.0137 -0.0057 -0.0044 211 PHE 27 CB 0.0030 -0.0165 -0.0084 212 PHE 27 CG 0.0001 -0.0137 -0.0033 213 PHE 27 CD1 -0.0042 -0.0131 0.0003 214 PHE 27 CD2 0.0017 -0.0117 -0.0023 215 PHE 27 CE1 -0.0071 -0.0106 0.0049 216 PHE 27 CE2 -0.0011 -0.0092 0.0023 217 PHE 27 CZ -0.0055 -0.0087 0.0059 218 ASN 28 N 0.0250 -0.0174 -0.0110 219 ASN 28 CA 0.0321 -0.0167 -0.0111 220 ASN 28 C 0.0317 -0.0179 -0.0148 221 ASN 28 O 0.0273 -0.0198 -0.0195 222 ASN 28 CB 0.0379 -0.0172 -0.0145 223 ASN 28 CG 0.0393 -0.0159 -0.0107 224 ASN 28 OD1 0.0379 -0.0141 -0.0045 225 ASN 28 ND2 0.0424 -0.0167 -0.0142 226 ILE 29 N 0.0205 -0.0210 -0.0158 227 ILE 29 CA 0.0161 -0.0230 -0.0140 228 ILE 29 C 0.0179 -0.0235 -0.0148 229 ILE 29 O 0.0217 -0.0206 -0.0163 230 ILE 29 CB 0.0114 -0.0192 -0.0117 231 ILE 29 CG1 0.0126 -0.0129 -0.0118 232 ILE 29 CG2 0.0092 -0.0197 -0.0108 233 ILE 29 CD1 0.0078 -0.0092 -0.0094 234 VAL 30 N 0.0209 -0.0179 -0.0133 235 VAL 30 CA 0.0198 -0.0156 -0.0127 236 VAL 30 C 0.0160 -0.0153 -0.0081 237 VAL 30 O 0.0145 -0.0176 -0.0054 238 VAL 30 CB 0.0218 -0.0187 -0.0143 239 VAL 30 CG1 0.0255 -0.0184 -0.0191 240 VAL 30 CG2 0.0215 -0.0244 -0.0122 241 GLY 31 N 0.0072 -0.0205 -0.0057 242 GLY 31 CA 0.0067 -0.0191 -0.0018 243 GLY 31 C 0.0052 -0.0188 -0.0042 244 GLY 31 O 0.0035 -0.0189 -0.0088 245 GLY 32 N 0.0063 -0.0174 0.0003 246 GLY 32 CA 0.0048 -0.0157 0.0002 247 GLY 32 C 0.0041 -0.0158 0.0003 248 GLY 32 O 0.0031 -0.0143 0.0002 249 GLU 33 N 0.0025 -0.0210 0.0003 250 GLU 33 CA -0.0020 -0.0174 0.0028 251 GLU 33 C 0.0018 -0.0144 0.0080 252 GLU 33 O 0.0065 -0.0138 0.0108 253 GLU 33 CB -0.0078 -0.0147 0.0035 254 GLU 33 CG -0.0118 -0.0178 -0.0019 255 GLU 33 CD -0.0175 -0.0155 -0.0015 256 GLU 33 OE1 -0.0205 -0.0179 -0.0059 257 GLU 33 OE2 -0.0187 -0.0113 0.0030 258 ASP 34 N 0.0102 -0.0110 0.0127 259 ASP 34 CA 0.0198 -0.0017 0.0156 260 ASP 34 C 0.0299 -0.0028 0.0178 261 ASP 34 O 0.0364 0.0060 0.0199 262 ASP 34 CB 0.0139 0.0111 0.0153 263 ASP 34 CG 0.0055 0.0120 0.0135 264 ASP 34 OD1 0.0085 0.0058 0.0136 265 ASP 34 OD2 -0.0036 0.0187 0.0119 266 GLY 35 N 0.0174 -0.0112 0.0165 267 GLY 35 CA 0.0157 -0.0121 0.0172 268 GLY 35 C 0.0157 -0.0141 0.0165 269 GLY 35 O 0.0143 -0.0151 0.0170 270 GLU 36 N 0.0164 -0.0139 0.0108 271 GLU 36 CA 0.0165 -0.0128 0.0114 272 GLU 36 C 0.0181 -0.0155 0.0105 273 GLU 36 O 0.0195 -0.0149 0.0113 274 GLU 36 CB 0.0129 -0.0115 0.0110 275 GLU 36 CG 0.0114 -0.0085 0.0121 276 GLU 36 CD 0.0083 -0.0068 0.0120 277 GLU 36 OE1 0.0077 -0.0039 0.0135 278 GLU 36 OE2 0.0067 -0.0083 0.0107 279 GLY 37 N 0.0137 -0.0156 0.0103 280 GLY 37 CA 0.0140 -0.0178 0.0099 281 GLY 37 C 0.0132 -0.0185 0.0076 282 GLY 37 O 0.0125 -0.0173 0.0063 283 ILE 38 N 0.0076 -0.0152 0.0071 284 ILE 38 CA 0.0085 -0.0157 0.0045 285 ILE 38 C 0.0113 -0.0168 0.0057 286 ILE 38 O 0.0135 -0.0177 0.0067 287 ILE 38 CB 0.0091 -0.0161 0.0013 288 ILE 38 CG1 0.0064 -0.0150 0.0002 289 ILE 38 CG2 0.0100 -0.0165 -0.0014 290 ILE 38 CD1 0.0034 -0.0138 -0.0005 291 PHE 39 N 0.0188 -0.0122 -0.0030 292 PHE 39 CA 0.0213 -0.0141 -0.0023 293 PHE 39 C 0.0241 -0.0134 -0.0041 294 PHE 39 O 0.0242 -0.0119 -0.0054 295 PHE 39 CB 0.0211 -0.0161 -0.0004 296 PHE 39 CG 0.0186 -0.0170 0.0015 297 PHE 39 CD1 0.0187 -0.0188 0.0031 298 PHE 39 CD2 0.0160 -0.0160 0.0016 299 PHE 39 CE1 0.0163 -0.0197 0.0048 300 PHE 39 CE2 0.0135 -0.0168 0.0034 301 PHE 39 CZ 0.0137 -0.0187 0.0050 302 ILE 40 N 0.0263 -0.0060 -0.0058 303 ILE 40 CA 0.0238 -0.0073 -0.0068 304 ILE 40 C 0.0255 -0.0063 -0.0134 305 ILE 40 O 0.0240 -0.0069 -0.0183 306 ILE 40 CB 0.0172 -0.0106 -0.0062 307 ILE 40 CG1 0.0152 -0.0117 0.0003 308 ILE 40 CG2 0.0146 -0.0120 -0.0073 309 ILE 40 CD1 0.0174 -0.0107 0.0062 310 SER 41 N 0.0383 -0.0101 -0.0253 311 SER 41 CA 0.0406 -0.0086 -0.0331 312 SER 41 C 0.0328 -0.0102 -0.0345 313 SER 41 O 0.0314 -0.0095 -0.0427 314 SER 41 CB 0.0506 -0.0067 -0.0308 315 SER 41 OG 0.0507 -0.0078 -0.0214 316 PHE 42 N 0.0220 -0.0094 -0.0309 317 PHE 42 CA 0.0145 -0.0110 -0.0305 318 PHE 42 C 0.0086 -0.0142 -0.0242 319 PHE 42 O 0.0115 -0.0158 -0.0178 320 PHE 42 CB 0.0175 -0.0112 -0.0282 321 PHE 42 CG 0.0104 -0.0130 -0.0268 322 PHE 42 CD1 0.0081 -0.0161 -0.0187 323 PHE 42 CD2 0.0059 -0.0117 -0.0335 324 PHE 42 CE1 0.0014 -0.0179 -0.0174 325 PHE 42 CE2 -0.0008 -0.0134 -0.0322 326 PHE 42 CZ -0.0030 -0.0165 -0.0242 327 ILE 43 N -0.0040 -0.0100 -0.0154 328 ILE 43 CA -0.0037 -0.0113 -0.0155 329 ILE 43 C -0.0041 -0.0118 -0.0169 330 ILE 43 O -0.0044 -0.0117 -0.0174 331 ILE 43 CB -0.0032 -0.0121 -0.0147 332 ILE 43 CG1 -0.0028 -0.0116 -0.0133 333 ILE 43 CG2 -0.0029 -0.0136 -0.0149 334 ILE 43 CD1 -0.0023 -0.0123 -0.0124 335 LEU 44 N -0.0043 -0.0112 -0.0132 336 LEU 44 CA -0.0061 -0.0115 -0.0120 337 LEU 44 C -0.0026 -0.0082 -0.0114 338 LEU 44 O 0.0010 -0.0082 -0.0144 339 LEU 44 CB -0.0074 -0.0158 -0.0155 340 LEU 44 CG -0.0092 -0.0166 -0.0148 341 LEU 44 CD1 -0.0138 -0.0165 -0.0109 342 LEU 44 CD2 -0.0099 -0.0207 -0.0186 343 ALA 45 N 0.0026 -0.0047 -0.0092 344 ALA 45 CA 0.0062 0.0000 -0.0078 345 ALA 45 C 0.0076 -0.0006 -0.0110 346 ALA 45 O 0.0046 -0.0038 -0.0109 347 ALA 45 CB 0.0042 0.0025 -0.0013 348 GLY 46 N 0.0211 -0.0005 -0.0118 349 GLY 46 CA 0.0244 -0.0019 -0.0177 350 GLY 46 C 0.0221 -0.0031 -0.0230 351 GLY 46 O 0.0244 -0.0044 -0.0282 352 GLY 47 N 0.0032 -0.0045 -0.0162 353 GLY 47 CA 0.0016 -0.0070 -0.0219 354 GLY 47 C 0.0055 -0.0055 -0.0255 355 GLY 47 O 0.0089 -0.0029 -0.0230 356 PRO 48 N 0.0022 0.0006 -0.0234 357 PRO 48 CA 0.0043 0.0009 -0.0247 358 PRO 48 C 0.0051 0.0020 -0.0236 359 PRO 48 O 0.0072 0.0030 -0.0237 360 PRO 48 CB 0.0038 -0.0008 -0.0268 361 PRO 48 CG 0.0020 -0.0019 -0.0271 362 PRO 48 CD 0.0006 -0.0011 -0.0247 363 ALA 49 N 0.0037 0.0003 -0.0180 364 ALA 49 CA 0.0028 -0.0006 -0.0152 365 ALA 49 C 0.0064 0.0007 -0.0100 366 ALA 49 O 0.0083 0.0016 -0.0091 367 ALA 49 CB -0.0026 -0.0037 -0.0135 368 ASP 50 N 0.0120 0.0021 -0.0160 369 ASP 50 CA 0.0195 0.0013 -0.0081 370 ASP 50 C 0.0301 0.0029 -0.0108 371 ASP 50 O 0.0351 0.0022 -0.0050 372 ASP 50 CB 0.0194 0.0010 -0.0067 373 ASP 50 CG 0.0260 0.0000 0.0021 374 ASP 50 OD1 0.0253 -0.0016 0.0102 375 ASP 50 OD2 0.0312 0.0008 0.0008 376 LEU 51 N 0.0345 0.0014 -0.0075 377 LEU 51 CA 0.0554 0.0082 -0.0162 378 LEU 51 C 0.0587 0.0097 -0.0207 379 LEU 51 O 0.0770 0.0145 -0.0203 380 LEU 51 CB 0.0585 0.0122 -0.0374 381 LEU 51 CG 0.0608 0.0123 -0.0340 382 LEU 51 CD1 0.0618 0.0159 -0.0565 383 LEU 51 CD2 0.0810 0.0156 -0.0205 384 SER 52 N 0.0260 0.0081 -0.0152 385 SER 52 CA 0.0286 0.0078 -0.0118 386 SER 52 C 0.0317 0.0079 -0.0027 387 SER 52 O 0.0367 0.0071 0.0000 388 SER 52 CB 0.0217 0.0092 -0.0126 389 SER 52 OG 0.0156 0.0109 -0.0064 390 GLY 53 N 0.0364 0.0109 -0.0062 391 GLY 53 CA 0.0372 0.0090 -0.0021 392 GLY 53 C 0.0330 0.0059 -0.0034 393 GLY 53 O 0.0332 0.0039 0.0000 394 GLU 54 N 0.0286 0.0130 -0.0021 395 GLU 54 CA 0.0216 0.0109 0.0000 396 GLU 54 C 0.0216 0.0117 0.0000 397 GLU 54 O 0.0177 0.0075 0.0012 398 GLU 54 CB 0.0155 0.0157 0.0019 399 GLU 54 CG 0.0145 0.0145 0.0022 400 GLU 54 CD 0.0078 0.0189 0.0042 401 GLU 54 OE1 0.0038 0.0156 0.0055 402 GLU 54 OE2 0.0068 0.0255 0.0045 403 LEU 55 N 0.0091 0.0006 0.0024 404 LEU 55 CA 0.0077 0.0010 0.0026 405 LEU 55 C 0.0067 0.0019 0.0034 406 LEU 55 O 0.0064 0.0018 0.0032 407 LEU 55 CB 0.0068 0.0002 0.0013 408 LEU 55 CG 0.0056 0.0005 0.0014 409 LEU 55 CD1 0.0064 0.0006 0.0017 410 LEU 55 CD2 0.0046 -0.0003 0.0002 411 ARG 56 N 0.0063 -0.0090 -0.0006 412 ARG 56 CA 0.0030 -0.0060 0.0030 413 ARG 56 C 0.0022 -0.0122 0.0042 414 ARG 56 O 0.0054 -0.0172 0.0006 415 ARG 56 CB 0.0054 0.0012 0.0001 416 ARG 56 CG 0.0061 0.0077 -0.0009 417 ARG 56 CD 0.0085 0.0148 -0.0038 418 ARG 56 NE 0.0094 0.0209 -0.0049 419 ARG 56 CZ 0.0080 0.0282 -0.0035 420 ARG 56 NH1 0.0055 0.0311 -0.0007 421 ARG 56 NH2 0.0091 0.0330 -0.0049 422 LYS 57 N -0.0182 -0.0681 -0.0136 423 LYS 57 CA 0.0030 -0.0157 -0.0299 424 LYS 57 C 0.0216 0.0099 -0.0123 425 LYS 57 O 0.0110 -0.0067 -0.0191 426 LYS 57 CB -0.0110 -0.0061 -0.0890 427 LYS 57 CG 0.0106 0.0485 -0.1078 428 LYS 57 CD -0.0035 0.0580 -0.1667 429 LYS 57 CE 0.0193 0.1132 -0.1829 430 LYS 57 NZ 0.0076 0.1261 -0.2398 431 GLY 58 N 0.0239 0.0027 -0.0066 432 GLY 58 CA 0.0214 0.0020 -0.0042 433 GLY 58 C 0.0181 0.0025 -0.0007 434 GLY 58 O 0.0160 0.0027 0.0016 435 ASP 59 N 0.0136 -0.0068 0.0029 436 ASP 59 CA 0.0144 -0.0072 0.0031 437 ASP 59 C 0.0167 -0.0083 0.0037 438 ASP 59 O 0.0172 -0.0093 0.0051 439 ASP 59 CB 0.0128 -0.0076 0.0048 440 ASP 59 CG 0.0107 -0.0065 0.0041 441 ASP 59 OD1 0.0106 -0.0054 0.0023 442 ASP 59 OD2 0.0091 -0.0067 0.0055 443 ARG 60 N 0.0140 -0.0128 0.0064 444 ARG 60 CA 0.0149 -0.0129 0.0069 445 ARG 60 C 0.0143 -0.0126 0.0080 446 ARG 60 O 0.0132 -0.0124 0.0079 447 ARG 60 CB 0.0151 -0.0131 0.0058 448 ARG 60 CG 0.0161 -0.0132 0.0063 449 ARG 60 CD 0.0164 -0.0135 0.0052 450 ARG 60 NE 0.0174 -0.0136 0.0056 451 ARG 60 CZ 0.0178 -0.0138 0.0049 452 ARG 60 NH1 0.0174 -0.0139 0.0038 453 ARG 60 NH2 0.0187 -0.0139 0.0054 454 ILE 61 N 0.0071 -0.0109 0.0085 455 ILE 61 CA 0.0060 -0.0102 0.0114 456 ILE 61 C 0.0062 -0.0099 0.0121 457 ILE 61 O 0.0086 -0.0096 0.0120 458 ILE 61 CB 0.0076 -0.0092 0.0136 459 ILE 61 CG1 0.0074 -0.0095 0.0128 460 ILE 61 CG2 0.0061 -0.0084 0.0165 461 ILE 61 CD1 0.0089 -0.0085 0.0150 462 ILE 62 N 0.0049 -0.0102 0.0114 463 ILE 62 CA 0.0038 -0.0104 0.0104 464 ILE 62 C 0.0039 -0.0087 0.0130 465 ILE 62 O 0.0050 -0.0092 0.0130 466 ILE 62 CB 0.0006 -0.0102 0.0085 467 ILE 62 CG1 0.0004 -0.0118 0.0059 468 ILE 62 CG2 -0.0007 -0.0103 0.0075 469 ILE 62 CD1 0.0026 -0.0140 0.0039 470 SER 63 N 0.0012 0.0045 0.0176 471 SER 63 CA 0.0014 0.0033 0.0183 472 SER 63 C 0.0003 0.0049 0.0222 473 SER 63 O -0.0008 0.0080 0.0236 474 SER 63 CB 0.0017 0.0045 0.0147 475 SER 63 OG 0.0006 0.0086 0.0142 476 VAL 64 N -0.0059 0.0096 0.0231 477 VAL 64 CA -0.0084 0.0082 0.0253 478 VAL 64 C -0.0064 0.0054 0.0244 479 VAL 64 O -0.0045 0.0020 0.0237 480 VAL 64 CB -0.0111 0.0056 0.0279 481 VAL 64 CG1 -0.0136 0.0038 0.0302 482 VAL 64 CG2 -0.0134 0.0086 0.0290 483 ASN 65 N -0.0060 0.0166 0.0263 484 ASN 65 CA -0.0033 0.0162 0.0212 485 ASN 65 C -0.0008 0.0149 0.0158 486 ASN 65 O 0.0011 0.0189 0.0146 487 ASN 65 CB -0.0049 0.0117 0.0215 488 ASN 65 CG -0.0069 0.0139 0.0263 489 ASN 65 OD1 -0.0063 0.0193 0.0283 490 ASN 65 ND2 -0.0093 0.0096 0.0282 491 SER 66 N -0.0115 0.0188 0.0282 492 SER 66 CA 0.0132 0.0046 -0.0129 493 SER 66 C 0.0425 -0.0300 -0.0229 494 SER 66 O 0.0661 -0.0481 -0.0525 495 SER 66 CB 0.0197 -0.0062 -0.0084 496 SER 66 OG -0.0076 0.0252 0.0027 497 VAL 67 N 0.0039 -0.0074 0.0123 498 VAL 67 CA 0.0013 -0.0102 0.0137 499 VAL 67 C 0.0012 -0.0063 0.0162 500 VAL 67 O -0.0001 -0.0029 0.0197 501 VAL 67 CB -0.0031 -0.0136 0.0166 502 VAL 67 CG1 -0.0057 -0.0168 0.0177 503 VAL 67 CG2 -0.0030 -0.0174 0.0142 504 ASP 68 N 0.0057 -0.0084 0.0155 505 ASP 68 CA 0.0053 -0.0074 0.0179 506 ASP 68 C 0.0030 -0.0064 0.0178 507 ASP 68 O 0.0012 -0.0059 0.0169 508 ASP 68 CB 0.0054 -0.0069 0.0196 509 ASP 68 CG 0.0054 -0.0059 0.0222 510 ASP 68 OD1 0.0049 -0.0055 0.0229 511 ASP 68 OD2 0.0061 -0.0057 0.0238 512 LEU 69 N 0.0014 -0.0075 0.0138 513 LEU 69 CA 0.0012 -0.0077 0.0143 514 LEU 69 C 0.0020 -0.0064 0.0122 515 LEU 69 O 0.0017 -0.0063 0.0124 516 LEU 69 CB -0.0014 -0.0072 0.0160 517 LEU 69 CG -0.0023 -0.0086 0.0184 518 LEU 69 CD1 -0.0048 -0.0081 0.0199 519 LEU 69 CD2 -0.0007 -0.0110 0.0196 520 ARG 70 N 0.0084 -0.0070 0.0177 521 ARG 70 CA 0.0084 -0.0080 0.0168 522 ARG 70 C 0.0103 -0.0039 0.0160 523 ARG 70 O 0.0113 -0.0045 0.0133 524 ARG 70 CB 0.0059 -0.0100 0.0206 525 ARG 70 CG 0.0041 -0.0148 0.0207 526 ARG 70 CD 0.0016 -0.0169 0.0245 527 ARG 70 NE 0.0005 -0.0148 0.0287 528 ARG 70 CZ -0.0016 -0.0158 0.0326 529 ARG 70 NH1 -0.0029 -0.0187 0.0330 530 ARG 70 NH2 -0.0024 -0.0137 0.0361 531 ALA 71 N 0.0122 -0.0101 0.0195 532 ALA 71 CA 0.0122 -0.0076 0.0193 533 ALA 71 C 0.0093 -0.0109 0.0184 534 ALA 71 O 0.0101 -0.0103 0.0186 535 ALA 71 CB 0.0176 -0.0065 0.0214 536 ALA 72 N 0.0035 -0.0127 0.0157 537 ALA 72 CA 0.0036 -0.0123 0.0151 538 ALA 72 C 0.0038 -0.0105 0.0122 539 ALA 72 O 0.0034 -0.0107 0.0102 540 ALA 72 CB 0.0023 -0.0150 0.0149 541 SER 73 N -0.0007 -0.0083 0.0056 542 SER 73 CA -0.0015 -0.0055 0.0003 543 SER 73 C -0.0040 -0.0096 -0.0038 544 SER 73 O -0.0050 -0.0144 -0.0023 545 SER 73 CB 0.0000 -0.0013 0.0009 546 SER 73 OG -0.0008 -0.0036 0.0005 547 HIS 74 N -0.0037 -0.0144 -0.0122 548 HIS 74 CA -0.0026 -0.0167 -0.0164 549 HIS 74 C -0.0024 -0.0155 -0.0166 550 HIS 74 O -0.0024 -0.0188 -0.0174 551 HIS 74 CB -0.0011 -0.0150 -0.0208 552 HIS 74 CG 0.0001 -0.0178 -0.0251 553 HIS 74 ND1 0.0003 -0.0221 -0.0267 554 HIS 74 CD2 0.0010 -0.0168 -0.0279 555 HIS 74 CE1 0.0014 -0.0236 -0.0305 556 HIS 74 NE2 0.0018 -0.0205 -0.0313 557 GLU 75 N -0.0057 -0.0113 -0.0114 558 GLU 75 CA -0.0055 -0.0101 -0.0064 559 GLU 75 C -0.0098 -0.0158 0.0036 560 GLU 75 O -0.0125 -0.0201 0.0053 561 GLU 75 CB 0.0002 0.0002 -0.0032 562 GLU 75 CG 0.0051 0.0069 -0.0125 563 GLU 75 CD 0.0066 0.0088 -0.0165 564 GLU 75 OE1 0.0092 0.0116 -0.0259 565 GLU 75 OE2 0.0050 0.0071 -0.0104 566 GLN 76 N -0.0056 -0.0114 0.0035 567 GLN 76 CA -0.0123 -0.0149 0.0120 568 GLN 76 C -0.0232 -0.0214 0.0089 569 GLN 76 O -0.0292 -0.0245 0.0164 570 GLN 76 CB -0.0102 -0.0136 0.0126 571 GLN 76 CG -0.0003 -0.0075 0.0184 572 GLN 76 CD 0.0020 -0.0062 0.0181 573 GLN 76 OE1 -0.0004 -0.0080 0.0103 574 GLN 76 NE2 0.0069 -0.0029 0.0266 575 ALA 77 N -0.0159 -0.0176 0.0044 576 ALA 77 CA -0.0224 -0.0158 0.0034 577 ALA 77 C -0.0275 -0.0178 0.0077 578 ALA 77 O -0.0318 -0.0186 0.0100 579 ALA 77 CB -0.0236 -0.0117 -0.0023 580 ALA 78 N -0.0331 -0.0204 0.0002 581 ALA 78 CA -0.0331 -0.0196 0.0039 582 ALA 78 C -0.0360 -0.0168 0.0214 583 ALA 78 O -0.0448 -0.0195 0.0264 584 ALA 78 CB -0.0184 -0.0147 -0.0027 585 ALA 79 N -0.0393 -0.0148 0.0151 586 ALA 79 CA -0.0428 -0.0074 0.0204 587 ALA 79 C -0.0513 -0.0093 0.0228 588 ALA 79 O -0.0523 -0.0052 0.0254 589 ALA 79 CB -0.0438 -0.0027 0.0233 590 ALA 80 N -0.0541 -0.0146 0.0247 591 ALA 80 CA -0.0549 -0.0132 0.0239 592 ALA 80 C -0.0554 -0.0119 0.0249 593 ALA 80 O -0.0559 -0.0109 0.0252 594 ALA 80 CB -0.0549 -0.0133 0.0222 595 LEU 81 N -0.0398 0.0018 0.0185 596 LEU 81 CA -0.0386 0.0017 0.0184 597 LEU 81 C -0.0385 0.0018 0.0171 598 LEU 81 O -0.0374 0.0018 0.0166 599 LEU 81 CB -0.0387 0.0015 0.0195 600 LEU 81 CG -0.0385 0.0013 0.0209 601 LEU 81 CD1 -0.0389 0.0012 0.0219 602 LEU 81 CD2 -0.0371 0.0011 0.0211 603 LYS 82 N -0.0485 -0.0057 0.0249 604 LYS 82 CA -0.0454 0.0009 0.0144 605 LYS 82 C -0.0456 0.0064 0.0064 606 LYS 82 O -0.0373 0.0097 -0.0005 607 LYS 82 CB -0.0541 0.0038 0.0124 608 LYS 82 CG -0.0510 0.0104 0.0018 609 LYS 82 CD -0.0597 0.0129 0.0004 610 LYS 82 CE -0.0568 0.0197 -0.0103 611 LYS 82 NZ -0.0653 0.0223 -0.0119 612 ASN 83 N -0.0498 0.0158 0.0085 613 ASN 83 CA -0.0561 0.0230 0.0100 614 ASN 83 C -0.0542 0.0100 0.0160 615 ASN 83 O -0.0569 0.0146 0.0157 616 ASN 83 CB -0.0720 0.0329 0.0183 617 ASN 83 CG -0.0742 0.0477 0.0116 618 ASN 83 OD1 -0.0654 0.0545 -0.0005 619 ASN 83 ND2 -0.0864 0.0533 0.0192 620 ALA 84 N -0.0469 0.0062 0.0118 621 ALA 84 CA -0.0422 0.0025 0.0133 622 ALA 84 C -0.0387 0.0006 0.0078 623 ALA 84 O -0.0388 0.0011 0.0042 624 ALA 84 CB -0.0407 0.0009 0.0181 625 GLY 85 N -0.0373 0.0039 0.0044 626 GLY 85 CA -0.0332 -0.0012 -0.0038 627 GLY 85 C -0.0294 -0.0038 -0.0042 628 GLY 85 O -0.0318 -0.0009 0.0000 629 GLN 86 N -0.0270 -0.0037 -0.0116 630 GLN 86 CA -0.0197 -0.0112 -0.0154 631 GLN 86 C -0.0125 -0.0158 -0.0012 632 GLN 86 O -0.0105 -0.0175 -0.0005 633 GLN 86 CB -0.0119 -0.0206 -0.0274 634 GLN 86 CG -0.0184 -0.0171 -0.0437 635 GLN 86 CD -0.0235 -0.0134 -0.0506 636 GLN 86 OE1 -0.0211 -0.0147 -0.0449 637 GLN 86 NE2 -0.0308 -0.0084 -0.0630 638 THR 87 N -0.0130 -0.0128 0.0038 639 THR 87 CA -0.0080 -0.0084 0.0089 640 THR 87 C -0.0070 -0.0013 0.0133 641 THR 87 O -0.0040 -0.0023 0.0145 642 THR 87 CB 0.0002 -0.0140 0.0104 643 THR 87 OG1 -0.0009 -0.0207 0.0061 644 THR 87 CG2 0.0053 -0.0097 0.0155 645 VAL 88 N -0.0084 0.0052 0.0158 646 VAL 88 CA -0.0101 0.0079 0.0187 647 VAL 88 C -0.0042 0.0139 0.0226 648 VAL 88 O -0.0040 0.0182 0.0263 649 VAL 88 CB -0.0189 0.0091 0.0218 650 VAL 88 CG1 -0.0208 0.0111 0.0241 651 VAL 88 CG2 -0.0247 0.0031 0.0179 652 THR 89 N -0.0041 0.0171 0.0215 653 THR 89 CA -0.0022 0.0214 0.0186 654 THR 89 C -0.0028 0.0182 0.0190 655 THR 89 O -0.0024 0.0126 0.0166 656 THR 89 CB 0.0010 0.0225 0.0118 657 THR 89 OG1 0.0016 0.0258 0.0114 658 THR 89 CG2 0.0030 0.0269 0.0087 659 ILE 90 N -0.0060 0.0161 0.0209 660 ILE 90 CA -0.0062 0.0136 0.0212 661 ILE 90 C -0.0059 0.0152 0.0188 662 ILE 90 O -0.0057 0.0185 0.0190 663 ILE 90 CB -0.0064 0.0131 0.0253 664 ILE 90 CG1 -0.0067 0.0115 0.0276 665 ILE 90 CG2 -0.0067 0.0105 0.0256 666 ILE 90 CD1 -0.0069 0.0110 0.0318 667 ILE 91 N -0.0043 0.0177 0.0152 668 ILE 91 CA -0.0066 0.0156 0.0093 669 ILE 91 C -0.0035 0.0073 0.0133 670 ILE 91 O -0.0018 -0.0004 0.0140 671 ILE 91 CB -0.0107 0.0131 -0.0004 672 ILE 91 CG1 -0.0137 0.0208 -0.0042 673 ILE 91 CG2 -0.0131 0.0116 -0.0063 674 ILE 91 CD1 -0.0152 0.0312 -0.0038 675 ALA 92 N 0.0001 0.0058 0.0133 676 ALA 92 CA 0.0020 0.0029 0.0135 677 ALA 92 C 0.0006 0.0020 0.0102 678 ALA 92 O -0.0018 0.0044 0.0086 679 ALA 92 CB 0.0035 0.0040 0.0173 680 GLN 93 N 0.0046 0.0010 0.0072 681 GLN 93 CA 0.0039 0.0014 0.0029 682 GLN 93 C 0.0051 0.0004 0.0032 683 GLN 93 O 0.0078 -0.0021 0.0045 684 GLN 93 CB 0.0057 -0.0003 -0.0005 685 GLN 93 CG 0.0053 -0.0001 -0.0052 686 GLN 93 CD 0.0070 -0.0018 -0.0086 687 GLN 93 OE1 0.0096 -0.0040 -0.0078 688 GLN 93 NE2 0.0057 -0.0007 -0.0125 689 TYR 94 N 0.0088 0.0038 0.0002 690 TYR 94 CA 0.0096 0.0028 0.0005 691 TYR 94 C 0.0107 0.0009 -0.0021 692 TYR 94 O 0.0101 0.0012 -0.0048 693 TYR 94 CB 0.0080 0.0049 0.0008 694 TYR 94 CG 0.0088 0.0042 0.0020 695 TYR 94 CD1 0.0089 0.0037 0.0001 696 TYR 94 CD2 0.0095 0.0040 0.0052 697 TYR 94 CE1 0.0096 0.0031 0.0013 698 TYR 94 CE2 0.0102 0.0033 0.0064 699 TYR 94 CZ 0.0103 0.0028 0.0044 700 TYR 94 OH 0.0109 0.0022 0.0056 701 LYS 95 N 0.0135 -0.0131 -0.0028 702 LYS 95 CA 0.0151 0.0000 0.0021 703 LYS 95 C 0.0143 -0.0057 -0.0030 704 LYS 95 O 0.0129 -0.0125 -0.0175 705 LYS 95 CB 0.0168 0.0180 -0.0054 706 LYS 95 CG 0.0186 0.0325 0.0018 707 LYS 95 CD 0.0203 0.0504 -0.0054 708 LYS 95 CE 0.0222 0.0647 0.0023 709 LYS 95 NZ 0.0238 0.0821 -0.0048 710 LYS 95 OXT 0.0151 -0.0022 0.0077