1 PHE 1 N -0.0853 -0.0353 0.0767 2 PHE 1 HN -0.1060 -0.0472 0.0872 3 PHE 1 CA -0.0722 -0.0484 0.0439 4 PHE 1 HA -0.0748 -0.0542 0.0398 5 PHE 1 CB -0.0861 -0.0737 0.0291 6 PHE 1 HB1 -0.0809 -0.0668 0.0313 7 PHE 1 HB2 -0.1089 -0.0867 0.0409 8 PHE 1 CG -0.0773 -0.0916 -0.0045 9 PHE 1 CD1 -0.0571 -0.0894 -0.0266 10 PHE 1 HD1 -0.0476 -0.0746 -0.0197 11 PHE 1 CE1 -0.0493 -0.1063 -0.0577 12 PHE 1 HE1 -0.0337 -0.1045 -0.0747 13 PHE 1 CZ -0.0618 -0.1257 -0.0667 14 PHE 1 HZ -0.0558 -0.1386 -0.0906 15 PHE 1 CD2 -0.0898 -0.1110 -0.0136 16 PHE 1 HD2 -0.1053 -0.1127 0.0034 17 PHE 1 CE2 -0.0822 -0.1281 -0.0447 18 PHE 1 HE2 -0.0919 -0.1431 -0.0516 19 PHE 1 C -0.0406 -0.0285 0.0299 20 PHE 1 O -0.0245 -0.0306 0.0075 21 ILE 2 N -0.0338 -0.0038 0.0256 22 ILE 2 HN -0.0460 0.0009 0.0402 23 ILE 2 CA -0.0057 0.0163 0.0184 24 ILE 2 HA 0.0065 0.0064 -0.0005 25 ILE 2 CB -0.0018 0.0403 0.0355 26 ILE 2 HB -0.0132 0.0512 0.0546 27 ILE 2 CG2 0.0280 0.0600 0.0264 28 ILE 2 HG21 0.0396 0.0494 0.0073 29 ILE 2 HG22 0.0360 0.0680 0.0263 30 ILE 2 HG23 0.0303 0.0769 0.0388 31 ILE 2 CG1 -0.0137 0.0315 0.0382 32 ILE 2 HG11 -0.0093 0.0500 0.0501 33 ILE 2 HG12 -0.0357 0.0201 0.0476 34 ILE 2 CD -0.0032 0.0138 0.0141 35 ILE 2 HD1 -0.0077 -0.0052 0.0018 36 ILE 2 HD2 0.0188 0.0246 0.0043 37 ILE 2 HD3 -0.0131 0.0085 0.0182 38 ILE 2 C 0.0060 0.0257 0.0163 39 ILE 2 O 0.0287 0.0278 -0.0016 40 PRO 3 N 0.0034 0.0213 0.0285 41 PRO 3 CD -0.0206 0.0233 0.0512 42 PRO 3 HD1 -0.0403 0.0083 0.0439 43 PRO 3 HD2 -0.0235 0.0317 0.0666 44 PRO 3 CA 0.0206 0.0247 0.0198 45 PRO 3 HA 0.0420 0.0372 0.0217 46 PRO 3 CB 0.0049 0.0277 0.0372 47 PRO 3 HB1 0.0202 0.0391 0.0424 48 PRO 3 HB2 -0.0090 0.0135 0.0265 49 PRO 3 CG -0.0128 0.0347 0.0624 50 PRO 3 HG1 -0.0321 0.0308 0.0721 51 PRO 3 HG2 -0.0001 0.0510 0.0774 52 PRO 3 C 0.0255 0.0077 -0.0104 53 PRO 3 O 0.0495 0.0117 -0.0237 54 LEU 4 N 0.0226 0.0062 -0.0016 55 LEU 4 HN 0.0130 -0.0018 0.0071 56 LEU 4 CA 0.0205 0.0078 -0.0231 57 LEU 4 HA 0.0320 0.0163 -0.0264 58 LEU 4 CB 0.0047 -0.0028 -0.0259 59 LEU 4 HB1 -0.0070 -0.0113 -0.0233 60 LEU 4 HB2 0.0062 -0.0035 -0.0139 61 LEU 4 CG 0.0020 -0.0017 -0.0474 62 LEU 4 HG 0.0006 -0.0009 -0.0595 63 LEU 4 CD1 0.0169 0.0094 -0.0519 64 LEU 4 HD11 0.0183 0.0087 -0.0401 65 LEU 4 HD12 0.0291 0.0178 -0.0514 66 LEU 4 HD13 0.0143 0.0098 -0.0675 67 LEU 4 CD2 -0.0145 -0.0130 -0.0484 68 LEU 4 HD21 -0.0258 -0.0212 -0.0460 69 LEU 4 HD22 -0.0135 -0.0140 -0.0361 70 LEU 4 HD23 -0.0167 -0.0123 -0.0639 71 LEU 4 C 0.0192 0.0091 -0.0385 72 LEU 4 O 0.0273 0.0170 -0.0542 73 VAL 5 N 0.0286 -0.0055 -0.0312 74 VAL 5 HN 0.0234 -0.0059 -0.0250 75 VAL 5 CA 0.0411 -0.0032 -0.0454 76 VAL 5 HA 0.0435 -0.0136 -0.0527 77 VAL 5 CB 0.0434 -0.0032 -0.0482 78 VAL 5 HB 0.0408 0.0073 -0.0406 79 VAL 5 CG1 0.0564 -0.0009 -0.0630 80 VAL 5 HG11 0.0592 -0.0115 -0.0708 81 VAL 5 HG12 0.0620 0.0113 -0.0647 82 VAL 5 HG13 0.0577 -0.0011 -0.0646 83 VAL 5 CG2 0.0363 -0.0201 -0.0466 84 VAL 5 HG21 0.0267 -0.0222 -0.0359 85 VAL 5 HG22 0.0387 -0.0309 -0.0541 86 VAL 5 HG23 0.0380 -0.0198 -0.0486 87 VAL 5 C 0.0493 0.0128 -0.0487 88 VAL 5 O 0.0581 0.0118 -0.0597 89 ALA 6 N 0.0456 0.0173 -0.0392 90 ALA 6 HN 0.0481 0.0192 -0.0476 91 ALA 6 CA 0.0335 0.0104 -0.0379 92 ALA 6 CB 0.0223 0.0048 -0.0464 93 ALA 6 HB1 0.0227 0.0052 -0.0497 94 ALA 6 HB2 0.0235 0.0060 -0.0556 95 ALA 6 CM1 0.0098 -0.0025 -0.0417 96 ALA 6 HM1 0.0060 -0.0041 -0.0494 97 ALA 6 CM2 0.0023 -0.0074 -0.0312 98 ALA 6 HM2 -0.0057 -0.0117 -0.0332 99 ALA 6 C 0.0294 0.0075 -0.0277 100 ALA 6 O 0.0245 0.0042 -0.0190 101 ALA 6 CX1 0.0336 0.0105 -0.0379 102 ALA 6 CX2 -0.0097 -0.0158 -0.0042 103 ALA 6 HX11 0.0364 0.0127 -0.0474 104 ALA 6 HX21 -0.0080 -0.0143 -0.0122 105 ALA 6 HX12 0.0250 0.0056 -0.0365 106 ALA 6 HX22 -0.0180 -0.0203 -0.0063 107 ALA 6 HX13 0.0396 0.0134 -0.0305 108 ALA 6 HX23 -0.0103 -0.0167 0.0048 109 GLY 7 N 0.0394 0.0076 -0.0402 110 GLY 7 HN 0.0432 0.0112 -0.0442 111 GLY 7 CA 0.0397 0.0089 -0.0398 112 GLY 7 HA1 0.0441 0.0135 -0.0444 113 GLY 7 HA2 0.0383 0.0020 -0.0416 114 GLY 7 C 0.0357 0.0135 -0.0308 115 GLY 7 O 0.0321 0.0096 -0.0271 116 LEU 8 N 0.0378 0.0121 -0.0229 117 LEU 8 HN 0.0469 0.0121 -0.0279 118 LEU 8 CA 0.0289 0.0210 -0.0111 119 LEU 8 HA 0.0285 0.0285 -0.0050 120 LEU 8 CB 0.0369 0.0281 -0.0100 121 LEU 8 HB1 0.0383 0.0199 -0.0171 122 LEU 8 HB2 0.0485 0.0349 -0.0110 123 LEU 8 CG 0.0285 0.0369 0.0015 124 LEU 8 HG 0.0172 0.0300 0.0023 125 LEU 8 CD1 0.0257 0.0484 0.0120 126 LEU 8 HD11 0.0369 0.0555 0.0114 127 LEU 8 HD12 0.0187 0.0440 0.0124 128 LEU 8 HD13 0.0197 0.0545 0.0200 129 LEU 8 CD2 0.0382 0.0433 0.0013 130 LEU 8 HD21 0.0398 0.0351 -0.0061 131 LEU 8 HD22 0.0497 0.0499 0.0001 132 LEU 8 HD23 0.0322 0.0497 0.0095 133 LEU 8 C 0.0119 0.0128 -0.0083 134 LEU 8 O 0.0016 0.0172 0.0008 135 PHE 9 N 0.0237 0.0127 -0.0113 136 PHE 9 HN 0.0340 0.0122 -0.0240 137 PHE 9 CA 0.0058 0.0040 -0.0118 138 PHE 9 HA 0.0041 0.0087 0.0010 139 PHE 9 CB 0.0083 -0.0035 -0.0321 140 PHE 9 HB1 0.0057 -0.0101 -0.0445 141 PHE 9 HB2 0.0238 0.0023 -0.0356 142 PHE 9 CG -0.0061 -0.0104 -0.0320 143 PHE 9 CD1 -0.0011 -0.0050 -0.0251 144 PHE 9 HD1 0.0131 0.0040 -0.0199 145 PHE 9 CE1 -0.0145 -0.0113 -0.0248 146 PHE 9 HE1 -0.0105 -0.0071 -0.0195 147 PHE 9 CZ -0.0329 -0.0229 -0.0315 148 PHE 9 HZ -0.0432 -0.0278 -0.0313 149 PHE 9 CD2 -0.0246 -0.0221 -0.0388 150 PHE 9 HD2 -0.0286 -0.0263 -0.0441 151 PHE 9 CE2 -0.0380 -0.0284 -0.0385 152 PHE 9 HE2 -0.0522 -0.0374 -0.0437 153 PHE 9 C -0.0137 -0.0037 -0.0080 154 PHE 9 O -0.0284 -0.0055 0.0039 155 ALA 10 N -0.0007 -0.0136 -0.0113 156 ALA 10 HN 0.0075 -0.0083 -0.0201 157 ALA 10 CA -0.0090 -0.0239 -0.0158 158 ALA 10 CB -0.0028 -0.0251 -0.0366 159 ALA 10 HB1 0.0061 -0.0162 -0.0374 160 ALA 10 HB2 -0.0089 -0.0327 -0.0398 161 ALA 10 C -0.0114 -0.0214 -0.0026 162 ALA 10 O -0.0191 -0.0300 -0.0039 163 LEU 11 N -0.0120 -0.0136 0.0086 164 LEU 11 HN -0.0015 -0.0027 0.0056 165 LEU 11 CA -0.0141 -0.0021 0.0287 166 LEU 11 HA -0.0241 -0.0148 0.0282 167 LEU 11 CB 0.0072 0.0199 0.0225 168 LEU 11 HB1 0.0081 0.0345 0.0415 169 LEU 11 HB2 0.0188 0.0254 0.0096 170 LEU 11 CG 0.0124 0.0165 0.0084 171 LEU 11 HG 0.0286 0.0326 0.0027 172 LEU 11 CD1 -0.0010 0.0124 0.0262 173 LEU 11 HD11 -0.0174 -0.0038 0.0319 174 LEU 11 HD12 0.0010 0.0279 0.0445 175 LEU 11 HD13 0.0031 0.0099 0.0153 176 LEU 11 CD2 0.0106 -0.0040 -0.0177 177 LEU 11 HD21 0.0191 -0.0025 -0.0304 178 LEU 11 HD22 -0.0057 -0.0213 -0.0136 179 LEU 11 HD23 0.0173 -0.0035 -0.0287 180 LEU 11 C -0.0247 0.0049 0.0571 181 LEU 11 O -0.0346 0.0056 0.0757 182 LEU 12 N -0.0264 0.0001 0.0670 183 LEU 12 HN -0.0151 -0.0007 0.0452 184 LEU 12 CA -0.0349 0.0063 0.0957 185 LEU 12 HA -0.0269 0.0227 0.1165 186 LEU 12 CB -0.0216 0.0115 0.0830 187 LEU 12 HB1 -0.0320 -0.0063 0.0632 188 LEU 12 HB2 0.0019 0.0255 0.0710 189 LEU 12 CG -0.0250 0.0213 0.1102 190 LEU 12 HG -0.0485 0.0068 0.1208 191 LEU 12 CD1 -0.0123 0.0456 0.1397 192 LEU 12 HD11 0.0113 0.0605 0.1297 193 LEU 12 HD12 -0.0233 0.0424 0.1526 194 LEU 12 HD13 -0.0151 0.0520 0.1584 195 LEU 12 CD2 -0.0089 0.0268 0.0931 196 LEU 12 HD21 -0.0182 0.0093 0.0722 197 LEU 12 HD22 0.0144 0.0410 0.0819 198 LEU 12 HD23 -0.0111 0.0338 0.1122 199 LEU 12 C -0.0681 -0.0142 0.1108 200 LEU 12 O -0.0853 -0.0335 0.1000