USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 963 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 77 MET CE :methyl 158:sc= -0.285 (180deg=-1.01) USER MOD Set 1.2: A 111 MET CE :methyl 151:sc= -0.219 (180deg=-0.86) USER MOD Set 2.1: A 35 MET CE :methyl -127:sc= -2.88 (180deg=-1.03) USER MOD Set 2.2: A 86 ASN : amide:sc= -0.525 K(o=-3.4,f=-11!) USER MOD Set 3.1: A 18 HIS : no HD1:sc= 0.0185 K(o=1.1,f=-9.5!) USER MOD Set 3.2: A 81 SER OG : rot -130:sc= 1.09 USER MOD Set 4.1: A 51 GLN : amide:sc= 2.07 K(o=2.7,f=-0.061) USER MOD Set 4.2: A 66 SER OG : rot 151:sc= 0.674 USER MOD Set 5.1: A 46 THR OG1 : rot 135:sc= 0.181 USER MOD Set 5.2: A 72 HIS : +bothHN:sc= 1.75 K(o=1.9,f=-7.1!) USER MOD Set 6.1: A 33 ASN : amide:sc= -0.799 K(o=-1.3,f=-2.6!) USER MOD Set 6.2: A 39 THR OG1 : rot -169:sc= -0.458 USER MOD Set 7.1: A 23 TYR OH : rot 30:sc= 1.24 USER MOD Set 7.2: A 25 SER OG : rot 95:sc= 0.481 USER MOD Single : A 19 ASN : amide:sc= -0.167 K(o=-0.17,f=-1.3) USER MOD Single : A 27 GLN : amide:sc= 1.09 K(o=1.1,f=-5.7!) USER MOD Single : A 44 SER OG : rot 180:sc= -0.0819 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 CYS SG : rot 161:sc= 0.21 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ -170:sc=-0.00129 (180deg=-0.121) USER MOD Single : A 80 THR OG1 : rot -83:sc= 0.645 USER MOD Single : A 93 ASN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 43:sc= 0.123 USER MOD Single : A 107 ASN : amide:sc= -3.37! C(o=-3.4!,f=-11!) USER MOD Single : A 108 SER OG : rot -32:sc= 0.586 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 178:sc= -0.698 (180deg=-0.738) USER MOD Single : A 115 THR OG1 : rot 72:sc= 1.08 USER MOD Single : A 116 TYR OH : rot -141:sc= 1.24 USER MOD Single : A 117 MET CE :methyl -112:sc= -1.44 (180deg=-4.82!) USER MOD Single : A 120 ASN :FLIP amide:sc= -0.376 F(o=-1.5!,f=-0.38) USER MOD Single : A 121 LYS NZ :NH3+ 168:sc= 0.505 (180deg=0.3) USER MOD Single : A 126 MET CE :methyl -110:sc= -0.0311 (180deg=-1.48) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ -145:sc= 1.23 (180deg=0.66) USER MOD Single : A 142 LYS NZ :NH3+ 164:sc= -0.0533 (180deg=-0.336) USER MOD Single : A 146 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 MET CE :methyl 163:sc= -0.0593 (180deg=-0.466) USER MOD Single : A 153 CYS SG : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 93 N LEU A 17 -24.085 -12.099 -11.597 1.00 61.13 N ATOM 94 CA LEU A 17 -23.594 -11.321 -10.519 1.00 71.23 C ATOM 95 C LEU A 17 -22.669 -10.286 -11.055 1.00 10.02 C ATOM 96 O LEU A 17 -22.092 -10.438 -12.144 1.00 14.41 O ATOM 97 CB LEU A 17 -22.900 -12.146 -9.453 1.00 62.41 C ATOM 98 CG LEU A 17 -23.732 -13.195 -8.739 1.00 2.03 C ATOM 99 CD1 LEU A 17 -25.028 -12.618 -8.176 1.00 70.10 C ATOM 100 CD2 LEU A 17 -23.963 -14.402 -9.602 1.00 44.54 C ATOM 0 HA LEU A 17 -24.451 -10.856 -10.031 1.00 71.23 H new ATOM 0 HB2 LEU A 17 -22.048 -12.646 -9.914 1.00 62.41 H new ATOM 0 HB3 LEU A 17 -22.501 -11.463 -8.703 1.00 62.41 H new ATOM 0 HG LEU A 17 -23.154 -13.533 -7.879 1.00 2.03 H new ATOM 0 HD11 LEU A 17 -25.589 -13.406 -7.674 1.00 70.10 H new ATOM 0 HD12 LEU A 17 -24.795 -11.828 -7.462 1.00 70.10 H new ATOM 0 HD13 LEU A 17 -25.627 -12.207 -8.989 1.00 70.10 H new ATOM 0 HD21 LEU A 17 -24.562 -15.130 -9.056 1.00 44.54 H new ATOM 0 HD22 LEU A 17 -24.490 -14.105 -10.509 1.00 44.54 H new ATOM 0 HD23 LEU A 17 -23.005 -14.848 -9.868 1.00 44.54 H new ATOM 112 N HIS A 18 -22.527 -9.250 -10.334 1.00 44.52 N ATOM 113 CA HIS A 18 -21.776 -8.131 -10.785 1.00 3.12 C ATOM 114 C HIS A 18 -20.559 -8.008 -9.929 1.00 64.43 C ATOM 115 O HIS A 18 -20.511 -8.573 -8.822 1.00 42.30 O ATOM 116 CB HIS A 18 -22.625 -6.862 -10.645 1.00 11.40 C ATOM 117 CG HIS A 18 -23.966 -6.948 -11.324 1.00 34.13 C ATOM 118 ND1 HIS A 18 -24.230 -6.405 -12.545 1.00 32.43 N ATOM 119 CD2 HIS A 18 -25.124 -7.527 -10.919 1.00 43.24 C ATOM 120 CE1 HIS A 18 -25.483 -6.638 -12.870 1.00 53.02 C ATOM 121 NE2 HIS A 18 -26.043 -7.318 -11.900 1.00 21.32 N ATOM 0 H HIS A 18 -22.929 -9.143 -9.403 1.00 44.52 H new ATOM 0 HA HIS A 18 -21.492 -8.261 -11.829 1.00 3.12 H new ATOM 0 HB2 HIS A 18 -22.777 -6.654 -9.586 1.00 11.40 H new ATOM 0 HB3 HIS A 18 -22.072 -6.019 -11.059 1.00 11.40 H new ATOM 0 HD2 HIS A 18 -25.286 -8.055 -9.991 1.00 43.24 H new ATOM 0 HE1 HIS A 18 -25.968 -6.322 -13.782 1.00 53.02 H new ATOM 0 HE2 HIS A 18 -27.011 -7.639 -11.883 1.00 21.32 H new ATOM 130 N ASN A 19 -19.573 -7.333 -10.426 1.00 34.43 N ATOM 131 CA ASN A 19 -18.373 -7.114 -9.682 1.00 44.52 C ATOM 132 C ASN A 19 -18.173 -5.610 -9.580 1.00 11.34 C ATOM 133 O ASN A 19 -18.201 -4.903 -10.598 1.00 61.14 O ATOM 134 CB ASN A 19 -17.155 -7.762 -10.367 1.00 55.02 C ATOM 135 CG ASN A 19 -17.312 -9.238 -10.720 1.00 62.33 C ATOM 136 OD1 ASN A 19 -18.055 -9.973 -10.094 1.00 73.24 O ATOM 137 ND2 ASN A 19 -16.570 -9.681 -11.705 1.00 62.43 N ATOM 0 H ASN A 19 -19.576 -6.918 -11.358 1.00 34.43 H new ATOM 0 HA ASN A 19 -18.463 -7.570 -8.696 1.00 44.52 H new ATOM 0 HB2 ASN A 19 -16.936 -7.209 -11.280 1.00 55.02 H new ATOM 0 HB3 ASN A 19 -16.290 -7.652 -9.713 1.00 55.02 H new ATOM 0 HD21 ASN A 19 -16.605 -10.666 -11.966 1.00 62.43 H new ATOM 0 HD22 ASN A 19 -15.958 -9.041 -12.210 1.00 62.43 H new ATOM 144 N VAL A 20 -18.000 -5.114 -8.384 1.00 61.14 N ATOM 145 CA VAL A 20 -17.878 -3.679 -8.154 1.00 3.42 C ATOM 146 C VAL A 20 -16.625 -3.384 -7.343 1.00 31.12 C ATOM 147 O VAL A 20 -16.316 -4.096 -6.394 1.00 52.01 O ATOM 148 CB VAL A 20 -19.135 -3.117 -7.398 1.00 12.55 C ATOM 149 CG1 VAL A 20 -19.016 -1.614 -7.149 1.00 42.14 C ATOM 150 CG2 VAL A 20 -20.411 -3.414 -8.173 1.00 42.13 C ATOM 0 H VAL A 20 -17.938 -5.681 -7.538 1.00 61.14 H new ATOM 0 HA VAL A 20 -17.810 -3.189 -9.125 1.00 3.42 H new ATOM 0 HB VAL A 20 -19.181 -3.620 -6.432 1.00 12.55 H new ATOM 0 HG11 VAL A 20 -19.904 -1.261 -6.624 1.00 42.14 H new ATOM 0 HG12 VAL A 20 -18.132 -1.414 -6.543 1.00 42.14 H new ATOM 0 HG13 VAL A 20 -18.927 -1.093 -8.102 1.00 42.14 H new ATOM 0 HG21 VAL A 20 -21.268 -3.015 -7.630 1.00 42.13 H new ATOM 0 HG22 VAL A 20 -20.356 -2.948 -9.157 1.00 42.13 H new ATOM 0 HG23 VAL A 20 -20.524 -4.492 -8.288 1.00 42.13 H new ATOM 160 N PHE A 21 -15.908 -2.356 -7.721 1.00 10.14 N ATOM 161 CA PHE A 21 -14.712 -1.970 -7.002 1.00 74.41 C ATOM 162 C PHE A 21 -15.068 -0.886 -6.003 1.00 30.53 C ATOM 163 O PHE A 21 -15.572 0.186 -6.381 1.00 35.21 O ATOM 164 CB PHE A 21 -13.649 -1.472 -8.015 1.00 42.20 C ATOM 165 CG PHE A 21 -12.326 -0.991 -7.440 1.00 51.14 C ATOM 166 CD1 PHE A 21 -11.392 -1.894 -6.945 1.00 54.03 C ATOM 167 CD2 PHE A 21 -12.001 0.365 -7.434 1.00 43.44 C ATOM 168 CE1 PHE A 21 -10.181 -1.460 -6.459 1.00 51.44 C ATOM 169 CE2 PHE A 21 -10.786 0.798 -6.941 1.00 45.32 C ATOM 170 CZ PHE A 21 -9.878 -0.115 -6.456 1.00 44.13 C ATOM 0 H PHE A 21 -16.129 -1.768 -8.524 1.00 10.14 H new ATOM 0 HA PHE A 21 -14.298 -2.820 -6.460 1.00 74.41 H new ATOM 0 HB2 PHE A 21 -13.441 -2.282 -8.715 1.00 42.20 H new ATOM 0 HB3 PHE A 21 -14.085 -0.656 -8.592 1.00 42.20 H new ATOM 0 HD1 PHE A 21 -11.620 -2.950 -6.942 1.00 54.03 H new ATOM 0 HD2 PHE A 21 -12.708 1.085 -7.819 1.00 43.44 H new ATOM 0 HE1 PHE A 21 -9.466 -2.174 -6.079 1.00 51.44 H new ATOM 0 HE2 PHE A 21 -10.549 1.852 -6.936 1.00 45.32 H new ATOM 0 HZ PHE A 21 -8.927 0.222 -6.072 1.00 44.13 H new ATOM 180 N VAL A 22 -14.803 -1.148 -4.747 1.00 2.45 N ATOM 181 CA VAL A 22 -15.081 -0.202 -3.699 1.00 1.04 C ATOM 182 C VAL A 22 -13.859 0.603 -3.362 1.00 20.23 C ATOM 183 O VAL A 22 -12.818 0.073 -2.961 1.00 63.52 O ATOM 184 CB VAL A 22 -15.743 -0.822 -2.436 1.00 65.51 C ATOM 185 CG1 VAL A 22 -17.202 -1.155 -2.720 1.00 62.15 C ATOM 186 CG2 VAL A 22 -15.006 -2.084 -1.997 1.00 63.02 C ATOM 0 H VAL A 22 -14.389 -2.023 -4.424 1.00 2.45 H new ATOM 0 HA VAL A 22 -15.836 0.474 -4.100 1.00 1.04 H new ATOM 0 HB VAL A 22 -15.687 -0.089 -1.631 1.00 65.51 H new ATOM 0 HG11 VAL A 22 -17.656 -1.589 -1.829 1.00 62.15 H new ATOM 0 HG12 VAL A 22 -17.736 -0.245 -2.994 1.00 62.15 H new ATOM 0 HG13 VAL A 22 -17.259 -1.870 -3.541 1.00 62.15 H new ATOM 0 HG21 VAL A 22 -15.489 -2.498 -1.112 1.00 63.02 H new ATOM 0 HG22 VAL A 22 -15.032 -2.819 -2.802 1.00 63.02 H new ATOM 0 HG23 VAL A 22 -13.970 -1.838 -1.764 1.00 63.02 H new ATOM 196 N TYR A 23 -13.993 1.879 -3.541 1.00 70.31 N ATOM 197 CA TYR A 23 -12.904 2.810 -3.425 1.00 22.41 C ATOM 198 C TYR A 23 -12.458 3.116 -2.005 1.00 3.33 C ATOM 199 O TYR A 23 -11.278 3.335 -1.771 1.00 31.00 O ATOM 200 CB TYR A 23 -13.227 4.074 -4.182 1.00 72.35 C ATOM 201 CG TYR A 23 -14.481 4.811 -3.757 1.00 52.23 C ATOM 202 CD1 TYR A 23 -15.724 4.471 -4.278 1.00 23.02 C ATOM 203 CD2 TYR A 23 -14.417 5.859 -2.854 1.00 14.02 C ATOM 204 CE1 TYR A 23 -16.859 5.151 -3.905 1.00 22.42 C ATOM 205 CE2 TYR A 23 -15.548 6.540 -2.476 1.00 44.21 C ATOM 206 CZ TYR A 23 -16.763 6.184 -3.003 1.00 35.24 C ATOM 207 OH TYR A 23 -17.883 6.860 -2.627 1.00 20.25 O ATOM 0 H TYR A 23 -14.883 2.318 -3.778 1.00 70.31 H new ATOM 0 HA TYR A 23 -12.043 2.313 -3.872 1.00 22.41 H new ATOM 0 HB2 TYR A 23 -12.381 4.755 -4.087 1.00 72.35 H new ATOM 0 HB3 TYR A 23 -13.318 3.825 -5.239 1.00 72.35 H new ATOM 0 HD1 TYR A 23 -15.799 3.660 -4.987 1.00 23.02 H new ATOM 0 HD2 TYR A 23 -13.462 6.146 -2.440 1.00 14.02 H new ATOM 0 HE1 TYR A 23 -17.819 4.876 -4.317 1.00 22.42 H new ATOM 0 HE2 TYR A 23 -15.481 7.352 -1.767 1.00 44.21 H new ATOM 0 HH TYR A 23 -18.656 6.259 -2.665 1.00 20.25 H new ATOM 217 N GLY A 24 -13.374 3.137 -1.069 1.00 14.30 N ATOM 218 CA GLY A 24 -12.973 3.447 0.283 1.00 42.21 C ATOM 219 C GLY A 24 -14.116 3.447 1.247 1.00 24.45 C ATOM 220 O GLY A 24 -14.062 2.775 2.266 1.00 61.54 O ATOM 0 H GLY A 24 -14.367 2.951 -1.207 1.00 14.30 H new ATOM 0 HA2 GLY A 24 -12.229 2.721 0.611 1.00 42.21 H new ATOM 0 HA3 GLY A 24 -12.492 4.425 0.298 1.00 42.21 H new ATOM 224 N SER A 25 -15.173 4.161 0.899 1.00 50.34 N ATOM 225 CA SER A 25 -16.336 4.323 1.765 1.00 42.24 C ATOM 226 C SER A 25 -16.964 2.973 2.143 1.00 34.03 C ATOM 227 O SER A 25 -17.426 2.782 3.270 1.00 2.15 O ATOM 228 CB SER A 25 -17.349 5.212 1.058 1.00 64.12 C ATOM 229 OG SER A 25 -16.737 6.435 0.665 1.00 40.24 O ATOM 0 H SER A 25 -15.252 4.647 0.006 1.00 50.34 H new ATOM 0 HA SER A 25 -16.018 4.789 2.698 1.00 42.24 H new ATOM 0 HB2 SER A 25 -17.747 4.698 0.183 1.00 64.12 H new ATOM 0 HB3 SER A 25 -18.191 5.414 1.720 1.00 64.12 H new ATOM 0 HG SER A 25 -16.424 6.362 -0.261 1.00 40.24 H new ATOM 235 N PHE A 26 -16.945 2.042 1.222 1.00 33.25 N ATOM 236 CA PHE A 26 -17.483 0.724 1.472 1.00 31.23 C ATOM 237 C PHE A 26 -16.429 -0.337 1.235 1.00 40.40 C ATOM 238 O PHE A 26 -16.746 -1.474 0.935 1.00 10.25 O ATOM 239 CB PHE A 26 -18.691 0.455 0.587 1.00 53.02 C ATOM 240 CG PHE A 26 -19.863 1.339 0.841 1.00 64.24 C ATOM 241 CD1 PHE A 26 -20.466 1.364 2.087 1.00 21.20 C ATOM 242 CD2 PHE A 26 -20.361 2.139 -0.155 1.00 55.44 C ATOM 243 CE1 PHE A 26 -21.550 2.178 2.329 1.00 12.22 C ATOM 244 CE2 PHE A 26 -21.450 2.954 0.081 1.00 2.35 C ATOM 245 CZ PHE A 26 -22.044 2.974 1.323 1.00 70.05 C ATOM 0 H PHE A 26 -16.561 2.172 0.286 1.00 33.25 H new ATOM 0 HA PHE A 26 -17.797 0.685 2.515 1.00 31.23 H new ATOM 0 HB2 PHE A 26 -18.391 0.564 -0.455 1.00 53.02 H new ATOM 0 HB3 PHE A 26 -19.000 -0.581 0.723 1.00 53.02 H new ATOM 0 HD1 PHE A 26 -20.082 0.738 2.879 1.00 21.20 H new ATOM 0 HD2 PHE A 26 -19.898 2.131 -1.131 1.00 55.44 H new ATOM 0 HE1 PHE A 26 -22.010 2.191 3.306 1.00 12.22 H new ATOM 0 HE2 PHE A 26 -21.837 3.578 -0.711 1.00 2.35 H new ATOM 0 HZ PHE A 26 -22.895 3.613 1.506 1.00 70.05 H new ATOM 255 N GLN A 27 -15.179 0.017 1.442 1.00 35.21 N ATOM 256 CA GLN A 27 -14.068 -0.890 1.193 1.00 52.30 C ATOM 257 C GLN A 27 -13.824 -1.780 2.441 1.00 33.23 C ATOM 258 O GLN A 27 -12.712 -2.240 2.712 1.00 0.43 O ATOM 259 CB GLN A 27 -12.845 -0.049 0.838 1.00 24.30 C ATOM 260 CG GLN A 27 -11.672 -0.825 0.302 1.00 74.03 C ATOM 261 CD GLN A 27 -10.546 0.075 -0.120 1.00 13.42 C ATOM 262 OE1 GLN A 27 -9.653 0.397 0.655 1.00 54.52 O ATOM 263 NE2 GLN A 27 -10.595 0.513 -1.344 1.00 64.40 N ATOM 0 H GLN A 27 -14.900 0.936 1.786 1.00 35.21 H new ATOM 0 HA GLN A 27 -14.286 -1.562 0.363 1.00 52.30 H new ATOM 0 HB2 GLN A 27 -13.137 0.696 0.098 1.00 24.30 H new ATOM 0 HB3 GLN A 27 -12.526 0.494 1.727 1.00 24.30 H new ATOM 0 HG2 GLN A 27 -11.316 -1.517 1.065 1.00 74.03 H new ATOM 0 HG3 GLN A 27 -11.993 -1.426 -0.548 1.00 74.03 H new ATOM 0 HE21 GLN A 27 -11.355 0.222 -1.960 1.00 64.40 H new ATOM 0 HE22 GLN A 27 -9.874 1.147 -1.688 1.00 64.40 H new ATOM 272 N ASP A 28 -14.894 -2.049 3.143 1.00 11.55 N ATOM 273 CA ASP A 28 -14.886 -2.839 4.347 1.00 33.45 C ATOM 274 C ASP A 28 -16.153 -3.696 4.346 1.00 21.43 C ATOM 275 O ASP A 28 -17.235 -3.175 4.127 1.00 3.32 O ATOM 276 CB ASP A 28 -14.892 -1.903 5.558 1.00 53.53 C ATOM 277 CG ASP A 28 -14.801 -2.624 6.875 1.00 32.00 C ATOM 278 OD1 ASP A 28 -15.838 -2.992 7.426 1.00 1.24 O ATOM 279 OD2 ASP A 28 -13.678 -2.797 7.392 1.00 20.53 O ATOM 0 H ASP A 28 -15.822 -1.715 2.885 1.00 11.55 H new ATOM 0 HA ASP A 28 -14.001 -3.473 4.395 1.00 33.45 H new ATOM 0 HB2 ASP A 28 -14.056 -1.209 5.475 1.00 53.53 H new ATOM 0 HB3 ASP A 28 -15.804 -1.307 5.542 1.00 53.53 H new ATOM 284 N PRO A 29 -16.050 -5.011 4.563 1.00 42.02 N ATOM 285 CA PRO A 29 -17.220 -5.913 4.528 1.00 23.54 C ATOM 286 C PRO A 29 -18.197 -5.646 5.666 1.00 14.31 C ATOM 287 O PRO A 29 -19.412 -5.778 5.504 1.00 52.31 O ATOM 288 CB PRO A 29 -16.607 -7.311 4.689 1.00 24.11 C ATOM 289 CG PRO A 29 -15.154 -7.137 4.433 1.00 23.34 C ATOM 290 CD PRO A 29 -14.813 -5.743 4.851 1.00 2.01 C ATOM 0 HA PRO A 29 -17.795 -5.782 3.612 1.00 23.54 H new ATOM 0 HB2 PRO A 29 -16.785 -7.705 5.690 1.00 24.11 H new ATOM 0 HB3 PRO A 29 -17.048 -8.017 3.985 1.00 24.11 H new ATOM 0 HG2 PRO A 29 -14.571 -7.865 4.997 1.00 23.34 H new ATOM 0 HG3 PRO A 29 -14.924 -7.293 3.379 1.00 23.34 H new ATOM 0 HD2 PRO A 29 -14.547 -5.690 5.907 1.00 2.01 H new ATOM 0 HD3 PRO A 29 -13.967 -5.347 4.289 1.00 2.01 H new ATOM 298 N ASP A 30 -17.679 -5.239 6.804 1.00 73.14 N ATOM 299 CA ASP A 30 -18.525 -4.992 7.976 1.00 74.31 C ATOM 300 C ASP A 30 -19.556 -3.914 7.693 1.00 12.22 C ATOM 301 O ASP A 30 -20.734 -4.055 8.060 1.00 51.24 O ATOM 302 CB ASP A 30 -17.701 -4.648 9.220 1.00 12.15 C ATOM 303 CG ASP A 30 -18.566 -4.342 10.427 1.00 31.20 C ATOM 304 OD1 ASP A 30 -19.045 -5.292 11.089 1.00 33.44 O ATOM 305 OD2 ASP A 30 -18.771 -3.157 10.732 1.00 3.51 O ATOM 0 H ASP A 30 -16.684 -5.070 6.954 1.00 73.14 H new ATOM 0 HA ASP A 30 -19.054 -5.922 8.186 1.00 74.31 H new ATOM 0 HB2 ASP A 30 -17.039 -5.481 9.454 1.00 12.15 H new ATOM 0 HB3 ASP A 30 -17.067 -3.788 9.005 1.00 12.15 H new ATOM 310 N VAL A 31 -19.143 -2.876 6.981 1.00 31.23 N ATOM 311 CA VAL A 31 -20.055 -1.799 6.650 1.00 2.41 C ATOM 312 C VAL A 31 -21.030 -2.249 5.555 1.00 33.10 C ATOM 313 O VAL A 31 -22.168 -1.807 5.515 1.00 21.11 O ATOM 314 CB VAL A 31 -19.332 -0.459 6.263 1.00 33.23 C ATOM 315 CG1 VAL A 31 -18.523 -0.584 4.989 1.00 41.35 C ATOM 316 CG2 VAL A 31 -20.321 0.695 6.165 1.00 13.51 C ATOM 0 H VAL A 31 -18.194 -2.760 6.626 1.00 31.23 H new ATOM 0 HA VAL A 31 -20.617 -1.572 7.556 1.00 2.41 H new ATOM 0 HB VAL A 31 -18.630 -0.242 7.068 1.00 33.23 H new ATOM 0 HG11 VAL A 31 -18.044 0.370 4.767 1.00 41.35 H new ATOM 0 HG12 VAL A 31 -17.760 -1.352 5.116 1.00 41.35 H new ATOM 0 HG13 VAL A 31 -19.182 -0.860 4.165 1.00 41.35 H new ATOM 0 HG21 VAL A 31 -19.790 1.608 5.896 1.00 13.51 H new ATOM 0 HG22 VAL A 31 -21.067 0.471 5.402 1.00 13.51 H new ATOM 0 HG23 VAL A 31 -20.815 0.833 7.127 1.00 13.51 H new ATOM 326 N ILE A 32 -20.588 -3.168 4.696 1.00 75.42 N ATOM 327 CA ILE A 32 -21.433 -3.690 3.632 1.00 32.21 C ATOM 328 C ILE A 32 -22.616 -4.465 4.236 1.00 31.01 C ATOM 329 O ILE A 32 -23.779 -4.269 3.833 1.00 23.20 O ATOM 330 CB ILE A 32 -20.629 -4.595 2.667 1.00 14.01 C ATOM 331 CG1 ILE A 32 -19.522 -3.818 1.969 1.00 44.34 C ATOM 332 CG2 ILE A 32 -21.531 -5.210 1.621 1.00 51.32 C ATOM 333 CD1 ILE A 32 -20.033 -2.716 1.074 1.00 25.22 C ATOM 0 H ILE A 32 -19.648 -3.564 4.720 1.00 75.42 H new ATOM 0 HA ILE A 32 -21.814 -2.848 3.055 1.00 32.21 H new ATOM 0 HB ILE A 32 -20.183 -5.385 3.272 1.00 14.01 H new ATOM 0 HG12 ILE A 32 -18.861 -3.387 2.721 1.00 44.34 H new ATOM 0 HG13 ILE A 32 -18.923 -4.509 1.376 1.00 44.34 H new ATOM 0 HG21 ILE A 32 -20.940 -5.841 0.957 1.00 51.32 H new ATOM 0 HG22 ILE A 32 -22.296 -5.814 2.110 1.00 51.32 H new ATOM 0 HG23 ILE A 32 -22.008 -4.419 1.042 1.00 51.32 H new ATOM 0 HD11 ILE A 32 -19.190 -2.204 0.609 1.00 25.22 H new ATOM 0 HD12 ILE A 32 -20.670 -3.142 0.299 1.00 25.22 H new ATOM 0 HD13 ILE A 32 -20.608 -2.004 1.666 1.00 25.22 H new ATOM 345 N ASN A 33 -22.320 -5.315 5.227 1.00 42.41 N ATOM 346 CA ASN A 33 -23.353 -6.068 5.952 1.00 51.23 C ATOM 347 C ASN A 33 -24.377 -5.136 6.577 1.00 23.53 C ATOM 348 O ASN A 33 -25.566 -5.430 6.607 1.00 13.40 O ATOM 349 CB ASN A 33 -22.757 -6.947 7.067 1.00 35.10 C ATOM 350 CG ASN A 33 -22.008 -8.177 6.592 1.00 24.25 C ATOM 351 OD1 ASN A 33 -22.600 -9.240 6.409 1.00 23.50 O ATOM 352 ND2 ASN A 33 -20.722 -8.062 6.416 1.00 23.21 N ATOM 0 H ASN A 33 -21.369 -5.500 5.547 1.00 42.41 H new ATOM 0 HA ASN A 33 -23.833 -6.708 5.211 1.00 51.23 H new ATOM 0 HB2 ASN A 33 -22.079 -6.337 7.664 1.00 35.10 H new ATOM 0 HB3 ASN A 33 -23.564 -7.266 7.726 1.00 35.10 H new ATOM 0 HD21 ASN A 33 -20.174 -8.869 6.117 1.00 23.21 H new ATOM 0 HD22 ASN A 33 -20.263 -7.165 6.577 1.00 23.21 H new ATOM 359 N VAL A 34 -23.914 -4.011 7.056 1.00 32.22 N ATOM 360 CA VAL A 34 -24.783 -3.057 7.718 1.00 55.54 C ATOM 361 C VAL A 34 -25.555 -2.210 6.699 1.00 74.14 C ATOM 362 O VAL A 34 -26.756 -1.983 6.855 1.00 33.44 O ATOM 363 CB VAL A 34 -23.988 -2.135 8.688 1.00 11.11 C ATOM 364 CG1 VAL A 34 -24.908 -1.127 9.368 1.00 1.32 C ATOM 365 CG2 VAL A 34 -23.264 -2.965 9.736 1.00 23.03 C ATOM 0 H VAL A 34 -22.936 -3.727 7.002 1.00 32.22 H new ATOM 0 HA VAL A 34 -25.499 -3.632 8.306 1.00 55.54 H new ATOM 0 HB VAL A 34 -23.254 -1.586 8.099 1.00 11.11 H new ATOM 0 HG11 VAL A 34 -24.325 -0.497 10.039 1.00 1.32 H new ATOM 0 HG12 VAL A 34 -25.388 -0.505 8.612 1.00 1.32 H new ATOM 0 HG13 VAL A 34 -25.670 -1.657 9.939 1.00 1.32 H new ATOM 0 HG21 VAL A 34 -22.713 -2.305 10.406 1.00 23.03 H new ATOM 0 HG22 VAL A 34 -23.990 -3.541 10.310 1.00 23.03 H new ATOM 0 HG23 VAL A 34 -22.569 -3.646 9.245 1.00 23.03 H new ATOM 375 N MET A 35 -24.871 -1.765 5.654 1.00 21.12 N ATOM 376 CA MET A 35 -25.470 -0.904 4.666 1.00 71.31 C ATOM 377 C MET A 35 -26.515 -1.659 3.832 1.00 73.22 C ATOM 378 O MET A 35 -27.564 -1.105 3.519 1.00 25.33 O ATOM 379 CB MET A 35 -24.350 -0.283 3.793 1.00 62.40 C ATOM 380 CG MET A 35 -24.763 0.850 2.848 1.00 35.01 C ATOM 381 SD MET A 35 -25.788 0.354 1.459 1.00 75.13 S ATOM 382 CE MET A 35 -24.624 -0.661 0.568 1.00 41.41 C ATOM 0 H MET A 35 -23.893 -1.993 5.475 1.00 21.12 H new ATOM 0 HA MET A 35 -26.008 -0.095 5.160 1.00 71.31 H new ATOM 0 HB2 MET A 35 -23.571 0.094 4.456 1.00 62.40 H new ATOM 0 HB3 MET A 35 -23.903 -1.078 3.196 1.00 62.40 H new ATOM 0 HG2 MET A 35 -25.300 1.604 3.424 1.00 35.01 H new ATOM 0 HG3 MET A 35 -23.862 1.326 2.462 1.00 35.01 H new ATOM 0 HE1 MET A 35 -24.563 -0.322 -0.466 1.00 41.41 H new ATOM 0 HE2 MET A 35 -23.642 -0.583 1.034 1.00 41.41 H new ATOM 0 HE3 MET A 35 -24.955 -1.699 0.591 1.00 41.41 H new ATOM 392 N LEU A 36 -26.273 -2.934 3.521 1.00 61.33 N ATOM 393 CA LEU A 36 -27.266 -3.681 2.761 1.00 71.01 C ATOM 394 C LEU A 36 -27.828 -4.919 3.467 1.00 14.24 C ATOM 395 O LEU A 36 -29.045 -4.994 3.690 1.00 2.02 O ATOM 396 CB LEU A 36 -26.895 -3.889 1.250 1.00 74.34 C ATOM 397 CG LEU A 36 -25.538 -4.509 0.864 1.00 74.15 C ATOM 398 CD1 LEU A 36 -25.516 -5.993 1.099 1.00 64.50 C ATOM 399 CD2 LEU A 36 -25.202 -4.199 -0.583 1.00 51.24 C ATOM 0 H LEU A 36 -25.431 -3.451 3.773 1.00 61.33 H new ATOM 0 HA LEU A 36 -28.127 -3.013 2.730 1.00 71.01 H new ATOM 0 HB2 LEU A 36 -27.673 -4.513 0.809 1.00 74.34 H new ATOM 0 HB3 LEU A 36 -26.955 -2.915 0.765 1.00 74.34 H new ATOM 0 HG LEU A 36 -24.780 -4.061 1.507 1.00 74.15 H new ATOM 0 HD11 LEU A 36 -24.542 -6.392 0.815 1.00 64.50 H new ATOM 0 HD12 LEU A 36 -25.698 -6.197 2.154 1.00 64.50 H new ATOM 0 HD13 LEU A 36 -26.292 -6.468 0.499 1.00 64.50 H new ATOM 0 HD21 LEU A 36 -24.240 -4.645 -0.837 1.00 51.24 H new ATOM 0 HD22 LEU A 36 -25.975 -4.610 -1.232 1.00 51.24 H new ATOM 0 HD23 LEU A 36 -25.149 -3.119 -0.721 1.00 51.24 H new ATOM 411 N ASP A 37 -26.964 -5.862 3.857 1.00 63.05 N ATOM 412 CA ASP A 37 -27.410 -7.113 4.513 1.00 42.54 C ATOM 413 C ASP A 37 -26.232 -8.024 4.752 1.00 75.12 C ATOM 414 O ASP A 37 -25.968 -8.449 5.873 1.00 22.31 O ATOM 415 CB ASP A 37 -28.428 -7.868 3.642 1.00 31.04 C ATOM 416 CG ASP A 37 -29.013 -9.080 4.333 1.00 50.04 C ATOM 417 OD1 ASP A 37 -29.869 -8.904 5.220 1.00 63.40 O ATOM 418 OD2 ASP A 37 -28.657 -10.218 3.979 1.00 21.23 O ATOM 0 H ASP A 37 -25.954 -5.791 3.734 1.00 63.05 H new ATOM 0 HA ASP A 37 -27.877 -6.835 5.458 1.00 42.54 H new ATOM 0 HB2 ASP A 37 -29.235 -7.190 3.365 1.00 31.04 H new ATOM 0 HB3 ASP A 37 -27.944 -8.182 2.717 1.00 31.04 H new ATOM 423 N ARG A 38 -25.524 -8.307 3.691 1.00 61.30 N ATOM 424 CA ARG A 38 -24.368 -9.205 3.714 1.00 71.34 C ATOM 425 C ARG A 38 -23.271 -8.603 2.896 1.00 64.23 C ATOM 426 O ARG A 38 -23.307 -7.422 2.638 1.00 44.14 O ATOM 427 CB ARG A 38 -24.740 -10.615 3.204 1.00 74.41 C ATOM 428 CG ARG A 38 -25.688 -11.362 4.122 1.00 10.34 C ATOM 429 CD ARG A 38 -25.051 -11.591 5.485 1.00 45.42 C ATOM 430 NE ARG A 38 -25.979 -12.178 6.441 1.00 1.52 N ATOM 431 CZ ARG A 38 -25.682 -12.450 7.713 1.00 72.14 C ATOM 432 NH1 ARG A 38 -24.422 -12.344 8.148 1.00 3.35 N ATOM 433 NH2 ARG A 38 -26.637 -12.852 8.539 1.00 42.12 N ATOM 0 H ARG A 38 -25.725 -7.923 2.768 1.00 61.30 H new ATOM 0 HA ARG A 38 -24.026 -9.324 4.742 1.00 71.34 H new ATOM 0 HB2 ARG A 38 -25.196 -10.527 2.218 1.00 74.41 H new ATOM 0 HB3 ARG A 38 -23.829 -11.200 3.082 1.00 74.41 H new ATOM 0 HG2 ARG A 38 -26.612 -10.795 4.238 1.00 10.34 H new ATOM 0 HG3 ARG A 38 -25.956 -12.319 3.675 1.00 10.34 H new ATOM 0 HD2 ARG A 38 -24.187 -12.246 5.373 1.00 45.42 H new ATOM 0 HD3 ARG A 38 -24.684 -10.642 5.875 1.00 45.42 H new ATOM 0 HE ARG A 38 -26.921 -12.396 6.116 1.00 1.52 H new ATOM 0 HH11 ARG A 38 -23.684 -12.054 7.507 1.00 3.35 H new ATOM 0 HH12 ARG A 38 -24.199 -12.553 9.121 1.00 3.35 H new ATOM 0 HH21 ARG A 38 -27.594 -12.952 8.202 1.00 42.12 H new ATOM 0 HH22 ARG A 38 -26.415 -13.061 9.512 1.00 42.12 H new ATOM 447 N THR A 39 -22.275 -9.367 2.545 1.00 35.45 N ATOM 448 CA THR A 39 -21.212 -8.845 1.739 1.00 32.01 C ATOM 449 C THR A 39 -20.797 -9.833 0.655 1.00 30.45 C ATOM 450 O THR A 39 -20.504 -10.992 0.949 1.00 41.15 O ATOM 451 CB THR A 39 -19.997 -8.504 2.608 1.00 12.53 C ATOM 452 OG1 THR A 39 -20.434 -7.642 3.640 1.00 32.53 O ATOM 453 CG2 THR A 39 -18.938 -7.779 1.796 1.00 1.32 C ATOM 0 H THR A 39 -22.178 -10.349 2.804 1.00 35.45 H new ATOM 0 HA THR A 39 -21.583 -7.939 1.259 1.00 32.01 H new ATOM 0 HB THR A 39 -19.566 -9.424 3.004 1.00 12.53 H new ATOM 0 HG1 THR A 39 -19.657 -7.266 4.104 1.00 32.53 H new ATOM 0 HG21 THR A 39 -18.085 -7.547 2.434 1.00 1.32 H new ATOM 0 HG22 THR A 39 -18.613 -8.415 0.972 1.00 1.32 H new ATOM 0 HG23 THR A 39 -19.355 -6.854 1.398 1.00 1.32 H new ATOM 461 N PRO A 40 -20.812 -9.397 -0.613 1.00 55.11 N ATOM 462 CA PRO A 40 -20.295 -10.188 -1.727 1.00 40.31 C ATOM 463 C PRO A 40 -18.798 -10.402 -1.547 1.00 14.33 C ATOM 464 O PRO A 40 -18.129 -9.562 -0.950 1.00 62.45 O ATOM 465 CB PRO A 40 -20.554 -9.298 -2.946 1.00 11.30 C ATOM 466 CG PRO A 40 -21.617 -8.373 -2.507 1.00 2.24 C ATOM 467 CD PRO A 40 -21.348 -8.110 -1.069 1.00 33.15 C ATOM 0 HA PRO A 40 -20.756 -11.172 -1.812 1.00 40.31 H new ATOM 0 HB2 PRO A 40 -19.655 -8.758 -3.242 1.00 11.30 H new ATOM 0 HB3 PRO A 40 -20.870 -9.886 -3.807 1.00 11.30 H new ATOM 0 HG2 PRO A 40 -21.596 -7.449 -3.085 1.00 2.24 H new ATOM 0 HG3 PRO A 40 -22.604 -8.815 -2.647 1.00 2.24 H new ATOM 0 HD2 PRO A 40 -20.633 -7.299 -0.930 1.00 33.15 H new ATOM 0 HD3 PRO A 40 -22.254 -7.832 -0.530 1.00 33.15 H new ATOM 475 N GLU A 41 -18.288 -11.506 -2.058 1.00 61.43 N ATOM 476 CA GLU A 41 -16.883 -11.863 -1.863 1.00 44.01 C ATOM 477 C GLU A 41 -15.924 -10.825 -2.346 1.00 42.12 C ATOM 478 O GLU A 41 -16.073 -10.259 -3.434 1.00 53.43 O ATOM 479 CB GLU A 41 -16.564 -13.234 -2.391 1.00 13.25 C ATOM 480 CG GLU A 41 -17.189 -14.297 -1.546 1.00 2.32 C ATOM 481 CD GLU A 41 -17.029 -15.676 -2.102 1.00 34.42 C ATOM 482 OE1 GLU A 41 -17.864 -16.093 -2.940 1.00 65.21 O ATOM 483 OE2 GLU A 41 -16.077 -16.378 -1.710 1.00 15.41 O ATOM 0 H GLU A 41 -18.820 -12.176 -2.613 1.00 61.43 H new ATOM 0 HA GLU A 41 -16.741 -11.899 -0.783 1.00 44.01 H new ATOM 0 HB2 GLU A 41 -16.922 -13.324 -3.417 1.00 13.25 H new ATOM 0 HB3 GLU A 41 -15.483 -13.374 -2.417 1.00 13.25 H new ATOM 0 HG2 GLU A 41 -16.749 -14.263 -0.550 1.00 2.32 H new ATOM 0 HG3 GLU A 41 -18.251 -14.081 -1.433 1.00 2.32 H new ATOM 490 N ILE A 42 -14.948 -10.590 -1.532 1.00 2.04 N ATOM 491 CA ILE A 42 -14.012 -9.508 -1.751 1.00 4.22 C ATOM 492 C ILE A 42 -12.648 -10.027 -2.168 1.00 1.54 C ATOM 493 O ILE A 42 -12.126 -10.986 -1.589 1.00 33.41 O ATOM 494 CB ILE A 42 -13.783 -8.620 -0.475 1.00 14.02 C ATOM 495 CG1 ILE A 42 -15.074 -8.157 0.191 1.00 4.44 C ATOM 496 CG2 ILE A 42 -12.948 -7.417 -0.815 1.00 64.12 C ATOM 497 CD1 ILE A 42 -15.731 -9.183 1.093 1.00 12.34 C ATOM 0 H ILE A 42 -14.767 -11.137 -0.691 1.00 2.04 H new ATOM 0 HA ILE A 42 -14.467 -8.908 -2.539 1.00 4.22 H new ATOM 0 HB ILE A 42 -13.264 -9.260 0.239 1.00 14.02 H new ATOM 0 HG12 ILE A 42 -14.863 -7.262 0.777 1.00 4.44 H new ATOM 0 HG13 ILE A 42 -15.783 -7.870 -0.585 1.00 4.44 H new ATOM 0 HG21 ILE A 42 -12.799 -6.813 0.080 1.00 64.12 H new ATOM 0 HG22 ILE A 42 -11.981 -7.742 -1.199 1.00 64.12 H new ATOM 0 HG23 ILE A 42 -13.458 -6.823 -1.573 1.00 64.12 H new ATOM 0 HD11 ILE A 42 -16.641 -8.762 1.520 1.00 12.34 H new ATOM 0 HD12 ILE A 42 -15.980 -10.071 0.513 1.00 12.34 H new ATOM 0 HD13 ILE A 42 -15.045 -9.454 1.896 1.00 12.34 H new ATOM 509 N VAL A 43 -12.088 -9.399 -3.153 1.00 40.44 N ATOM 510 CA VAL A 43 -10.736 -9.682 -3.588 1.00 12.23 C ATOM 511 C VAL A 43 -9.972 -8.367 -3.723 1.00 52.24 C ATOM 512 O VAL A 43 -10.572 -7.334 -4.049 1.00 52.33 O ATOM 513 CB VAL A 43 -10.684 -10.467 -4.935 1.00 63.12 C ATOM 514 CG1 VAL A 43 -11.262 -9.647 -6.083 1.00 53.43 C ATOM 515 CG2 VAL A 43 -9.257 -10.917 -5.242 1.00 11.12 C ATOM 0 H VAL A 43 -12.552 -8.666 -3.690 1.00 40.44 H new ATOM 0 HA VAL A 43 -10.274 -10.321 -2.836 1.00 12.23 H new ATOM 0 HB VAL A 43 -11.305 -11.356 -4.827 1.00 63.12 H new ATOM 0 HG11 VAL A 43 -11.209 -10.225 -7.006 1.00 53.43 H new ATOM 0 HG12 VAL A 43 -12.302 -9.402 -5.867 1.00 53.43 H new ATOM 0 HG13 VAL A 43 -10.688 -8.727 -6.198 1.00 53.43 H new ATOM 0 HG21 VAL A 43 -9.243 -11.463 -6.185 1.00 11.12 H new ATOM 0 HG22 VAL A 43 -8.609 -10.044 -5.318 1.00 11.12 H new ATOM 0 HG23 VAL A 43 -8.900 -11.566 -4.442 1.00 11.12 H new ATOM 525 N SER A 44 -8.696 -8.382 -3.443 1.00 73.12 N ATOM 526 CA SER A 44 -7.876 -7.218 -3.624 1.00 21.34 C ATOM 527 C SER A 44 -7.560 -7.033 -5.107 1.00 43.34 C ATOM 528 O SER A 44 -7.098 -7.966 -5.785 1.00 21.41 O ATOM 529 CB SER A 44 -6.605 -7.367 -2.814 1.00 34.24 C ATOM 530 OG SER A 44 -6.917 -7.530 -1.437 1.00 32.34 O ATOM 0 H SER A 44 -8.199 -9.198 -3.085 1.00 73.12 H new ATOM 0 HA SER A 44 -8.409 -6.333 -3.276 1.00 21.34 H new ATOM 0 HB2 SER A 44 -6.037 -8.226 -3.170 1.00 34.24 H new ATOM 0 HB3 SER A 44 -5.973 -6.489 -2.950 1.00 34.24 H new ATOM 0 HG SER A 44 -6.088 -7.627 -0.923 1.00 32.34 H new ATOM 536 N ALA A 45 -7.832 -5.866 -5.612 1.00 51.00 N ATOM 537 CA ALA A 45 -7.594 -5.556 -6.999 1.00 3.05 C ATOM 538 C ALA A 45 -7.070 -4.158 -7.154 1.00 30.53 C ATOM 539 O ALA A 45 -7.276 -3.307 -6.295 1.00 32.32 O ATOM 540 CB ALA A 45 -8.860 -5.731 -7.795 1.00 72.14 C ATOM 0 H ALA A 45 -8.228 -5.095 -5.074 1.00 51.00 H new ATOM 0 HA ALA A 45 -6.840 -6.245 -7.379 1.00 3.05 H new ATOM 0 HB1 ALA A 45 -8.668 -5.494 -8.841 1.00 72.14 H new ATOM 0 HB2 ALA A 45 -9.201 -6.763 -7.714 1.00 72.14 H new ATOM 0 HB3 ALA A 45 -9.629 -5.063 -7.407 1.00 72.14 H new ATOM 546 N THR A 46 -6.410 -3.938 -8.234 1.00 41.15 N ATOM 547 CA THR A 46 -5.815 -2.680 -8.541 1.00 2.31 C ATOM 548 C THR A 46 -6.508 -2.043 -9.729 1.00 30.31 C ATOM 549 O THR A 46 -6.666 -2.664 -10.773 1.00 60.22 O ATOM 550 CB THR A 46 -4.318 -2.861 -8.857 1.00 23.40 C ATOM 551 OG1 THR A 46 -3.673 -3.471 -7.738 1.00 53.01 O ATOM 552 CG2 THR A 46 -3.653 -1.520 -9.151 1.00 61.43 C ATOM 0 H THR A 46 -6.263 -4.647 -8.952 1.00 41.15 H new ATOM 0 HA THR A 46 -5.924 -2.029 -7.673 1.00 2.31 H new ATOM 0 HB THR A 46 -4.225 -3.493 -9.740 1.00 23.40 H new ATOM 0 HG1 THR A 46 -3.083 -4.188 -8.051 1.00 53.01 H new ATOM 0 HG21 THR A 46 -2.597 -1.678 -9.371 1.00 61.43 H new ATOM 0 HG22 THR A 46 -4.137 -1.055 -10.010 1.00 61.43 H new ATOM 0 HG23 THR A 46 -3.749 -0.868 -8.283 1.00 61.43 H new ATOM 560 N LEU A 47 -6.936 -0.833 -9.548 1.00 61.42 N ATOM 561 CA LEU A 47 -7.548 -0.059 -10.583 1.00 53.20 C ATOM 562 C LEU A 47 -6.527 0.946 -11.133 1.00 1.15 C ATOM 563 O LEU A 47 -6.221 1.948 -10.482 1.00 53.32 O ATOM 564 CB LEU A 47 -8.794 0.654 -10.029 1.00 15.20 C ATOM 565 CG LEU A 47 -9.527 1.582 -10.986 1.00 15.51 C ATOM 566 CD1 LEU A 47 -9.936 0.848 -12.249 1.00 52.24 C ATOM 567 CD2 LEU A 47 -10.748 2.187 -10.312 1.00 50.42 C ATOM 0 H LEU A 47 -6.868 -0.344 -8.655 1.00 61.42 H new ATOM 0 HA LEU A 47 -7.867 -0.708 -11.399 1.00 53.20 H new ATOM 0 HB2 LEU A 47 -9.496 -0.105 -9.685 1.00 15.20 H new ATOM 0 HB3 LEU A 47 -8.496 1.232 -9.155 1.00 15.20 H new ATOM 0 HG LEU A 47 -8.845 2.386 -11.263 1.00 15.51 H new ATOM 0 HD11 LEU A 47 -10.458 1.534 -12.916 1.00 52.24 H new ATOM 0 HD12 LEU A 47 -9.048 0.461 -12.749 1.00 52.24 H new ATOM 0 HD13 LEU A 47 -10.596 0.020 -11.991 1.00 52.24 H new ATOM 0 HD21 LEU A 47 -11.260 2.848 -11.012 1.00 50.42 H new ATOM 0 HD22 LEU A 47 -11.425 1.391 -10.004 1.00 50.42 H new ATOM 0 HD23 LEU A 47 -10.436 2.757 -9.437 1.00 50.42 H new ATOM 579 N PRO A 48 -5.952 0.664 -12.310 1.00 4.22 N ATOM 580 CA PRO A 48 -4.958 1.528 -12.921 1.00 74.01 C ATOM 581 C PRO A 48 -5.591 2.670 -13.720 1.00 42.14 C ATOM 582 O PRO A 48 -6.620 2.494 -14.396 1.00 20.11 O ATOM 583 CB PRO A 48 -4.189 0.577 -13.839 1.00 24.10 C ATOM 584 CG PRO A 48 -5.176 -0.480 -14.224 1.00 21.45 C ATOM 585 CD PRO A 48 -6.228 -0.527 -13.142 1.00 32.44 C ATOM 0 HA PRO A 48 -4.330 2.025 -12.181 1.00 74.01 H new ATOM 0 HB2 PRO A 48 -3.808 1.099 -14.717 1.00 24.10 H new ATOM 0 HB3 PRO A 48 -3.329 0.145 -13.327 1.00 24.10 H new ATOM 0 HG2 PRO A 48 -5.627 -0.251 -15.189 1.00 21.45 H new ATOM 0 HG3 PRO A 48 -4.684 -1.447 -14.324 1.00 21.45 H new ATOM 0 HD2 PRO A 48 -7.233 -0.494 -13.563 1.00 32.44 H new ATOM 0 HD3 PRO A 48 -6.157 -1.445 -12.558 1.00 32.44 H new ATOM 593 N GLY A 49 -4.987 3.836 -13.627 1.00 41.12 N ATOM 594 CA GLY A 49 -5.480 4.985 -14.336 1.00 12.50 C ATOM 595 C GLY A 49 -6.394 5.823 -13.480 1.00 73.43 C ATOM 596 O GLY A 49 -6.957 6.810 -13.941 1.00 35.45 O ATOM 0 H GLY A 49 -4.153 4.007 -13.065 1.00 41.12 H new ATOM 0 HA2 GLY A 49 -4.640 5.592 -14.672 1.00 12.50 H new ATOM 0 HA3 GLY A 49 -6.015 4.659 -15.228 1.00 12.50 H new ATOM 600 N PHE A 50 -6.532 5.442 -12.229 1.00 0.32 N ATOM 601 CA PHE A 50 -7.408 6.129 -11.301 1.00 32.13 C ATOM 602 C PHE A 50 -6.684 6.390 -10.025 1.00 75.20 C ATOM 603 O PHE A 50 -5.684 5.761 -9.747 1.00 51.02 O ATOM 604 CB PHE A 50 -8.708 5.355 -11.057 1.00 33.22 C ATOM 605 CG PHE A 50 -9.619 5.309 -12.255 1.00 13.55 C ATOM 606 CD1 PHE A 50 -9.504 4.309 -13.205 1.00 70.24 C ATOM 607 CD2 PHE A 50 -10.589 6.277 -12.426 1.00 54.21 C ATOM 608 CE1 PHE A 50 -10.336 4.280 -14.299 1.00 50.31 C ATOM 609 CE2 PHE A 50 -11.425 6.254 -13.518 1.00 13.12 C ATOM 610 CZ PHE A 50 -11.298 5.255 -14.457 1.00 71.20 C ATOM 0 H PHE A 50 -6.040 4.646 -11.824 1.00 0.32 H new ATOM 0 HA PHE A 50 -7.695 7.082 -11.746 1.00 32.13 H new ATOM 0 HB2 PHE A 50 -8.463 4.336 -10.759 1.00 33.22 H new ATOM 0 HB3 PHE A 50 -9.241 5.812 -10.223 1.00 33.22 H new ATOM 0 HD1 PHE A 50 -8.752 3.543 -13.085 1.00 70.24 H new ATOM 0 HD2 PHE A 50 -10.693 7.063 -11.692 1.00 54.21 H new ATOM 0 HE1 PHE A 50 -10.236 3.495 -15.034 1.00 50.31 H new ATOM 0 HE2 PHE A 50 -12.179 7.018 -13.639 1.00 13.12 H new ATOM 0 HZ PHE A 50 -11.951 5.235 -15.317 1.00 71.20 H new ATOM 620 N GLN A 51 -7.182 7.287 -9.242 1.00 14.20 N ATOM 621 CA GLN A 51 -6.486 7.694 -8.073 1.00 30.30 C ATOM 622 C GLN A 51 -7.416 7.884 -6.927 1.00 61.34 C ATOM 623 O GLN A 51 -8.532 8.383 -7.093 1.00 2.01 O ATOM 624 CB GLN A 51 -5.752 8.973 -8.400 1.00 71.10 C ATOM 625 CG GLN A 51 -4.943 9.589 -7.298 1.00 31.44 C ATOM 626 CD GLN A 51 -4.138 10.732 -7.839 1.00 14.42 C ATOM 627 OE1 GLN A 51 -3.026 10.548 -8.304 1.00 65.24 O ATOM 628 NE2 GLN A 51 -4.691 11.905 -7.808 1.00 14.01 N ATOM 0 H GLN A 51 -8.076 7.754 -9.394 1.00 14.20 H new ATOM 0 HA GLN A 51 -5.779 6.921 -7.770 1.00 30.30 H new ATOM 0 HB2 GLN A 51 -5.087 8.777 -9.241 1.00 71.10 H new ATOM 0 HB3 GLN A 51 -6.483 9.708 -8.736 1.00 71.10 H new ATOM 0 HG2 GLN A 51 -5.601 9.940 -6.503 1.00 31.44 H new ATOM 0 HG3 GLN A 51 -4.282 8.842 -6.858 1.00 31.44 H new ATOM 0 HE21 GLN A 51 -5.623 12.019 -7.411 1.00 14.01 H new ATOM 0 HE22 GLN A 51 -4.193 12.713 -8.181 1.00 14.01 H new ATOM 637 N ARG A 52 -6.959 7.458 -5.770 1.00 5.44 N ATOM 638 CA ARG A 52 -7.699 7.601 -4.567 1.00 12.44 C ATOM 639 C ARG A 52 -7.229 8.862 -3.920 1.00 54.44 C ATOM 640 O ARG A 52 -6.039 9.192 -3.977 1.00 13.33 O ATOM 641 CB ARG A 52 -7.445 6.423 -3.601 1.00 22.12 C ATOM 642 CG ARG A 52 -8.376 6.414 -2.385 1.00 4.34 C ATOM 643 CD ARG A 52 -7.932 5.441 -1.286 1.00 1.32 C ATOM 644 NE ARG A 52 -7.746 4.043 -1.739 1.00 75.25 N ATOM 645 CZ ARG A 52 -8.057 2.959 -0.992 1.00 75.34 C ATOM 646 NH1 ARG A 52 -8.774 3.095 0.120 1.00 44.23 N ATOM 647 NH2 ARG A 52 -7.678 1.734 -1.372 1.00 35.22 N ATOM 0 H ARG A 52 -6.055 7.001 -5.652 1.00 5.44 H new ATOM 0 HA ARG A 52 -8.765 7.621 -4.792 1.00 12.44 H new ATOM 0 HB2 ARG A 52 -7.563 5.486 -4.145 1.00 22.12 H new ATOM 0 HB3 ARG A 52 -6.412 6.463 -3.256 1.00 22.12 H new ATOM 0 HG2 ARG A 52 -8.429 7.420 -1.970 1.00 4.34 H new ATOM 0 HG3 ARG A 52 -9.383 6.150 -2.709 1.00 4.34 H new ATOM 0 HD2 ARG A 52 -6.995 5.799 -0.859 1.00 1.32 H new ATOM 0 HD3 ARG A 52 -8.672 5.455 -0.486 1.00 1.32 H new ATOM 0 HE ARG A 52 -7.360 3.888 -2.670 1.00 75.25 H new ATOM 0 HH11 ARG A 52 -9.091 4.019 0.412 1.00 44.23 H new ATOM 0 HH12 ARG A 52 -9.006 2.275 0.680 1.00 44.23 H new ATOM 0 HH21 ARG A 52 -7.148 1.609 -2.234 1.00 35.22 H new ATOM 0 HH22 ARG A 52 -7.919 0.925 -0.799 1.00 35.22 H new ATOM 661 N PHE A 53 -8.114 9.552 -3.333 1.00 2.24 N ATOM 662 CA PHE A 53 -7.778 10.743 -2.636 1.00 75.52 C ATOM 663 C PHE A 53 -7.854 10.522 -1.165 1.00 12.42 C ATOM 664 O PHE A 53 -8.309 9.486 -0.715 1.00 74.21 O ATOM 665 CB PHE A 53 -8.641 11.916 -3.089 1.00 24.33 C ATOM 666 CG PHE A 53 -8.182 12.522 -4.386 1.00 35.42 C ATOM 667 CD1 PHE A 53 -8.064 11.766 -5.552 1.00 52.40 C ATOM 668 CD2 PHE A 53 -7.836 13.854 -4.427 1.00 32.23 C ATOM 669 CE1 PHE A 53 -7.621 12.336 -6.710 1.00 3.01 C ATOM 670 CE2 PHE A 53 -7.388 14.433 -5.583 1.00 62.20 C ATOM 671 CZ PHE A 53 -7.278 13.678 -6.732 1.00 24.11 C ATOM 0 H PHE A 53 -9.106 9.315 -3.315 1.00 2.24 H new ATOM 0 HA PHE A 53 -6.748 11.006 -2.877 1.00 75.52 H new ATOM 0 HB2 PHE A 53 -9.672 11.580 -3.197 1.00 24.33 H new ATOM 0 HB3 PHE A 53 -8.636 12.683 -2.315 1.00 24.33 H new ATOM 0 HD1 PHE A 53 -8.326 10.718 -5.538 1.00 52.40 H new ATOM 0 HD2 PHE A 53 -7.920 14.452 -3.532 1.00 32.23 H new ATOM 0 HE1 PHE A 53 -7.538 11.742 -7.608 1.00 3.01 H new ATOM 0 HE2 PHE A 53 -7.121 15.479 -5.596 1.00 62.20 H new ATOM 0 HZ PHE A 53 -6.925 14.132 -7.646 1.00 24.11 H new ATOM 681 N ARG A 54 -7.362 11.452 -0.429 1.00 21.35 N ATOM 682 CA ARG A 54 -7.289 11.331 0.989 1.00 71.24 C ATOM 683 C ARG A 54 -8.051 12.502 1.592 1.00 55.11 C ATOM 684 O ARG A 54 -8.221 13.527 0.934 1.00 42.22 O ATOM 685 CB ARG A 54 -5.815 11.396 1.398 1.00 44.24 C ATOM 686 CG ARG A 54 -5.519 11.117 2.850 1.00 71.15 C ATOM 687 CD ARG A 54 -5.541 9.649 3.133 1.00 74.53 C ATOM 688 NE ARG A 54 -5.192 9.356 4.531 1.00 34.12 N ATOM 689 CZ ARG A 54 -4.664 8.199 4.973 1.00 71.41 C ATOM 690 NH1 ARG A 54 -4.545 7.157 4.149 1.00 13.31 N ATOM 691 NH2 ARG A 54 -4.301 8.083 6.253 1.00 70.44 N ATOM 0 H ARG A 54 -6.993 12.330 -0.795 1.00 21.35 H new ATOM 0 HA ARG A 54 -7.719 10.392 1.336 1.00 71.24 H new ATOM 0 HB2 ARG A 54 -5.258 10.682 0.791 1.00 44.24 H new ATOM 0 HB3 ARG A 54 -5.434 12.388 1.154 1.00 44.24 H new ATOM 0 HG2 ARG A 54 -4.543 11.526 3.110 1.00 71.15 H new ATOM 0 HG3 ARG A 54 -6.253 11.622 3.477 1.00 71.15 H new ATOM 0 HD2 ARG A 54 -6.532 9.252 2.915 1.00 74.53 H new ATOM 0 HD3 ARG A 54 -4.841 9.141 2.470 1.00 74.53 H new ATOM 0 HE ARG A 54 -5.364 10.087 5.221 1.00 34.12 H new ATOM 0 HH11 ARG A 54 -4.854 7.235 3.180 1.00 13.31 H new ATOM 0 HH12 ARG A 54 -4.144 6.282 4.488 1.00 13.31 H new ATOM 0 HH21 ARG A 54 -4.424 8.869 6.891 1.00 70.44 H new ATOM 0 HH22 ARG A 54 -3.901 7.208 6.592 1.00 70.44 H new ATOM 796 N TYR A 60 -13.972 13.553 1.009 1.00 34.43 N ATOM 797 CA TYR A 60 -13.614 12.213 1.429 1.00 40.53 C ATOM 798 C TYR A 60 -12.717 11.583 0.369 1.00 53.10 C ATOM 799 O TYR A 60 -12.555 12.155 -0.712 1.00 32.22 O ATOM 800 CB TYR A 60 -14.899 11.367 1.543 1.00 34.05 C ATOM 801 CG TYR A 60 -15.978 11.959 2.414 1.00 33.15 C ATOM 802 CD1 TYR A 60 -16.014 11.727 3.781 1.00 0.22 C ATOM 803 CD2 TYR A 60 -16.977 12.742 1.854 1.00 44.12 C ATOM 804 CE1 TYR A 60 -17.017 12.264 4.562 1.00 74.12 C ATOM 805 CE2 TYR A 60 -17.976 13.281 2.624 1.00 64.40 C ATOM 806 CZ TYR A 60 -17.994 13.042 3.975 1.00 22.55 C ATOM 807 OH TYR A 60 -19.006 13.579 4.743 1.00 53.34 O ATOM 0 HA TYR A 60 -13.097 12.252 2.388 1.00 40.53 H new ATOM 0 HB2 TYR A 60 -15.304 11.213 0.543 1.00 34.05 H new ATOM 0 HB3 TYR A 60 -14.635 10.385 1.935 1.00 34.05 H new ATOM 0 HD1 TYR A 60 -15.248 11.119 4.240 1.00 0.22 H new ATOM 0 HD2 TYR A 60 -16.968 12.931 0.791 1.00 44.12 H new ATOM 0 HE1 TYR A 60 -17.037 12.077 5.625 1.00 74.12 H new ATOM 0 HE2 TYR A 60 -18.744 13.890 2.170 1.00 64.40 H new ATOM 0 HH TYR A 60 -19.608 14.101 4.172 1.00 53.34 H new ATOM 817 N PRO A 61 -12.098 10.417 0.659 1.00 53.50 N ATOM 818 CA PRO A 61 -11.320 9.681 -0.334 1.00 24.14 C ATOM 819 C PRO A 61 -12.178 9.288 -1.542 1.00 53.32 C ATOM 820 O PRO A 61 -12.943 8.320 -1.491 1.00 44.40 O ATOM 821 CB PRO A 61 -10.853 8.428 0.431 1.00 21.01 C ATOM 822 CG PRO A 61 -10.867 8.853 1.853 1.00 12.43 C ATOM 823 CD PRO A 61 -12.062 9.743 1.979 1.00 64.11 C ATOM 0 HA PRO A 61 -10.497 10.271 -0.739 1.00 24.14 H new ATOM 0 HB2 PRO A 61 -11.520 7.583 0.260 1.00 21.01 H new ATOM 0 HB3 PRO A 61 -9.857 8.116 0.117 1.00 21.01 H new ATOM 0 HG2 PRO A 61 -10.942 7.995 2.521 1.00 12.43 H new ATOM 0 HG3 PRO A 61 -9.951 9.382 2.116 1.00 12.43 H new ATOM 0 HD2 PRO A 61 -12.973 9.175 2.170 1.00 64.11 H new ATOM 0 HD3 PRO A 61 -11.953 10.456 2.796 1.00 64.11 H new ATOM 831 N CYS A 62 -12.106 10.085 -2.574 1.00 74.14 N ATOM 832 CA CYS A 62 -12.843 9.856 -3.783 1.00 75.22 C ATOM 833 C CYS A 62 -11.919 9.262 -4.854 1.00 52.12 C ATOM 834 O CYS A 62 -10.712 9.083 -4.615 1.00 61.45 O ATOM 835 CB CYS A 62 -13.444 11.190 -4.246 1.00 54.44 C ATOM 836 SG CYS A 62 -12.204 12.476 -4.541 1.00 30.25 S ATOM 0 H CYS A 62 -11.525 10.923 -2.597 1.00 74.14 H new ATOM 0 HA CYS A 62 -13.648 9.143 -3.609 1.00 75.22 H new ATOM 0 HB2 CYS A 62 -14.011 11.026 -5.162 1.00 54.44 H new ATOM 0 HB3 CYS A 62 -14.150 11.542 -3.494 1.00 54.44 H new ATOM 0 HG CYS A 62 -12.715 13.409 -5.288 1.00 30.25 H new ATOM 842 N ILE A 63 -12.480 8.947 -6.014 1.00 63.01 N ATOM 843 CA ILE A 63 -11.723 8.382 -7.124 1.00 43.15 C ATOM 844 C ILE A 63 -11.912 9.229 -8.336 1.00 74.20 C ATOM 845 O ILE A 63 -13.024 9.595 -8.655 1.00 21.51 O ATOM 846 CB ILE A 63 -12.204 6.935 -7.488 1.00 41.34 C ATOM 847 CG1 ILE A 63 -12.016 5.994 -6.338 1.00 55.35 C ATOM 848 CG2 ILE A 63 -11.513 6.382 -8.737 1.00 21.12 C ATOM 849 CD1 ILE A 63 -10.585 5.817 -5.898 1.00 41.32 C ATOM 0 H ILE A 63 -13.472 9.076 -6.212 1.00 63.01 H new ATOM 0 HA ILE A 63 -10.679 8.346 -6.813 1.00 43.15 H new ATOM 0 HB ILE A 63 -13.268 7.015 -7.710 1.00 41.34 H new ATOM 0 HG12 ILE A 63 -12.600 6.355 -5.492 1.00 55.35 H new ATOM 0 HG13 ILE A 63 -12.421 5.020 -6.613 1.00 55.35 H new ATOM 0 HG21 ILE A 63 -11.883 5.378 -8.943 1.00 21.12 H new ATOM 0 HG22 ILE A 63 -11.726 7.029 -9.588 1.00 21.12 H new ATOM 0 HG23 ILE A 63 -10.436 6.345 -8.571 1.00 21.12 H new ATOM 0 HD11 ILE A 63 -10.545 5.119 -5.061 1.00 41.32 H new ATOM 0 HD12 ILE A 63 -9.996 5.424 -6.726 1.00 41.32 H new ATOM 0 HD13 ILE A 63 -10.178 6.779 -5.588 1.00 41.32 H new ATOM 861 N VAL A 64 -10.846 9.566 -8.972 1.00 33.50 N ATOM 862 CA VAL A 64 -10.892 10.230 -10.261 1.00 61.53 C ATOM 863 C VAL A 64 -9.751 9.669 -11.099 1.00 74.33 C ATOM 864 O VAL A 64 -8.767 9.173 -10.531 1.00 12.32 O ATOM 865 CB VAL A 64 -10.740 11.801 -10.169 1.00 63.24 C ATOM 866 CG1 VAL A 64 -11.890 12.445 -9.417 1.00 31.13 C ATOM 867 CG2 VAL A 64 -9.418 12.189 -9.531 1.00 62.01 C ATOM 0 H VAL A 64 -9.902 9.395 -8.624 1.00 33.50 H new ATOM 0 HA VAL A 64 -11.871 10.043 -10.703 1.00 61.53 H new ATOM 0 HB VAL A 64 -10.760 12.175 -11.192 1.00 63.24 H new ATOM 0 HG11 VAL A 64 -11.741 13.524 -9.380 1.00 31.13 H new ATOM 0 HG12 VAL A 64 -12.827 12.225 -9.928 1.00 31.13 H new ATOM 0 HG13 VAL A 64 -11.928 12.049 -8.402 1.00 31.13 H new ATOM 0 HG21 VAL A 64 -9.343 13.275 -9.482 1.00 62.01 H new ATOM 0 HG22 VAL A 64 -9.365 11.775 -8.524 1.00 62.01 H new ATOM 0 HG23 VAL A 64 -8.596 11.795 -10.129 1.00 62.01 H new ATOM 877 N PRO A 65 -9.872 9.678 -12.430 1.00 54.22 N ATOM 878 CA PRO A 65 -8.800 9.228 -13.311 1.00 2.23 C ATOM 879 C PRO A 65 -7.523 10.060 -13.115 1.00 70.53 C ATOM 880 O PRO A 65 -7.578 11.292 -12.975 1.00 54.11 O ATOM 881 CB PRO A 65 -9.362 9.424 -14.724 1.00 22.02 C ATOM 882 CG PRO A 65 -10.552 10.303 -14.562 1.00 54.25 C ATOM 883 CD PRO A 65 -11.065 10.086 -13.175 1.00 24.43 C ATOM 0 HA PRO A 65 -8.514 8.195 -13.110 1.00 2.23 H new ATOM 0 HB2 PRO A 65 -8.622 9.883 -15.380 1.00 22.02 H new ATOM 0 HB3 PRO A 65 -9.638 8.469 -15.172 1.00 22.02 H new ATOM 0 HG2 PRO A 65 -10.284 11.348 -14.716 1.00 54.25 H new ATOM 0 HG3 PRO A 65 -11.316 10.058 -15.299 1.00 54.25 H new ATOM 0 HD2 PRO A 65 -11.505 10.994 -12.763 1.00 24.43 H new ATOM 0 HD3 PRO A 65 -11.837 9.317 -13.148 1.00 24.43 H new ATOM 891 N SER A 66 -6.404 9.395 -13.079 1.00 21.42 N ATOM 892 CA SER A 66 -5.139 10.043 -12.866 1.00 20.25 C ATOM 893 C SER A 66 -4.204 9.690 -13.987 1.00 54.32 C ATOM 894 O SER A 66 -4.298 8.594 -14.554 1.00 4.24 O ATOM 895 CB SER A 66 -4.542 9.624 -11.521 1.00 54.15 C ATOM 896 OG SER A 66 -3.332 10.330 -11.211 1.00 21.52 O ATOM 0 H SER A 66 -6.342 8.384 -13.197 1.00 21.42 H new ATOM 0 HA SER A 66 -5.288 11.123 -12.848 1.00 20.25 H new ATOM 0 HB2 SER A 66 -5.273 9.800 -10.732 1.00 54.15 H new ATOM 0 HB3 SER A 66 -4.340 8.553 -11.535 1.00 54.15 H new ATOM 0 HG SER A 66 -3.235 10.402 -10.238 1.00 21.52 H new ATOM 902 N GLU A 67 -3.332 10.610 -14.327 1.00 11.53 N ATOM 903 CA GLU A 67 -2.353 10.378 -15.371 1.00 30.33 C ATOM 904 C GLU A 67 -1.351 9.350 -14.886 1.00 32.11 C ATOM 905 O GLU A 67 -0.904 8.498 -15.643 1.00 44.13 O ATOM 906 CB GLU A 67 -1.646 11.676 -15.720 1.00 23.34 C ATOM 907 CG GLU A 67 -2.591 12.804 -16.078 1.00 74.04 C ATOM 908 CD GLU A 67 -1.871 14.098 -16.333 1.00 24.45 C ATOM 909 OE1 GLU A 67 -1.412 14.739 -15.349 1.00 12.23 O ATOM 910 OE2 GLU A 67 -1.764 14.505 -17.504 1.00 54.01 O ATOM 0 H GLU A 67 -3.278 11.532 -13.895 1.00 11.53 H new ATOM 0 HA GLU A 67 -2.852 10.007 -16.266 1.00 30.33 H new ATOM 0 HB2 GLU A 67 -1.031 11.983 -14.875 1.00 23.34 H new ATOM 0 HB3 GLU A 67 -0.971 11.499 -16.558 1.00 23.34 H new ATOM 0 HG2 GLU A 67 -3.161 12.528 -16.965 1.00 74.04 H new ATOM 0 HG3 GLU A 67 -3.308 12.944 -15.269 1.00 74.04 H new ATOM 917 N LYS A 68 -1.034 9.433 -13.610 1.00 24.22 N ATOM 918 CA LYS A 68 -0.175 8.488 -12.972 1.00 54.43 C ATOM 919 C LYS A 68 -0.778 8.082 -11.663 1.00 54.32 C ATOM 920 O LYS A 68 -0.458 8.644 -10.602 1.00 22.32 O ATOM 921 CB LYS A 68 1.272 9.002 -12.773 1.00 35.35 C ATOM 922 CG LYS A 68 2.036 9.307 -14.064 1.00 3.34 C ATOM 923 CD LYS A 68 2.092 8.097 -15.001 1.00 41.33 C ATOM 924 CE LYS A 68 2.752 6.891 -14.356 1.00 73.14 C ATOM 925 NZ LYS A 68 2.722 5.721 -15.252 1.00 23.44 N ATOM 0 H LYS A 68 -1.374 10.169 -12.991 1.00 24.22 H new ATOM 0 HA LYS A 68 -0.092 7.626 -13.635 1.00 54.43 H new ATOM 0 HB2 LYS A 68 1.239 9.907 -12.166 1.00 35.35 H new ATOM 0 HB3 LYS A 68 1.831 8.258 -12.206 1.00 35.35 H new ATOM 0 HG2 LYS A 68 1.559 10.141 -14.578 1.00 3.34 H new ATOM 0 HG3 LYS A 68 3.050 9.622 -13.819 1.00 3.34 H new ATOM 0 HD2 LYS A 68 1.080 7.832 -15.308 1.00 41.33 H new ATOM 0 HD3 LYS A 68 2.639 8.366 -15.905 1.00 41.33 H new ATOM 0 HE2 LYS A 68 3.785 7.131 -14.102 1.00 73.14 H new ATOM 0 HE3 LYS A 68 2.242 6.650 -13.423 1.00 73.14 H new ATOM 0 HZ1 LYS A 68 3.180 4.913 -14.784 1.00 23.44 H new ATOM 0 HZ2 LYS A 68 1.735 5.479 -15.474 1.00 23.44 H new ATOM 0 HZ3 LYS A 68 3.230 5.944 -16.132 1.00 23.44 H new ATOM 939 N GLY A 69 -1.720 7.188 -11.740 1.00 14.52 N ATOM 940 CA GLY A 69 -2.339 6.703 -10.549 1.00 70.54 C ATOM 941 C GLY A 69 -2.890 5.313 -10.692 1.00 15.30 C ATOM 942 O GLY A 69 -3.235 4.876 -11.791 1.00 2.12 O ATOM 0 H GLY A 69 -2.072 6.785 -12.608 1.00 14.52 H new ATOM 0 HA2 GLY A 69 -1.611 6.717 -9.738 1.00 70.54 H new ATOM 0 HA3 GLY A 69 -3.145 7.379 -10.265 1.00 70.54 H new ATOM 946 N GLU A 70 -2.967 4.629 -9.584 1.00 70.51 N ATOM 947 CA GLU A 70 -3.535 3.319 -9.501 1.00 32.24 C ATOM 948 C GLU A 70 -4.042 3.115 -8.091 1.00 13.24 C ATOM 949 O GLU A 70 -3.385 3.530 -7.118 1.00 30.43 O ATOM 950 CB GLU A 70 -2.524 2.233 -9.891 1.00 34.20 C ATOM 951 CG GLU A 70 -1.277 2.180 -9.024 1.00 74.13 C ATOM 952 CD GLU A 70 -0.322 1.138 -9.484 1.00 72.41 C ATOM 953 OE1 GLU A 70 0.365 1.353 -10.494 1.00 73.22 O ATOM 954 OE2 GLU A 70 -0.252 0.071 -8.844 1.00 33.24 O ATOM 0 H GLU A 70 -2.625 4.981 -8.690 1.00 70.51 H new ATOM 0 HA GLU A 70 -4.359 3.235 -10.210 1.00 32.24 H new ATOM 0 HB2 GLU A 70 -3.020 1.263 -9.849 1.00 34.20 H new ATOM 0 HB3 GLU A 70 -2.223 2.392 -10.926 1.00 34.20 H new ATOM 0 HG2 GLU A 70 -0.785 3.153 -9.036 1.00 74.13 H new ATOM 0 HG3 GLU A 70 -1.562 1.980 -7.991 1.00 74.13 H new ATOM 961 N VAL A 71 -5.191 2.527 -7.964 1.00 64.51 N ATOM 962 CA VAL A 71 -5.780 2.317 -6.673 1.00 4.10 C ATOM 963 C VAL A 71 -5.841 0.852 -6.371 1.00 42.31 C ATOM 964 O VAL A 71 -6.463 0.095 -7.092 1.00 5.41 O ATOM 965 CB VAL A 71 -7.225 2.882 -6.602 1.00 51.00 C ATOM 966 CG1 VAL A 71 -7.800 2.752 -5.194 1.00 72.41 C ATOM 967 CG2 VAL A 71 -7.260 4.317 -7.061 1.00 3.11 C ATOM 0 H VAL A 71 -5.746 2.180 -8.746 1.00 64.51 H new ATOM 0 HA VAL A 71 -5.156 2.838 -5.947 1.00 4.10 H new ATOM 0 HB VAL A 71 -7.848 2.291 -7.274 1.00 51.00 H new ATOM 0 HG11 VAL A 71 -8.812 3.156 -5.176 1.00 72.41 H new ATOM 0 HG12 VAL A 71 -7.823 1.701 -4.906 1.00 72.41 H new ATOM 0 HG13 VAL A 71 -7.175 3.306 -4.493 1.00 72.41 H new ATOM 0 HG21 VAL A 71 -8.282 4.693 -7.003 1.00 3.11 H new ATOM 0 HG22 VAL A 71 -6.615 4.919 -6.421 1.00 3.11 H new ATOM 0 HG23 VAL A 71 -6.909 4.378 -8.091 1.00 3.11 H new ATOM 977 N HIS A 72 -5.193 0.454 -5.329 1.00 30.32 N ATOM 978 CA HIS A 72 -5.284 -0.905 -4.883 1.00 2.12 C ATOM 979 C HIS A 72 -6.404 -0.918 -3.884 1.00 11.21 C ATOM 980 O HIS A 72 -6.340 -0.218 -2.873 1.00 51.42 O ATOM 981 CB HIS A 72 -3.956 -1.391 -4.240 1.00 64.00 C ATOM 982 CG HIS A 72 -2.756 -1.337 -5.165 1.00 55.21 C ATOM 983 ND1 HIS A 72 -2.011 -2.440 -5.537 1.00 0.32 N ATOM 984 CD2 HIS A 72 -2.160 -0.279 -5.772 1.00 54.31 C ATOM 985 CE1 HIS A 72 -1.028 -2.052 -6.322 1.00 34.11 C ATOM 986 NE2 HIS A 72 -1.094 -0.754 -6.479 1.00 1.45 N ATOM 0 H HIS A 72 -4.589 1.051 -4.763 1.00 30.32 H new ATOM 0 HA HIS A 72 -5.470 -1.584 -5.715 1.00 2.12 H new ATOM 0 HB2 HIS A 72 -3.749 -0.782 -3.360 1.00 64.00 H new ATOM 0 HB3 HIS A 72 -4.088 -2.416 -3.895 1.00 64.00 H new ATOM 0 HD1 HIS A 72 -2.194 -3.401 -5.249 1.00 0.32 H new ATOM 0 HD2 HIS A 72 -2.473 0.753 -5.707 1.00 54.31 H new ATOM 0 HE1 HIS A 72 -0.286 -2.700 -6.765 1.00 34.11 H new ATOM 0 HE2 HIS A 72 -0.454 -0.190 -7.038 1.00 1.45 H new ATOM 995 N GLY A 73 -7.438 -1.630 -4.184 1.00 11.22 N ATOM 996 CA GLY A 73 -8.572 -1.644 -3.334 1.00 23.05 C ATOM 997 C GLY A 73 -9.200 -2.988 -3.279 1.00 44.12 C ATOM 998 O GLY A 73 -8.513 -4.008 -3.373 1.00 55.14 O ATOM 0 H GLY A 73 -7.518 -2.212 -5.018 1.00 11.22 H new ATOM 0 HA2 GLY A 73 -8.278 -1.338 -2.330 1.00 23.05 H new ATOM 0 HA3 GLY A 73 -9.301 -0.916 -3.688 1.00 23.05 H new ATOM 1002 N LYS A 74 -10.494 -3.010 -3.167 1.00 63.42 N ATOM 1003 CA LYS A 74 -11.209 -4.239 -3.006 1.00 53.41 C ATOM 1004 C LYS A 74 -12.357 -4.330 -3.997 1.00 75.52 C ATOM 1005 O LYS A 74 -13.016 -3.328 -4.294 1.00 43.40 O ATOM 1006 CB LYS A 74 -11.748 -4.326 -1.571 1.00 50.51 C ATOM 1007 CG LYS A 74 -10.677 -4.332 -0.470 1.00 12.03 C ATOM 1008 CD LYS A 74 -9.767 -5.552 -0.573 1.00 33.33 C ATOM 1009 CE LYS A 74 -8.704 -5.562 0.516 1.00 74.04 C ATOM 1010 NZ LYS A 74 -7.782 -4.406 0.419 1.00 62.22 N ATOM 0 H LYS A 74 -11.083 -2.177 -3.185 1.00 63.42 H new ATOM 0 HA LYS A 74 -10.530 -5.070 -3.196 1.00 53.41 H new ATOM 0 HB2 LYS A 74 -12.418 -3.483 -1.400 1.00 50.51 H new ATOM 0 HB3 LYS A 74 -12.346 -5.232 -1.479 1.00 50.51 H new ATOM 0 HG2 LYS A 74 -10.078 -3.424 -0.541 1.00 12.03 H new ATOM 0 HG3 LYS A 74 -11.160 -4.320 0.507 1.00 12.03 H new ATOM 0 HD2 LYS A 74 -10.367 -6.459 -0.503 1.00 33.33 H new ATOM 0 HD3 LYS A 74 -9.285 -5.564 -1.551 1.00 33.33 H new ATOM 0 HE2 LYS A 74 -9.189 -5.555 1.492 1.00 74.04 H new ATOM 0 HE3 LYS A 74 -8.130 -6.487 0.451 1.00 74.04 H new ATOM 0 HZ1 LYS A 74 -6.982 -4.544 1.069 1.00 62.22 H new ATOM 0 HZ2 LYS A 74 -7.427 -4.326 -0.555 1.00 62.22 H new ATOM 0 HZ3 LYS A 74 -8.289 -3.535 0.675 1.00 62.22 H new ATOM 1024 N VAL A 75 -12.572 -5.513 -4.515 1.00 44.34 N ATOM 1025 CA VAL A 75 -13.670 -5.791 -5.399 1.00 2.40 C ATOM 1026 C VAL A 75 -14.698 -6.679 -4.729 1.00 40.34 C ATOM 1027 O VAL A 75 -14.354 -7.714 -4.161 1.00 62.40 O ATOM 1028 CB VAL A 75 -13.173 -6.485 -6.695 1.00 70.51 C ATOM 1029 CG1 VAL A 75 -14.338 -7.056 -7.499 1.00 40.02 C ATOM 1030 CG2 VAL A 75 -12.390 -5.505 -7.540 1.00 13.22 C ATOM 0 H VAL A 75 -11.978 -6.321 -4.330 1.00 44.34 H new ATOM 0 HA VAL A 75 -14.131 -4.836 -5.652 1.00 2.40 H new ATOM 0 HB VAL A 75 -12.524 -7.312 -6.408 1.00 70.51 H new ATOM 0 HG11 VAL A 75 -13.957 -7.536 -8.401 1.00 40.02 H new ATOM 0 HG12 VAL A 75 -14.872 -7.790 -6.895 1.00 40.02 H new ATOM 0 HG13 VAL A 75 -15.018 -6.251 -7.776 1.00 40.02 H new ATOM 0 HG21 VAL A 75 -12.045 -6.001 -8.447 1.00 13.22 H new ATOM 0 HG22 VAL A 75 -13.029 -4.663 -7.807 1.00 13.22 H new ATOM 0 HG23 VAL A 75 -11.531 -5.143 -6.975 1.00 13.22 H new ATOM 1040 N LEU A 76 -15.940 -6.251 -4.803 1.00 51.15 N ATOM 1041 CA LEU A 76 -17.062 -7.004 -4.322 1.00 23.34 C ATOM 1042 C LEU A 76 -17.644 -7.749 -5.504 1.00 51.22 C ATOM 1043 O LEU A 76 -18.182 -7.130 -6.431 1.00 61.32 O ATOM 1044 CB LEU A 76 -18.154 -6.073 -3.760 1.00 23.12 C ATOM 1045 CG LEU A 76 -17.766 -5.129 -2.622 1.00 34.21 C ATOM 1046 CD1 LEU A 76 -18.969 -4.313 -2.193 1.00 64.34 C ATOM 1047 CD2 LEU A 76 -17.206 -5.897 -1.447 1.00 12.13 C ATOM 0 H LEU A 76 -16.196 -5.351 -5.209 1.00 51.15 H new ATOM 0 HA LEU A 76 -16.734 -7.676 -3.529 1.00 23.34 H new ATOM 0 HB2 LEU A 76 -18.535 -5.468 -4.583 1.00 23.12 H new ATOM 0 HB3 LEU A 76 -18.979 -6.695 -3.413 1.00 23.12 H new ATOM 0 HG LEU A 76 -16.990 -4.455 -2.985 1.00 34.21 H new ATOM 0 HD11 LEU A 76 -18.684 -3.643 -1.382 1.00 64.34 H new ATOM 0 HD12 LEU A 76 -19.331 -3.727 -3.038 1.00 64.34 H new ATOM 0 HD13 LEU A 76 -19.759 -4.982 -1.851 1.00 64.34 H new ATOM 0 HD21 LEU A 76 -16.938 -5.201 -0.652 1.00 12.13 H new ATOM 0 HD22 LEU A 76 -17.956 -6.597 -1.079 1.00 12.13 H new ATOM 0 HD23 LEU A 76 -16.319 -6.447 -1.761 1.00 12.13 H new ATOM 1059 N MET A 77 -17.511 -9.032 -5.506 1.00 55.24 N ATOM 1060 CA MET A 77 -18.034 -9.837 -6.580 1.00 70.20 C ATOM 1061 C MET A 77 -19.072 -10.784 -6.069 1.00 15.34 C ATOM 1062 O MET A 77 -19.010 -11.224 -4.919 1.00 1.20 O ATOM 1063 CB MET A 77 -16.931 -10.571 -7.326 1.00 23.41 C ATOM 1064 CG MET A 77 -16.034 -11.418 -6.467 1.00 62.42 C ATOM 1065 SD MET A 77 -14.809 -12.306 -7.441 1.00 63.33 S ATOM 1066 CE MET A 77 -14.007 -10.946 -8.302 1.00 72.25 C ATOM 0 H MET A 77 -17.040 -9.560 -4.771 1.00 55.24 H new ATOM 0 HA MET A 77 -18.508 -9.167 -7.297 1.00 70.20 H new ATOM 0 HB2 MET A 77 -17.388 -11.207 -8.085 1.00 23.41 H new ATOM 0 HB3 MET A 77 -16.319 -9.838 -7.851 1.00 23.41 H new ATOM 0 HG2 MET A 77 -15.528 -10.786 -5.738 1.00 62.42 H new ATOM 0 HG3 MET A 77 -16.638 -12.132 -5.906 1.00 62.42 H new ATOM 0 HE1 MET A 77 -13.013 -11.256 -8.625 1.00 72.25 H new ATOM 0 HE2 MET A 77 -14.601 -10.666 -9.172 1.00 72.25 H new ATOM 0 HE3 MET A 77 -13.920 -10.091 -7.631 1.00 72.25 H new ATOM 1076 N GLY A 78 -20.029 -11.106 -6.904 1.00 74.25 N ATOM 1077 CA GLY A 78 -21.112 -11.916 -6.456 1.00 21.44 C ATOM 1078 C GLY A 78 -22.235 -11.056 -5.934 1.00 11.43 C ATOM 1079 O GLY A 78 -23.125 -11.536 -5.233 1.00 13.01 O ATOM 0 H GLY A 78 -20.073 -10.820 -7.882 1.00 74.25 H new ATOM 0 HA2 GLY A 78 -21.473 -12.537 -7.276 1.00 21.44 H new ATOM 0 HA3 GLY A 78 -20.769 -12.591 -5.672 1.00 21.44 H new ATOM 1083 N VAL A 79 -22.188 -9.773 -6.272 1.00 53.23 N ATOM 1084 CA VAL A 79 -23.206 -8.838 -5.846 1.00 3.32 C ATOM 1085 C VAL A 79 -24.377 -8.928 -6.820 1.00 72.44 C ATOM 1086 O VAL A 79 -24.171 -9.007 -8.048 1.00 33.10 O ATOM 1087 CB VAL A 79 -22.645 -7.359 -5.758 1.00 64.34 C ATOM 1088 CG1 VAL A 79 -22.286 -6.779 -7.098 1.00 52.20 C ATOM 1089 CG2 VAL A 79 -23.583 -6.444 -5.025 1.00 51.33 C ATOM 0 H VAL A 79 -21.450 -9.361 -6.843 1.00 53.23 H new ATOM 0 HA VAL A 79 -23.539 -9.099 -4.841 1.00 3.32 H new ATOM 0 HB VAL A 79 -21.721 -7.436 -5.185 1.00 64.34 H new ATOM 0 HG11 VAL A 79 -21.909 -5.765 -6.966 1.00 52.20 H new ATOM 0 HG12 VAL A 79 -21.518 -7.394 -7.567 1.00 52.20 H new ATOM 0 HG13 VAL A 79 -23.171 -6.757 -7.734 1.00 52.20 H new ATOM 0 HG21 VAL A 79 -23.158 -5.441 -4.989 1.00 51.33 H new ATOM 0 HG22 VAL A 79 -24.541 -6.414 -5.544 1.00 51.33 H new ATOM 0 HG23 VAL A 79 -23.731 -6.812 -4.010 1.00 51.33 H new ATOM 1099 N THR A 80 -25.580 -8.957 -6.309 1.00 72.44 N ATOM 1100 CA THR A 80 -26.732 -9.071 -7.167 1.00 54.24 C ATOM 1101 C THR A 80 -27.129 -7.707 -7.717 1.00 54.21 C ATOM 1102 O THR A 80 -26.648 -6.673 -7.242 1.00 62.04 O ATOM 1103 CB THR A 80 -27.939 -9.723 -6.456 1.00 41.32 C ATOM 1104 OG1 THR A 80 -28.309 -8.960 -5.300 1.00 50.21 O ATOM 1105 CG2 THR A 80 -27.631 -11.154 -6.048 1.00 53.54 C ATOM 0 H THR A 80 -25.788 -8.904 -5.312 1.00 72.44 H new ATOM 0 HA THR A 80 -26.445 -9.726 -7.990 1.00 54.24 H new ATOM 0 HB THR A 80 -28.771 -9.737 -7.160 1.00 41.32 H new ATOM 0 HG1 THR A 80 -27.740 -9.215 -4.544 1.00 50.21 H new ATOM 0 HG21 THR A 80 -28.500 -11.585 -5.550 1.00 53.54 H new ATOM 0 HG22 THR A 80 -27.392 -11.742 -6.934 1.00 53.54 H new ATOM 0 HG23 THR A 80 -26.781 -11.163 -5.366 1.00 53.54 H new ATOM 1113 N SER A 81 -27.986 -7.706 -8.706 1.00 55.55 N ATOM 1114 CA SER A 81 -28.453 -6.486 -9.337 1.00 40.23 C ATOM 1115 C SER A 81 -29.188 -5.564 -8.343 1.00 65.42 C ATOM 1116 O SER A 81 -29.088 -4.348 -8.440 1.00 33.45 O ATOM 1117 CB SER A 81 -29.350 -6.824 -10.515 1.00 2.10 C ATOM 1118 OG SER A 81 -28.679 -7.684 -11.434 1.00 75.11 O ATOM 0 H SER A 81 -28.386 -8.556 -9.103 1.00 55.55 H new ATOM 0 HA SER A 81 -27.579 -5.940 -9.693 1.00 40.23 H new ATOM 0 HB2 SER A 81 -30.260 -7.306 -10.158 1.00 2.10 H new ATOM 0 HB3 SER A 81 -29.652 -5.908 -11.022 1.00 2.10 H new ATOM 0 HG SER A 81 -28.762 -7.322 -12.341 1.00 75.11 H new ATOM 1124 N ASP A 82 -29.889 -6.145 -7.370 1.00 21.11 N ATOM 1125 CA ASP A 82 -30.627 -5.347 -6.372 1.00 74.25 C ATOM 1126 C ASP A 82 -29.668 -4.603 -5.467 1.00 35.52 C ATOM 1127 O ASP A 82 -29.916 -3.474 -5.064 1.00 35.42 O ATOM 1128 CB ASP A 82 -31.580 -6.205 -5.526 1.00 61.44 C ATOM 1129 CG ASP A 82 -32.657 -6.879 -6.338 1.00 73.42 C ATOM 1130 OD1 ASP A 82 -33.595 -6.202 -6.785 1.00 44.30 O ATOM 1131 OD2 ASP A 82 -32.566 -8.107 -6.561 1.00 24.31 O ATOM 0 H ASP A 82 -29.966 -7.154 -7.246 1.00 21.11 H new ATOM 0 HA ASP A 82 -31.232 -4.631 -6.928 1.00 74.25 H new ATOM 0 HB2 ASP A 82 -31.003 -6.965 -5.000 1.00 61.44 H new ATOM 0 HB3 ASP A 82 -32.047 -5.577 -4.767 1.00 61.44 H new ATOM 1136 N GLU A 83 -28.575 -5.237 -5.169 1.00 4.00 N ATOM 1137 CA GLU A 83 -27.526 -4.657 -4.348 1.00 4.35 C ATOM 1138 C GLU A 83 -26.708 -3.681 -5.219 1.00 42.31 C ATOM 1139 O GLU A 83 -26.150 -2.722 -4.730 1.00 41.24 O ATOM 1140 CB GLU A 83 -26.648 -5.789 -3.834 1.00 15.13 C ATOM 1141 CG GLU A 83 -27.419 -6.861 -3.080 1.00 13.14 C ATOM 1142 CD GLU A 83 -26.576 -8.069 -2.726 1.00 62.33 C ATOM 1143 OE1 GLU A 83 -26.218 -8.852 -3.651 1.00 64.43 O ATOM 1144 OE2 GLU A 83 -26.284 -8.274 -1.531 1.00 4.30 O ATOM 0 H GLU A 83 -28.372 -6.185 -5.487 1.00 4.00 H new ATOM 0 HA GLU A 83 -27.938 -4.110 -3.500 1.00 4.35 H new ATOM 0 HB2 GLU A 83 -26.132 -6.249 -4.677 1.00 15.13 H new ATOM 0 HB3 GLU A 83 -25.882 -5.375 -3.178 1.00 15.13 H new ATOM 0 HG2 GLU A 83 -27.826 -6.430 -2.165 1.00 13.14 H new ATOM 0 HG3 GLU A 83 -28.266 -7.183 -3.685 1.00 13.14 H new ATOM 1151 N LEU A 84 -26.662 -3.953 -6.522 1.00 72.04 N ATOM 1152 CA LEU A 84 -25.994 -3.069 -7.484 1.00 41.24 C ATOM 1153 C LEU A 84 -26.739 -1.735 -7.562 1.00 55.44 C ATOM 1154 O LEU A 84 -26.148 -0.679 -7.400 1.00 24.21 O ATOM 1155 CB LEU A 84 -25.976 -3.713 -8.877 1.00 1.25 C ATOM 1156 CG LEU A 84 -25.302 -2.904 -9.991 1.00 42.35 C ATOM 1157 CD1 LEU A 84 -23.804 -2.819 -9.783 1.00 52.14 C ATOM 1158 CD2 LEU A 84 -25.629 -3.477 -11.347 1.00 42.21 C ATOM 0 H LEU A 84 -27.081 -4.783 -6.941 1.00 72.04 H new ATOM 0 HA LEU A 84 -24.970 -2.904 -7.150 1.00 41.24 H new ATOM 0 HB2 LEU A 84 -25.473 -4.677 -8.802 1.00 1.25 H new ATOM 0 HB3 LEU A 84 -27.005 -3.913 -9.175 1.00 1.25 H new ATOM 0 HG LEU A 84 -25.698 -1.889 -9.949 1.00 42.35 H new ATOM 0 HD11 LEU A 84 -23.357 -2.239 -10.590 1.00 52.14 H new ATOM 0 HD12 LEU A 84 -23.596 -2.334 -8.829 1.00 52.14 H new ATOM 0 HD13 LEU A 84 -23.380 -3.823 -9.780 1.00 52.14 H new ATOM 0 HD21 LEU A 84 -25.139 -2.885 -12.120 1.00 42.21 H new ATOM 0 HD22 LEU A 84 -25.277 -4.507 -11.401 1.00 42.21 H new ATOM 0 HD23 LEU A 84 -26.708 -3.453 -11.501 1.00 42.21 H new ATOM 1170 N GLU A 85 -28.061 -1.808 -7.777 1.00 41.35 N ATOM 1171 CA GLU A 85 -28.907 -0.608 -7.834 1.00 10.40 C ATOM 1172 C GLU A 85 -28.887 0.122 -6.500 1.00 41.22 C ATOM 1173 O GLU A 85 -29.040 1.336 -6.436 1.00 4.40 O ATOM 1174 CB GLU A 85 -30.339 -0.934 -8.299 1.00 63.54 C ATOM 1175 CG GLU A 85 -31.054 -1.969 -7.466 1.00 64.20 C ATOM 1176 CD GLU A 85 -32.435 -2.273 -7.969 1.00 52.15 C ATOM 1177 OE1 GLU A 85 -32.570 -2.920 -9.025 1.00 2.32 O ATOM 1178 OE2 GLU A 85 -33.413 -1.889 -7.310 1.00 3.42 O ATOM 0 H GLU A 85 -28.566 -2.684 -7.914 1.00 41.35 H new ATOM 0 HA GLU A 85 -28.490 0.063 -8.585 1.00 10.40 H new ATOM 0 HB2 GLU A 85 -30.926 -0.015 -8.294 1.00 63.54 H new ATOM 0 HB3 GLU A 85 -30.300 -1.282 -9.331 1.00 63.54 H new ATOM 0 HG2 GLU A 85 -30.467 -2.887 -7.455 1.00 64.20 H new ATOM 0 HG3 GLU A 85 -31.117 -1.618 -6.436 1.00 64.20 H new ATOM 1185 N ASN A 86 -28.687 -0.646 -5.444 1.00 63.33 N ATOM 1186 CA ASN A 86 -28.508 -0.128 -4.097 1.00 12.25 C ATOM 1187 C ASN A 86 -27.302 0.782 -4.056 1.00 72.34 C ATOM 1188 O ASN A 86 -27.376 1.910 -3.561 1.00 42.30 O ATOM 1189 CB ASN A 86 -28.309 -1.302 -3.145 1.00 42.55 C ATOM 1190 CG ASN A 86 -27.722 -0.940 -1.819 1.00 61.14 C ATOM 1191 OD1 ASN A 86 -26.527 -0.958 -1.657 1.00 50.42 O ATOM 1192 ND2 ASN A 86 -28.533 -0.605 -0.880 1.00 50.15 N ATOM 0 H ASN A 86 -28.643 -1.664 -5.498 1.00 63.33 H new ATOM 0 HA ASN A 86 -29.386 0.444 -3.797 1.00 12.25 H new ATOM 0 HB2 ASN A 86 -29.272 -1.786 -2.981 1.00 42.55 H new ATOM 0 HB3 ASN A 86 -27.662 -2.036 -3.625 1.00 42.55 H new ATOM 0 HD21 ASN A 86 -28.171 -0.343 0.037 1.00 50.15 H new ATOM 0 HD22 ASN A 86 -29.538 -0.601 -1.052 1.00 50.15 H new ATOM 1199 N LEU A 87 -26.213 0.293 -4.611 1.00 20.45 N ATOM 1200 CA LEU A 87 -24.958 1.007 -4.662 1.00 63.04 C ATOM 1201 C LEU A 87 -25.070 2.208 -5.558 1.00 30.13 C ATOM 1202 O LEU A 87 -24.536 3.281 -5.243 1.00 14.34 O ATOM 1203 CB LEU A 87 -23.828 0.084 -5.108 1.00 63.44 C ATOM 1204 CG LEU A 87 -23.553 -1.106 -4.182 1.00 3.33 C ATOM 1205 CD1 LEU A 87 -22.467 -1.993 -4.763 1.00 3.15 C ATOM 1206 CD2 LEU A 87 -23.158 -0.625 -2.779 1.00 32.12 C ATOM 0 H LEU A 87 -26.176 -0.629 -5.047 1.00 20.45 H new ATOM 0 HA LEU A 87 -24.720 1.360 -3.658 1.00 63.04 H new ATOM 0 HB2 LEU A 87 -24.062 -0.296 -6.102 1.00 63.44 H new ATOM 0 HB3 LEU A 87 -22.915 0.672 -5.199 1.00 63.44 H new ATOM 0 HG LEU A 87 -24.470 -1.690 -4.098 1.00 3.33 H new ATOM 0 HD11 LEU A 87 -22.285 -2.833 -4.092 1.00 3.15 H new ATOM 0 HD12 LEU A 87 -22.785 -2.368 -5.736 1.00 3.15 H new ATOM 0 HD13 LEU A 87 -21.549 -1.416 -4.879 1.00 3.15 H new ATOM 0 HD21 LEU A 87 -22.968 -1.487 -2.139 1.00 32.12 H new ATOM 0 HD22 LEU A 87 -22.257 -0.015 -2.844 1.00 32.12 H new ATOM 0 HD23 LEU A 87 -23.969 -0.031 -2.356 1.00 32.12 H new ATOM 1218 N ASP A 88 -25.786 2.043 -6.663 1.00 32.43 N ATOM 1219 CA ASP A 88 -26.052 3.152 -7.566 1.00 23.13 C ATOM 1220 C ASP A 88 -26.801 4.224 -6.844 1.00 22.03 C ATOM 1221 O ASP A 88 -26.485 5.392 -6.948 1.00 42.11 O ATOM 1222 CB ASP A 88 -26.869 2.743 -8.792 1.00 43.01 C ATOM 1223 CG ASP A 88 -26.173 1.798 -9.728 1.00 71.32 C ATOM 1224 OD1 ASP A 88 -25.054 2.114 -10.174 1.00 21.42 O ATOM 1225 OD2 ASP A 88 -26.774 0.775 -10.103 1.00 4.24 O ATOM 0 H ASP A 88 -26.192 1.153 -6.954 1.00 32.43 H new ATOM 0 HA ASP A 88 -25.081 3.508 -7.910 1.00 23.13 H new ATOM 0 HB2 ASP A 88 -27.796 2.280 -8.455 1.00 43.01 H new ATOM 0 HB3 ASP A 88 -27.144 3.642 -9.344 1.00 43.01 H new ATOM 1230 N ALA A 89 -27.791 3.818 -6.106 1.00 33.24 N ATOM 1231 CA ALA A 89 -28.624 4.718 -5.356 1.00 1.33 C ATOM 1232 C ALA A 89 -27.838 5.434 -4.260 1.00 42.44 C ATOM 1233 O ALA A 89 -27.944 6.653 -4.105 1.00 73.20 O ATOM 1234 CB ALA A 89 -29.775 3.946 -4.758 1.00 22.35 C ATOM 0 H ALA A 89 -28.049 2.836 -6.005 1.00 33.24 H new ATOM 0 HA ALA A 89 -29.003 5.483 -6.033 1.00 1.33 H new ATOM 0 HB1 ALA A 89 -30.410 4.624 -4.188 1.00 22.35 H new ATOM 0 HB2 ALA A 89 -30.358 3.487 -5.556 1.00 22.35 H new ATOM 0 HB3 ALA A 89 -29.388 3.170 -4.098 1.00 22.35 H new ATOM 1240 N VAL A 90 -27.056 4.688 -3.505 1.00 55.43 N ATOM 1241 CA VAL A 90 -26.312 5.255 -2.393 1.00 63.40 C ATOM 1242 C VAL A 90 -25.112 6.136 -2.850 1.00 34.05 C ATOM 1243 O VAL A 90 -25.052 7.322 -2.523 1.00 41.33 O ATOM 1244 CB VAL A 90 -25.896 4.159 -1.324 1.00 23.10 C ATOM 1245 CG1 VAL A 90 -25.034 3.070 -1.905 1.00 4.51 C ATOM 1246 CG2 VAL A 90 -25.243 4.773 -0.107 1.00 72.52 C ATOM 0 H VAL A 90 -26.918 3.686 -3.640 1.00 55.43 H new ATOM 0 HA VAL A 90 -26.998 5.934 -1.886 1.00 63.40 H new ATOM 0 HB VAL A 90 -26.827 3.690 -1.005 1.00 23.10 H new ATOM 0 HG11 VAL A 90 -24.782 2.351 -1.126 1.00 4.51 H new ATOM 0 HG12 VAL A 90 -25.576 2.564 -2.704 1.00 4.51 H new ATOM 0 HG13 VAL A 90 -24.119 3.505 -2.306 1.00 4.51 H new ATOM 0 HG21 VAL A 90 -24.975 3.986 0.598 1.00 72.52 H new ATOM 0 HG22 VAL A 90 -24.345 5.311 -0.409 1.00 72.52 H new ATOM 0 HG23 VAL A 90 -25.938 5.465 0.369 1.00 72.52 H new ATOM 1256 N GLU A 91 -24.206 5.575 -3.633 1.00 51.42 N ATOM 1257 CA GLU A 91 -23.004 6.300 -4.071 1.00 53.12 C ATOM 1258 C GLU A 91 -23.296 7.271 -5.203 1.00 10.24 C ATOM 1259 O GLU A 91 -22.673 8.333 -5.308 1.00 52.54 O ATOM 1260 CB GLU A 91 -21.899 5.323 -4.472 1.00 14.04 C ATOM 1261 CG GLU A 91 -21.440 4.426 -3.336 1.00 21.13 C ATOM 1262 CD GLU A 91 -20.818 5.198 -2.187 1.00 21.23 C ATOM 1263 OE1 GLU A 91 -21.539 5.925 -1.470 1.00 72.52 O ATOM 1264 OE2 GLU A 91 -19.600 5.089 -1.994 1.00 12.53 O ATOM 0 H GLU A 91 -24.271 4.619 -3.984 1.00 51.42 H new ATOM 0 HA GLU A 91 -22.661 6.891 -3.222 1.00 53.12 H new ATOM 0 HB2 GLU A 91 -22.255 4.701 -5.293 1.00 14.04 H new ATOM 0 HB3 GLU A 91 -21.045 5.887 -4.846 1.00 14.04 H new ATOM 0 HG2 GLU A 91 -22.291 3.855 -2.965 1.00 21.13 H new ATOM 0 HG3 GLU A 91 -20.715 3.707 -3.718 1.00 21.13 H new ATOM 1271 N GLY A 92 -24.272 6.921 -6.023 1.00 0.43 N ATOM 1272 CA GLY A 92 -24.630 7.709 -7.202 1.00 3.11 C ATOM 1273 C GLY A 92 -25.063 9.127 -6.896 1.00 64.03 C ATOM 1274 O GLY A 92 -25.080 9.982 -7.783 1.00 60.52 O ATOM 0 H GLY A 92 -24.841 6.084 -5.895 1.00 0.43 H new ATOM 0 HA2 GLY A 92 -23.775 7.740 -7.877 1.00 3.11 H new ATOM 0 HA3 GLY A 92 -25.436 7.202 -7.732 1.00 3.11 H new ATOM 1278 N ASN A 93 -25.407 9.382 -5.646 1.00 15.31 N ATOM 1279 CA ASN A 93 -25.825 10.707 -5.218 1.00 42.22 C ATOM 1280 C ASN A 93 -24.712 11.739 -5.461 1.00 61.04 C ATOM 1281 O ASN A 93 -24.991 12.898 -5.777 1.00 34.24 O ATOM 1282 CB ASN A 93 -26.255 10.694 -3.738 1.00 43.33 C ATOM 1283 CG ASN A 93 -26.731 12.055 -3.235 1.00 0.40 C ATOM 1284 OD1 ASN A 93 -25.947 12.856 -2.723 1.00 1.44 O ATOM 1285 ND2 ASN A 93 -28.010 12.322 -3.360 1.00 24.34 N ATOM 0 H ASN A 93 -25.405 8.683 -4.903 1.00 15.31 H new ATOM 0 HA ASN A 93 -26.688 11.000 -5.816 1.00 42.22 H new ATOM 0 HB2 ASN A 93 -27.055 9.966 -3.606 1.00 43.33 H new ATOM 0 HB3 ASN A 93 -25.416 10.361 -3.126 1.00 43.33 H new ATOM 0 HD21 ASN A 93 -28.380 13.213 -3.029 1.00 24.34 H new ATOM 0 HD22 ASN A 93 -28.634 11.638 -3.788 1.00 24.34 H new ATOM 1292 N GLU A 94 -23.451 11.318 -5.332 1.00 23.22 N ATOM 1293 CA GLU A 94 -22.328 12.231 -5.571 1.00 44.20 C ATOM 1294 C GLU A 94 -21.268 11.621 -6.500 1.00 2.51 C ATOM 1295 O GLU A 94 -20.337 12.312 -6.926 1.00 3.22 O ATOM 1296 CB GLU A 94 -21.668 12.658 -4.260 1.00 52.43 C ATOM 1297 CG GLU A 94 -22.589 13.362 -3.284 1.00 13.24 C ATOM 1298 CD GLU A 94 -21.855 13.843 -2.066 1.00 30.00 C ATOM 1299 OE1 GLU A 94 -21.640 13.053 -1.147 1.00 2.12 O ATOM 1300 OE2 GLU A 94 -21.476 15.031 -2.026 1.00 1.35 O ATOM 0 H GLU A 94 -23.184 10.370 -5.069 1.00 23.22 H new ATOM 0 HA GLU A 94 -22.750 13.107 -6.063 1.00 44.20 H new ATOM 0 HB2 GLU A 94 -21.253 11.775 -3.774 1.00 52.43 H new ATOM 0 HB3 GLU A 94 -20.831 13.318 -4.489 1.00 52.43 H new ATOM 0 HG2 GLU A 94 -23.063 14.209 -3.780 1.00 13.24 H new ATOM 0 HG3 GLU A 94 -23.386 12.682 -2.982 1.00 13.24 H new ATOM 1307 N TYR A 95 -21.400 10.341 -6.805 1.00 24.22 N ATOM 1308 CA TYR A 95 -20.427 9.640 -7.641 1.00 21.23 C ATOM 1309 C TYR A 95 -21.116 9.047 -8.866 1.00 52.02 C ATOM 1310 O TYR A 95 -22.341 8.964 -8.912 1.00 53.40 O ATOM 1311 CB TYR A 95 -19.722 8.534 -6.840 1.00 13.22 C ATOM 1312 CG TYR A 95 -18.948 9.035 -5.636 1.00 20.04 C ATOM 1313 CD1 TYR A 95 -19.597 9.334 -4.445 1.00 61.04 C ATOM 1314 CD2 TYR A 95 -17.576 9.220 -5.697 1.00 73.51 C ATOM 1315 CE1 TYR A 95 -18.906 9.801 -3.350 1.00 73.33 C ATOM 1316 CE2 TYR A 95 -16.873 9.688 -4.602 1.00 74.30 C ATOM 1317 CZ TYR A 95 -17.545 9.977 -3.430 1.00 1.33 C ATOM 1318 OH TYR A 95 -16.853 10.442 -2.332 1.00 43.33 O ATOM 0 H TYR A 95 -22.175 9.759 -6.486 1.00 24.22 H new ATOM 0 HA TYR A 95 -19.676 10.357 -7.972 1.00 21.23 H new ATOM 0 HB2 TYR A 95 -20.467 7.813 -6.504 1.00 13.22 H new ATOM 0 HB3 TYR A 95 -19.038 8.002 -7.501 1.00 13.22 H new ATOM 0 HD1 TYR A 95 -20.666 9.197 -4.377 1.00 61.04 H new ATOM 0 HD2 TYR A 95 -17.049 8.996 -6.612 1.00 73.51 H new ATOM 0 HE1 TYR A 95 -19.430 10.028 -2.433 1.00 73.33 H new ATOM 0 HE2 TYR A 95 -15.804 9.827 -4.663 1.00 74.30 H new ATOM 0 HH TYR A 95 -15.900 10.510 -2.551 1.00 43.33 H new ATOM 1328 N GLU A 96 -20.349 8.641 -9.848 1.00 55.32 N ATOM 1329 CA GLU A 96 -20.921 8.086 -11.055 1.00 44.14 C ATOM 1330 C GLU A 96 -20.373 6.694 -11.299 1.00 63.30 C ATOM 1331 O GLU A 96 -19.196 6.427 -11.036 1.00 42.13 O ATOM 1332 CB GLU A 96 -20.620 9.006 -12.252 1.00 10.04 C ATOM 1333 CG GLU A 96 -21.224 8.552 -13.571 1.00 62.44 C ATOM 1334 CD GLU A 96 -22.726 8.441 -13.502 1.00 40.43 C ATOM 1335 OE1 GLU A 96 -23.234 7.367 -13.150 1.00 41.45 O ATOM 1336 OE2 GLU A 96 -23.427 9.429 -13.792 1.00 62.03 O ATOM 0 H GLU A 96 -19.330 8.683 -9.838 1.00 55.32 H new ATOM 0 HA GLU A 96 -22.002 8.015 -10.937 1.00 44.14 H new ATOM 0 HB2 GLU A 96 -20.988 10.007 -12.025 1.00 10.04 H new ATOM 0 HB3 GLU A 96 -19.539 9.083 -12.371 1.00 10.04 H new ATOM 0 HG2 GLU A 96 -20.949 9.257 -14.356 1.00 62.44 H new ATOM 0 HG3 GLU A 96 -20.802 7.586 -13.848 1.00 62.44 H new ATOM 1343 N ARG A 97 -21.226 5.822 -11.801 1.00 70.45 N ATOM 1344 CA ARG A 97 -20.870 4.447 -12.048 1.00 61.42 C ATOM 1345 C ARG A 97 -20.272 4.331 -13.426 1.00 41.52 C ATOM 1346 O ARG A 97 -20.952 4.551 -14.432 1.00 43.53 O ATOM 1347 CB ARG A 97 -22.112 3.557 -11.990 1.00 74.33 C ATOM 1348 CG ARG A 97 -21.816 2.072 -12.161 1.00 73.13 C ATOM 1349 CD ARG A 97 -23.094 1.266 -12.298 1.00 2.34 C ATOM 1350 NE ARG A 97 -23.816 1.586 -13.546 1.00 74.10 N ATOM 1351 CZ ARG A 97 -25.110 1.308 -13.788 1.00 60.33 C ATOM 1352 NH1 ARG A 97 -25.911 0.884 -12.812 1.00 5.30 N ATOM 1353 NH2 ARG A 97 -25.605 1.513 -15.004 1.00 63.32 N ATOM 0 H ARG A 97 -22.188 6.053 -12.048 1.00 70.45 H new ATOM 0 HA ARG A 97 -20.156 4.129 -11.288 1.00 61.42 H new ATOM 0 HB2 ARG A 97 -22.612 3.710 -11.034 1.00 74.33 H new ATOM 0 HB3 ARG A 97 -22.808 3.871 -12.768 1.00 74.33 H new ATOM 0 HG2 ARG A 97 -21.193 1.923 -13.043 1.00 73.13 H new ATOM 0 HG3 ARG A 97 -21.247 1.712 -11.304 1.00 73.13 H new ATOM 0 HD2 ARG A 97 -22.856 0.202 -12.279 1.00 2.34 H new ATOM 0 HD3 ARG A 97 -23.741 1.463 -11.443 1.00 2.34 H new ATOM 0 HE ARG A 97 -23.291 2.056 -14.284 1.00 74.10 H new ATOM 0 HH11 ARG A 97 -25.545 0.766 -11.867 1.00 5.30 H new ATOM 0 HH12 ARG A 97 -26.890 0.677 -13.009 1.00 5.30 H new ATOM 0 HH21 ARG A 97 -25.005 1.878 -15.744 1.00 63.32 H new ATOM 0 HH22 ARG A 97 -26.585 1.305 -15.197 1.00 63.32 H new ATOM 1367 N VAL A 98 -19.026 3.996 -13.480 1.00 71.23 N ATOM 1368 CA VAL A 98 -18.353 3.826 -14.733 1.00 3.31 C ATOM 1369 C VAL A 98 -17.767 2.448 -14.848 1.00 34.14 C ATOM 1370 O VAL A 98 -17.581 1.750 -13.832 1.00 20.31 O ATOM 1371 CB VAL A 98 -17.283 4.899 -14.981 1.00 21.54 C ATOM 1372 CG1 VAL A 98 -17.960 6.257 -15.120 1.00 52.24 C ATOM 1373 CG2 VAL A 98 -16.268 4.909 -13.836 1.00 23.32 C ATOM 0 H VAL A 98 -18.442 3.831 -12.660 1.00 71.23 H new ATOM 0 HA VAL A 98 -19.107 3.948 -15.511 1.00 3.31 H new ATOM 0 HB VAL A 98 -16.745 4.675 -15.902 1.00 21.54 H new ATOM 0 HG11 VAL A 98 -17.205 7.023 -15.296 1.00 52.24 H new ATOM 0 HG12 VAL A 98 -18.655 6.233 -15.959 1.00 52.24 H new ATOM 0 HG13 VAL A 98 -18.504 6.488 -14.204 1.00 52.24 H new ATOM 0 HG21 VAL A 98 -15.515 5.674 -14.024 1.00 23.32 H new ATOM 0 HG22 VAL A 98 -16.779 5.126 -12.898 1.00 23.32 H new ATOM 0 HG23 VAL A 98 -15.786 3.934 -13.769 1.00 23.32 H new ATOM 1383 N THR A 99 -17.492 2.050 -16.056 1.00 44.13 N ATOM 1384 CA THR A 99 -16.970 0.768 -16.335 1.00 50.21 C ATOM 1385 C THR A 99 -15.450 0.807 -16.312 1.00 35.41 C ATOM 1386 O THR A 99 -14.812 1.585 -17.056 1.00 1.42 O ATOM 1387 CB THR A 99 -17.503 0.292 -17.692 1.00 45.32 C ATOM 1388 OG1 THR A 99 -17.328 1.320 -18.682 1.00 13.04 O ATOM 1389 CG2 THR A 99 -18.970 -0.064 -17.599 1.00 71.43 C ATOM 0 H THR A 99 -17.632 2.629 -16.884 1.00 44.13 H new ATOM 0 HA THR A 99 -17.291 0.060 -15.571 1.00 50.21 H new ATOM 0 HB THR A 99 -16.940 -0.596 -17.982 1.00 45.32 H new ATOM 0 HG1 THR A 99 -16.441 1.725 -18.580 1.00 13.04 H new ATOM 0 HG21 THR A 99 -19.326 -0.399 -18.573 1.00 71.43 H new ATOM 0 HG22 THR A 99 -19.105 -0.863 -16.869 1.00 71.43 H new ATOM 0 HG23 THR A 99 -19.538 0.812 -17.287 1.00 71.43 H new ATOM 1397 N VAL A 100 -14.864 -0.005 -15.462 1.00 2.01 N ATOM 1398 CA VAL A 100 -13.421 0.016 -15.283 1.00 61.22 C ATOM 1399 C VAL A 100 -12.817 -1.387 -15.281 1.00 63.14 C ATOM 1400 O VAL A 100 -13.518 -2.388 -15.078 1.00 60.02 O ATOM 1401 CB VAL A 100 -13.004 0.765 -13.977 1.00 12.10 C ATOM 1402 CG1 VAL A 100 -13.412 2.235 -14.015 1.00 34.12 C ATOM 1403 CG2 VAL A 100 -13.590 0.087 -12.747 1.00 51.20 C ATOM 0 H VAL A 100 -15.356 -0.686 -14.884 1.00 2.01 H new ATOM 0 HA VAL A 100 -13.025 0.560 -16.140 1.00 61.22 H new ATOM 0 HB VAL A 100 -11.917 0.720 -13.915 1.00 12.10 H new ATOM 0 HG11 VAL A 100 -13.105 2.722 -13.089 1.00 34.12 H new ATOM 0 HG12 VAL A 100 -12.929 2.725 -14.860 1.00 34.12 H new ATOM 0 HG13 VAL A 100 -14.494 2.310 -14.122 1.00 34.12 H new ATOM 0 HG21 VAL A 100 -13.284 0.629 -11.852 1.00 51.20 H new ATOM 0 HG22 VAL A 100 -14.678 0.085 -12.816 1.00 51.20 H new ATOM 0 HG23 VAL A 100 -13.229 -0.940 -12.691 1.00 51.20 H new ATOM 1413 N GLY A 101 -11.536 -1.456 -15.518 1.00 5.12 N ATOM 1414 CA GLY A 101 -10.853 -2.715 -15.498 1.00 32.15 C ATOM 1415 C GLY A 101 -9.895 -2.776 -14.342 1.00 61.33 C ATOM 1416 O GLY A 101 -9.035 -1.900 -14.197 1.00 40.12 O ATOM 0 H GLY A 101 -10.945 -0.652 -15.728 1.00 5.12 H new ATOM 0 HA2 GLY A 101 -11.577 -3.527 -15.422 1.00 32.15 H new ATOM 0 HA3 GLY A 101 -10.312 -2.857 -16.434 1.00 32.15 H new ATOM 1420 N ILE A 102 -10.033 -3.780 -13.524 1.00 41.04 N ATOM 1421 CA ILE A 102 -9.183 -3.939 -12.369 1.00 10.43 C ATOM 1422 C ILE A 102 -8.293 -5.125 -12.532 1.00 2.12 C ATOM 1423 O ILE A 102 -8.611 -6.028 -13.267 1.00 50.23 O ATOM 1424 CB ILE A 102 -9.995 -4.002 -11.027 1.00 70.10 C ATOM 1425 CG1 ILE A 102 -11.104 -5.087 -11.014 1.00 10.23 C ATOM 1426 CG2 ILE A 102 -10.594 -2.668 -10.717 1.00 43.03 C ATOM 1427 CD1 ILE A 102 -10.662 -6.520 -10.813 1.00 22.24 C ATOM 0 H ILE A 102 -10.735 -4.512 -13.635 1.00 41.04 H new ATOM 0 HA ILE A 102 -8.557 -3.049 -12.302 1.00 10.43 H new ATOM 0 HB ILE A 102 -9.275 -4.283 -10.258 1.00 70.10 H new ATOM 0 HG12 ILE A 102 -11.813 -4.837 -10.224 1.00 10.23 H new ATOM 0 HG13 ILE A 102 -11.645 -5.029 -11.958 1.00 10.23 H new ATOM 0 HG21 ILE A 102 -11.154 -2.729 -9.784 1.00 43.03 H new ATOM 0 HG22 ILE A 102 -9.801 -1.927 -10.617 1.00 43.03 H new ATOM 0 HG23 ILE A 102 -11.265 -2.374 -11.524 1.00 43.03 H new ATOM 0 HD11 ILE A 102 -11.533 -7.175 -10.825 1.00 22.24 H new ATOM 0 HD12 ILE A 102 -9.982 -6.807 -11.615 1.00 22.24 H new ATOM 0 HD13 ILE A 102 -10.152 -6.612 -9.854 1.00 22.24 H new ATOM 1439 N VAL A 103 -7.192 -5.115 -11.875 1.00 33.21 N ATOM 1440 CA VAL A 103 -6.267 -6.198 -11.955 1.00 25.42 C ATOM 1441 C VAL A 103 -6.164 -6.798 -10.597 1.00 24.44 C ATOM 1442 O VAL A 103 -5.783 -6.116 -9.654 1.00 24.41 O ATOM 1443 CB VAL A 103 -4.875 -5.725 -12.450 1.00 14.15 C ATOM 1444 CG1 VAL A 103 -3.891 -6.878 -12.491 1.00 43.13 C ATOM 1445 CG2 VAL A 103 -4.991 -5.083 -13.827 1.00 65.34 C ATOM 0 H VAL A 103 -6.900 -4.354 -11.262 1.00 33.21 H new ATOM 0 HA VAL A 103 -6.621 -6.933 -12.678 1.00 25.42 H new ATOM 0 HB VAL A 103 -4.501 -4.983 -11.745 1.00 14.15 H new ATOM 0 HG11 VAL A 103 -2.924 -6.518 -12.841 1.00 43.13 H new ATOM 0 HG12 VAL A 103 -3.781 -7.299 -11.491 1.00 43.13 H new ATOM 0 HG13 VAL A 103 -4.260 -7.647 -13.170 1.00 43.13 H new ATOM 0 HG21 VAL A 103 -4.006 -4.756 -14.160 1.00 65.34 H new ATOM 0 HG22 VAL A 103 -5.391 -5.809 -14.534 1.00 65.34 H new ATOM 0 HG23 VAL A 103 -5.659 -4.223 -13.773 1.00 65.34 H new ATOM 1455 N ARG A 104 -6.538 -8.046 -10.471 1.00 12.44 N ATOM 1456 CA ARG A 104 -6.530 -8.665 -9.179 1.00 24.32 C ATOM 1457 C ARG A 104 -5.136 -8.876 -8.695 1.00 5.13 C ATOM 1458 O ARG A 104 -4.270 -9.336 -9.439 1.00 20.34 O ATOM 1459 CB ARG A 104 -7.258 -10.007 -9.139 1.00 10.31 C ATOM 1460 CG ARG A 104 -8.714 -9.971 -9.512 1.00 32.41 C ATOM 1461 CD ARG A 104 -9.380 -11.304 -9.180 1.00 24.34 C ATOM 1462 NE ARG A 104 -8.719 -12.459 -9.807 1.00 23.01 N ATOM 1463 CZ ARG A 104 -9.247 -13.702 -9.848 1.00 20.32 C ATOM 1464 NH1 ARG A 104 -10.404 -13.956 -9.254 1.00 73.34 N ATOM 1465 NH2 ARG A 104 -8.611 -14.678 -10.469 1.00 51.21 N ATOM 0 H ARG A 104 -6.847 -8.643 -11.238 1.00 12.44 H new ATOM 0 HA ARG A 104 -7.064 -7.971 -8.529 1.00 24.32 H new ATOM 0 HB2 ARG A 104 -6.747 -10.697 -9.811 1.00 10.31 H new ATOM 0 HB3 ARG A 104 -7.170 -10.417 -8.133 1.00 10.31 H new ATOM 0 HG2 ARG A 104 -9.214 -9.164 -8.976 1.00 32.41 H new ATOM 0 HG3 ARG A 104 -8.819 -9.760 -10.576 1.00 32.41 H new ATOM 0 HD2 ARG A 104 -9.384 -11.440 -8.099 1.00 24.34 H new ATOM 0 HD3 ARG A 104 -10.421 -11.272 -9.502 1.00 24.34 H new ATOM 0 HE ARG A 104 -7.806 -12.312 -10.237 1.00 23.01 H new ATOM 0 HH11 ARG A 104 -10.900 -13.212 -8.763 1.00 73.34 H new ATOM 0 HH12 ARG A 104 -10.799 -14.896 -9.287 1.00 73.34 H new ATOM 0 HH21 ARG A 104 -7.715 -14.496 -10.922 1.00 51.21 H new ATOM 0 HH22 ARG A 104 -9.015 -15.614 -10.496 1.00 51.21 H new ATOM 1479 N GLU A 105 -4.941 -8.595 -7.437 1.00 54.01 N ATOM 1480 CA GLU A 105 -3.678 -8.817 -6.772 1.00 14.33 C ATOM 1481 C GLU A 105 -3.536 -10.321 -6.510 1.00 35.33 C ATOM 1482 O GLU A 105 -2.506 -10.803 -6.066 1.00 3.31 O ATOM 1483 CB GLU A 105 -3.672 -8.038 -5.456 1.00 22.35 C ATOM 1484 CG GLU A 105 -3.808 -6.522 -5.615 1.00 34.02 C ATOM 1485 CD GLU A 105 -2.594 -5.863 -6.241 1.00 32.34 C ATOM 1486 OE1 GLU A 105 -2.375 -6.005 -7.465 1.00 52.00 O ATOM 1487 OE2 GLU A 105 -1.836 -5.182 -5.505 1.00 74.14 O ATOM 0 H GLU A 105 -5.661 -8.200 -6.833 1.00 54.01 H new ATOM 0 HA GLU A 105 -2.843 -8.476 -7.385 1.00 14.33 H new ATOM 0 HB2 GLU A 105 -4.488 -8.400 -4.831 1.00 22.35 H new ATOM 0 HB3 GLU A 105 -2.745 -8.253 -4.925 1.00 22.35 H new ATOM 0 HG2 GLU A 105 -4.683 -6.307 -6.228 1.00 34.02 H new ATOM 0 HG3 GLU A 105 -3.987 -6.078 -4.636 1.00 34.02 H new ATOM 1494 N ASP A 106 -4.612 -11.035 -6.827 1.00 5.13 N ATOM 1495 CA ASP A 106 -4.726 -12.469 -6.683 1.00 63.12 C ATOM 1496 C ASP A 106 -3.888 -13.196 -7.724 1.00 63.23 C ATOM 1497 O ASP A 106 -2.989 -13.965 -7.387 1.00 60.12 O ATOM 1498 CB ASP A 106 -6.206 -12.863 -6.846 1.00 74.24 C ATOM 1499 CG ASP A 106 -6.452 -14.358 -6.802 1.00 62.02 C ATOM 1500 OD1 ASP A 106 -6.648 -14.899 -5.707 1.00 51.02 O ATOM 1501 OD2 ASP A 106 -6.478 -14.998 -7.864 1.00 33.52 O ATOM 0 H ASP A 106 -5.457 -10.607 -7.205 1.00 5.13 H new ATOM 0 HA ASP A 106 -4.359 -12.755 -5.697 1.00 63.12 H new ATOM 0 HB2 ASP A 106 -6.788 -12.386 -6.058 1.00 74.24 H new ATOM 0 HB3 ASP A 106 -6.574 -12.472 -7.795 1.00 74.24 H new ATOM 1506 N ASN A 107 -4.176 -12.923 -8.986 1.00 4.24 N ATOM 1507 CA ASN A 107 -3.553 -13.651 -10.093 1.00 2.14 C ATOM 1508 C ASN A 107 -2.890 -12.731 -11.115 1.00 75.33 C ATOM 1509 O ASN A 107 -2.407 -13.205 -12.145 1.00 30.33 O ATOM 1510 CB ASN A 107 -4.604 -14.521 -10.793 1.00 32.52 C ATOM 1511 CG ASN A 107 -5.728 -13.722 -11.450 1.00 62.33 C ATOM 1512 OD1 ASN A 107 -6.070 -12.601 -11.023 1.00 72.41 O ATOM 1513 ND2 ASN A 107 -6.345 -14.298 -12.449 1.00 50.24 N ATOM 0 H ASN A 107 -4.837 -12.203 -9.276 1.00 4.24 H new ATOM 0 HA ASN A 107 -2.766 -14.270 -9.663 1.00 2.14 H new ATOM 0 HB2 ASN A 107 -4.112 -15.129 -11.552 1.00 32.52 H new ATOM 0 HB3 ASN A 107 -5.036 -15.208 -10.065 1.00 32.52 H new ATOM 0 HD21 ASN A 107 -7.130 -13.830 -12.902 1.00 50.24 H new ATOM 0 HD22 ASN A 107 -6.041 -15.215 -12.775 1.00 50.24 H new ATOM 1520 N SER A 108 -2.891 -11.425 -10.839 1.00 50.23 N ATOM 1521 CA SER A 108 -2.254 -10.416 -11.702 1.00 21.33 C ATOM 1522 C SER A 108 -3.015 -10.240 -13.038 1.00 10.21 C ATOM 1523 O SER A 108 -2.519 -9.607 -13.968 1.00 51.45 O ATOM 1524 CB SER A 108 -0.759 -10.776 -11.943 1.00 2.04 C ATOM 1525 OG SER A 108 -0.067 -9.770 -12.670 1.00 14.00 O ATOM 0 H SER A 108 -3.334 -11.032 -10.009 1.00 50.23 H new ATOM 0 HA SER A 108 -2.297 -9.457 -11.186 1.00 21.33 H new ATOM 0 HB2 SER A 108 -0.266 -10.930 -10.983 1.00 2.04 H new ATOM 0 HB3 SER A 108 -0.699 -11.719 -12.487 1.00 2.04 H new ATOM 0 HG SER A 108 -0.685 -9.331 -13.291 1.00 14.00 H new ATOM 1531 N GLU A 109 -4.221 -10.760 -13.112 1.00 10.14 N ATOM 1532 CA GLU A 109 -5.002 -10.655 -14.323 1.00 31.05 C ATOM 1533 C GLU A 109 -6.101 -9.625 -14.176 1.00 1.14 C ATOM 1534 O GLU A 109 -6.532 -9.317 -13.046 1.00 43.51 O ATOM 1535 CB GLU A 109 -5.551 -12.012 -14.717 1.00 15.32 C ATOM 1536 CG GLU A 109 -4.461 -13.012 -15.065 1.00 12.44 C ATOM 1537 CD GLU A 109 -3.612 -12.548 -16.228 1.00 24.21 C ATOM 1538 OE1 GLU A 109 -3.983 -12.830 -17.387 1.00 24.34 O ATOM 1539 OE2 GLU A 109 -2.572 -11.893 -16.009 1.00 43.14 O ATOM 0 H GLU A 109 -4.680 -11.258 -12.350 1.00 10.14 H new ATOM 0 HA GLU A 109 -4.350 -10.313 -15.127 1.00 31.05 H new ATOM 0 HB2 GLU A 109 -6.152 -12.407 -13.898 1.00 15.32 H new ATOM 0 HB3 GLU A 109 -6.216 -11.895 -15.572 1.00 15.32 H new ATOM 0 HG2 GLU A 109 -3.825 -13.172 -14.194 1.00 12.44 H new ATOM 0 HG3 GLU A 109 -4.915 -13.972 -15.309 1.00 12.44 H new ATOM 1546 N LYS A 110 -6.549 -9.083 -15.295 1.00 1.00 N ATOM 1547 CA LYS A 110 -7.528 -8.043 -15.273 1.00 22.23 C ATOM 1548 C LYS A 110 -8.932 -8.611 -15.291 1.00 3.14 C ATOM 1549 O LYS A 110 -9.191 -9.683 -15.851 1.00 34.33 O ATOM 1550 CB LYS A 110 -7.379 -7.067 -16.447 1.00 30.25 C ATOM 1551 CG LYS A 110 -7.761 -7.649 -17.794 1.00 15.02 C ATOM 1552 CD LYS A 110 -7.796 -6.582 -18.849 1.00 3.23 C ATOM 1553 CE LYS A 110 -8.361 -7.113 -20.154 1.00 21.22 C ATOM 1554 NZ LYS A 110 -8.514 -6.040 -21.156 1.00 25.43 N ATOM 0 H LYS A 110 -6.240 -9.357 -16.228 1.00 1.00 H new ATOM 0 HA LYS A 110 -7.359 -7.497 -14.345 1.00 22.23 H new ATOM 0 HB2 LYS A 110 -7.996 -6.189 -16.255 1.00 30.25 H new ATOM 0 HB3 LYS A 110 -6.345 -6.726 -16.492 1.00 30.25 H new ATOM 0 HG2 LYS A 110 -7.046 -8.422 -18.076 1.00 15.02 H new ATOM 0 HG3 LYS A 110 -8.737 -8.128 -17.724 1.00 15.02 H new ATOM 0 HD2 LYS A 110 -8.402 -5.745 -18.502 1.00 3.23 H new ATOM 0 HD3 LYS A 110 -6.789 -6.199 -19.015 1.00 3.23 H new ATOM 0 HE2 LYS A 110 -7.703 -7.888 -20.547 1.00 21.22 H new ATOM 0 HE3 LYS A 110 -9.329 -7.580 -19.969 1.00 21.22 H new ATOM 0 HZ1 LYS A 110 -8.902 -6.438 -22.035 1.00 25.43 H new ATOM 0 HZ2 LYS A 110 -9.161 -5.313 -20.790 1.00 25.43 H new ATOM 0 HZ3 LYS A 110 -7.586 -5.612 -21.350 1.00 25.43 H new ATOM 1568 N MET A 111 -9.808 -7.906 -14.665 1.00 73.13 N ATOM 1569 CA MET A 111 -11.207 -8.204 -14.644 1.00 52.45 C ATOM 1570 C MET A 111 -11.979 -6.961 -14.829 1.00 31.21 C ATOM 1571 O MET A 111 -11.476 -5.857 -14.600 1.00 73.12 O ATOM 1572 CB MET A 111 -11.641 -8.859 -13.353 1.00 65.03 C ATOM 1573 CG MET A 111 -11.118 -10.244 -13.188 1.00 34.11 C ATOM 1574 SD MET A 111 -11.595 -11.003 -11.636 1.00 12.22 S ATOM 1575 CE MET A 111 -13.371 -10.955 -11.789 1.00 43.44 C ATOM 0 H MET A 111 -9.565 -7.072 -14.131 1.00 73.13 H new ATOM 0 HA MET A 111 -11.397 -8.906 -15.456 1.00 52.45 H new ATOM 0 HB2 MET A 111 -11.305 -8.249 -12.514 1.00 65.03 H new ATOM 0 HB3 MET A 111 -12.730 -8.883 -13.314 1.00 65.03 H new ATOM 0 HG2 MET A 111 -11.477 -10.861 -14.012 1.00 34.11 H new ATOM 0 HG3 MET A 111 -10.030 -10.224 -13.256 1.00 34.11 H new ATOM 0 HE1 MET A 111 -13.807 -11.785 -11.232 1.00 43.44 H new ATOM 0 HE2 MET A 111 -13.745 -10.013 -11.388 1.00 43.44 H new ATOM 0 HE3 MET A 111 -13.648 -11.038 -12.840 1.00 43.44 H new ATOM 1585 N ALA A 112 -13.174 -7.121 -15.219 1.00 35.13 N ATOM 1586 CA ALA A 112 -14.037 -6.001 -15.445 1.00 2.41 C ATOM 1587 C ALA A 112 -14.942 -5.805 -14.266 1.00 64.24 C ATOM 1588 O ALA A 112 -15.551 -6.760 -13.768 1.00 32.11 O ATOM 1589 CB ALA A 112 -14.837 -6.181 -16.721 1.00 11.55 C ATOM 0 H ALA A 112 -13.602 -8.030 -15.397 1.00 35.13 H new ATOM 0 HA ALA A 112 -13.424 -5.108 -15.564 1.00 2.41 H new ATOM 0 HB1 ALA A 112 -15.484 -5.317 -16.869 1.00 11.55 H new ATOM 0 HB2 ALA A 112 -14.156 -6.274 -17.567 1.00 11.55 H new ATOM 0 HB3 ALA A 112 -15.446 -7.082 -16.645 1.00 11.55 H new ATOM 1595 N VAL A 113 -15.011 -4.591 -13.798 1.00 45.11 N ATOM 1596 CA VAL A 113 -15.847 -4.227 -12.675 1.00 5.12 C ATOM 1597 C VAL A 113 -16.373 -2.835 -12.903 1.00 31.42 C ATOM 1598 O VAL A 113 -15.992 -2.165 -13.869 1.00 21.02 O ATOM 1599 CB VAL A 113 -15.074 -4.227 -11.314 1.00 21.22 C ATOM 1600 CG1 VAL A 113 -14.501 -5.588 -10.973 1.00 64.14 C ATOM 1601 CG2 VAL A 113 -13.989 -3.180 -11.315 1.00 61.32 C ATOM 0 H VAL A 113 -14.483 -3.810 -14.187 1.00 45.11 H new ATOM 0 HA VAL A 113 -16.643 -4.969 -12.611 1.00 5.12 H new ATOM 0 HB VAL A 113 -15.800 -3.982 -10.538 1.00 21.22 H new ATOM 0 HG11 VAL A 113 -13.975 -5.533 -10.020 1.00 64.14 H new ATOM 0 HG12 VAL A 113 -15.310 -6.315 -10.900 1.00 64.14 H new ATOM 0 HG13 VAL A 113 -13.806 -5.896 -11.754 1.00 64.14 H new ATOM 0 HG21 VAL A 113 -13.465 -3.198 -10.359 1.00 61.32 H new ATOM 0 HG22 VAL A 113 -13.284 -3.388 -12.120 1.00 61.32 H new ATOM 0 HG23 VAL A 113 -14.433 -2.196 -11.467 1.00 61.32 H new ATOM 1611 N LYS A 114 -17.235 -2.398 -12.058 1.00 60.50 N ATOM 1612 CA LYS A 114 -17.704 -1.056 -12.141 1.00 62.42 C ATOM 1613 C LYS A 114 -17.351 -0.352 -10.864 1.00 51.52 C ATOM 1614 O LYS A 114 -17.224 -0.996 -9.822 1.00 5.11 O ATOM 1615 CB LYS A 114 -19.197 -1.020 -12.390 1.00 1.33 C ATOM 1616 CG LYS A 114 -19.608 -1.831 -13.599 1.00 4.01 C ATOM 1617 CD LYS A 114 -21.056 -1.656 -13.913 1.00 14.13 C ATOM 1618 CE LYS A 114 -21.520 -2.651 -14.961 1.00 72.22 C ATOM 1619 NZ LYS A 114 -20.804 -2.536 -16.242 1.00 30.24 N ATOM 0 H LYS A 114 -17.633 -2.949 -11.298 1.00 60.50 H new ATOM 0 HA LYS A 114 -17.229 -0.549 -12.981 1.00 62.42 H new ATOM 0 HB2 LYS A 114 -19.717 -1.399 -11.510 1.00 1.33 H new ATOM 0 HB3 LYS A 114 -19.513 0.014 -12.527 1.00 1.33 H new ATOM 0 HG2 LYS A 114 -19.010 -1.531 -14.459 1.00 4.01 H new ATOM 0 HG3 LYS A 114 -19.399 -2.885 -13.418 1.00 4.01 H new ATOM 0 HD2 LYS A 114 -21.645 -1.782 -13.004 1.00 14.13 H new ATOM 0 HD3 LYS A 114 -21.232 -0.641 -14.269 1.00 14.13 H new ATOM 0 HE2 LYS A 114 -21.392 -3.661 -14.572 1.00 72.22 H new ATOM 0 HE3 LYS A 114 -22.586 -2.510 -15.137 1.00 72.22 H new ATOM 0 HZ1 LYS A 114 -21.147 -3.266 -16.898 1.00 30.24 H new ATOM 0 HZ2 LYS A 114 -20.974 -1.595 -16.651 1.00 30.24 H new ATOM 0 HZ3 LYS A 114 -19.784 -2.666 -16.083 1.00 30.24 H new ATOM 1633 N THR A 115 -17.155 0.925 -10.925 1.00 64.35 N ATOM 1634 CA THR A 115 -16.823 1.659 -9.743 1.00 61.31 C ATOM 1635 C THR A 115 -17.471 3.027 -9.805 1.00 25.41 C ATOM 1636 O THR A 115 -18.045 3.406 -10.844 1.00 33.54 O ATOM 1637 CB THR A 115 -15.281 1.781 -9.525 1.00 51.24 C ATOM 1638 OG1 THR A 115 -15.011 2.257 -8.193 1.00 32.13 O ATOM 1639 CG2 THR A 115 -14.666 2.758 -10.523 1.00 1.01 C ATOM 0 H THR A 115 -17.218 1.482 -11.777 1.00 64.35 H new ATOM 0 HA THR A 115 -17.209 1.108 -8.886 1.00 61.31 H new ATOM 0 HB THR A 115 -14.842 0.794 -9.670 1.00 51.24 H new ATOM 0 HG1 THR A 115 -15.203 1.546 -7.546 1.00 32.13 H new ATOM 0 HG21 THR A 115 -13.592 2.826 -10.351 1.00 1.01 H new ATOM 0 HG22 THR A 115 -14.849 2.405 -11.538 1.00 1.01 H new ATOM 0 HG23 THR A 115 -15.117 3.742 -10.394 1.00 1.01 H new ATOM 1647 N TYR A 116 -17.384 3.744 -8.722 1.00 71.14 N ATOM 1648 CA TYR A 116 -17.989 5.028 -8.604 1.00 43.21 C ATOM 1649 C TYR A 116 -16.922 6.071 -8.408 1.00 13.15 C ATOM 1650 O TYR A 116 -16.284 6.133 -7.356 1.00 21.34 O ATOM 1651 CB TYR A 116 -18.999 5.036 -7.449 1.00 35.34 C ATOM 1652 CG TYR A 116 -20.153 4.073 -7.649 1.00 64.31 C ATOM 1653 CD1 TYR A 116 -20.028 2.731 -7.318 1.00 72.15 C ATOM 1654 CD2 TYR A 116 -21.358 4.507 -8.177 1.00 44.55 C ATOM 1655 CE1 TYR A 116 -21.069 1.848 -7.511 1.00 4.12 C ATOM 1656 CE2 TYR A 116 -22.408 3.631 -8.370 1.00 50.12 C ATOM 1657 CZ TYR A 116 -22.255 2.302 -8.037 1.00 4.30 C ATOM 1658 OH TYR A 116 -23.290 1.425 -8.225 1.00 65.13 O ATOM 0 H TYR A 116 -16.882 3.444 -7.887 1.00 71.14 H new ATOM 0 HA TYR A 116 -18.533 5.261 -9.519 1.00 43.21 H new ATOM 0 HB2 TYR A 116 -18.482 4.784 -6.523 1.00 35.34 H new ATOM 0 HB3 TYR A 116 -19.394 6.045 -7.329 1.00 35.34 H new ATOM 0 HD1 TYR A 116 -19.098 2.372 -6.902 1.00 72.15 H new ATOM 0 HD2 TYR A 116 -21.478 5.547 -8.442 1.00 44.55 H new ATOM 0 HE1 TYR A 116 -20.953 0.806 -7.251 1.00 4.12 H new ATOM 0 HE2 TYR A 116 -23.343 3.985 -8.779 1.00 50.12 H new ATOM 0 HH TYR A 116 -23.748 1.635 -9.065 1.00 65.13 H new ATOM 1668 N MET A 117 -16.709 6.866 -9.424 1.00 52.43 N ATOM 1669 CA MET A 117 -15.713 7.907 -9.367 1.00 54.20 C ATOM 1670 C MET A 117 -16.379 9.258 -9.263 1.00 1.43 C ATOM 1671 O MET A 117 -17.551 9.422 -9.644 1.00 22.51 O ATOM 1672 CB MET A 117 -14.714 7.881 -10.547 1.00 50.04 C ATOM 1673 CG MET A 117 -15.320 8.134 -11.896 1.00 5.43 C ATOM 1674 SD MET A 117 -14.093 8.319 -13.195 1.00 62.23 S ATOM 1675 CE MET A 117 -15.154 8.388 -14.628 1.00 63.43 C ATOM 0 H MET A 117 -17.216 6.812 -10.308 1.00 52.43 H new ATOM 0 HA MET A 117 -15.120 7.717 -8.472 1.00 54.20 H new ATOM 0 HB2 MET A 117 -13.942 8.629 -10.366 1.00 50.04 H new ATOM 0 HB3 MET A 117 -14.220 6.910 -10.564 1.00 50.04 H new ATOM 0 HG2 MET A 117 -15.987 7.310 -12.149 1.00 5.43 H new ATOM 0 HG3 MET A 117 -15.931 9.036 -11.850 1.00 5.43 H new ATOM 0 HE1 MET A 117 -15.009 7.492 -15.232 1.00 63.43 H new ATOM 0 HE2 MET A 117 -16.194 8.445 -14.308 1.00 63.43 H new ATOM 0 HE3 MET A 117 -14.908 9.269 -15.221 1.00 63.43 H new ATOM 1685 N TRP A 118 -15.651 10.192 -8.731 1.00 54.31 N ATOM 1686 CA TRP A 118 -16.107 11.535 -8.524 1.00 43.10 C ATOM 1687 C TRP A 118 -16.269 12.197 -9.887 1.00 43.45 C ATOM 1688 O TRP A 118 -15.369 12.110 -10.738 1.00 24.22 O ATOM 1689 CB TRP A 118 -15.071 12.261 -7.668 1.00 33.15 C ATOM 1690 CG TRP A 118 -15.491 13.596 -7.197 1.00 3.42 C ATOM 1691 CD1 TRP A 118 -15.000 14.793 -7.572 1.00 54.42 C ATOM 1692 CD2 TRP A 118 -16.504 13.856 -6.256 1.00 11.23 C ATOM 1693 NE1 TRP A 118 -15.654 15.795 -6.908 1.00 44.12 N ATOM 1694 CE2 TRP A 118 -16.584 15.242 -6.093 1.00 71.24 C ATOM 1695 CE3 TRP A 118 -17.351 13.046 -5.539 1.00 15.33 C ATOM 1696 CZ2 TRP A 118 -17.488 15.836 -5.228 1.00 3.24 C ATOM 1697 CZ3 TRP A 118 -18.240 13.614 -4.690 1.00 1.13 C ATOM 1698 CH2 TRP A 118 -18.317 15.003 -4.530 1.00 0.15 C ATOM 0 H TRP A 118 -14.693 10.037 -8.419 1.00 54.31 H new ATOM 0 HA TRP A 118 -17.067 11.564 -8.008 1.00 43.10 H new ATOM 0 HB2 TRP A 118 -14.836 11.642 -6.802 1.00 33.15 H new ATOM 0 HB3 TRP A 118 -14.152 12.366 -8.244 1.00 33.15 H new ATOM 0 HD1 TRP A 118 -14.207 14.940 -8.291 1.00 54.42 H new ATOM 0 HE1 TRP A 118 -15.471 16.793 -7.010 1.00 44.12 H new ATOM 0 HE3 TRP A 118 -17.308 11.973 -5.651 1.00 15.33 H new ATOM 0 HZ2 TRP A 118 -17.536 16.909 -5.110 1.00 3.24 H new ATOM 0 HZ3 TRP A 118 -18.906 12.980 -4.123 1.00 1.13 H new ATOM 0 HH2 TRP A 118 -19.041 15.422 -3.846 1.00 0.15 H new ATOM 1709 N ILE A 119 -17.409 12.824 -10.119 1.00 70.34 N ATOM 1710 CA ILE A 119 -17.678 13.351 -11.456 1.00 44.33 C ATOM 1711 C ILE A 119 -16.854 14.595 -11.747 1.00 12.24 C ATOM 1712 O ILE A 119 -16.263 14.710 -12.826 1.00 43.22 O ATOM 1713 CB ILE A 119 -19.198 13.656 -11.776 1.00 42.44 C ATOM 1714 CG1 ILE A 119 -20.119 12.456 -11.533 1.00 3.41 C ATOM 1715 CG2 ILE A 119 -19.337 14.056 -13.232 1.00 74.50 C ATOM 1716 CD1 ILE A 119 -20.334 12.100 -10.095 1.00 32.10 C ATOM 0 H ILE A 119 -18.144 12.980 -9.429 1.00 70.34 H new ATOM 0 HA ILE A 119 -17.383 12.532 -12.112 1.00 44.33 H new ATOM 0 HB ILE A 119 -19.499 14.457 -11.101 1.00 42.44 H new ATOM 0 HG12 ILE A 119 -21.087 12.663 -11.988 1.00 3.41 H new ATOM 0 HG13 ILE A 119 -19.704 11.589 -12.047 1.00 3.41 H new ATOM 0 HG21 ILE A 119 -20.383 14.266 -13.453 1.00 74.50 H new ATOM 0 HG22 ILE A 119 -18.740 14.947 -13.423 1.00 74.50 H new ATOM 0 HG23 ILE A 119 -18.988 13.242 -13.868 1.00 74.50 H new ATOM 0 HD11 ILE A 119 -20.999 11.239 -10.029 1.00 32.10 H new ATOM 0 HD12 ILE A 119 -19.377 11.855 -9.634 1.00 32.10 H new ATOM 0 HD13 ILE A 119 -20.782 12.946 -9.574 1.00 32.10 H new ATOM 1728 N ASN A 120 -16.762 15.486 -10.776 1.00 54.43 N ATOM 1729 CA ASN A 120 -16.045 16.747 -10.967 1.00 73.43 C ATOM 1730 C ASN A 120 -14.565 16.550 -10.727 1.00 42.14 C ATOM 1731 O ASN A 120 -14.078 16.632 -9.610 1.00 2.54 O ATOM 1732 CB ASN A 120 -16.625 17.861 -10.089 1.00 52.41 C ATOM 1733 CG ASN A 120 -15.944 19.203 -10.299 1.00 51.13 C ATOM 1734 OD1 ASN A 120 -14.963 19.495 -9.498 1.00 41.43 O flip ATOM 1735 ND2 ASN A 120 -16.327 19.978 -11.174 1.00 13.43 N flip ATOM 0 H ASN A 120 -17.171 15.367 -9.849 1.00 54.43 H new ATOM 0 HA ASN A 120 -16.177 17.065 -12.001 1.00 73.43 H new ATOM 0 HB2 ASN A 120 -17.690 17.964 -10.300 1.00 52.41 H new ATOM 0 HB3 ASN A 120 -16.534 17.574 -9.041 1.00 52.41 H new ATOM 0 HD21 ASN A 120 -17.100 19.715 -11.785 1.00 13.43 H new ATOM 0 HD22 ASN A 120 -15.871 20.883 -11.289 1.00 13.43 H new ATOM 1742 N LYS A 121 -13.864 16.296 -11.789 1.00 11.01 N ATOM 1743 CA LYS A 121 -12.476 15.882 -11.736 1.00 0.14 C ATOM 1744 C LYS A 121 -11.515 17.038 -11.497 1.00 52.33 C ATOM 1745 O LYS A 121 -10.316 16.826 -11.305 1.00 72.51 O ATOM 1746 CB LYS A 121 -12.153 15.117 -13.004 1.00 53.51 C ATOM 1747 CG LYS A 121 -13.118 13.964 -13.193 1.00 25.14 C ATOM 1748 CD LYS A 121 -12.926 13.234 -14.491 1.00 70.23 C ATOM 1749 CE LYS A 121 -14.014 12.187 -14.654 1.00 2.12 C ATOM 1750 NZ LYS A 121 -15.363 12.803 -14.698 1.00 32.21 N ATOM 0 H LYS A 121 -14.236 16.368 -12.736 1.00 11.01 H new ATOM 0 HA LYS A 121 -12.340 15.231 -10.873 1.00 0.14 H new ATOM 0 HB2 LYS A 121 -12.206 15.787 -13.862 1.00 53.51 H new ATOM 0 HB3 LYS A 121 -11.132 14.739 -12.957 1.00 53.51 H new ATOM 0 HG2 LYS A 121 -12.999 13.261 -12.368 1.00 25.14 H new ATOM 0 HG3 LYS A 121 -14.139 14.343 -13.145 1.00 25.14 H new ATOM 0 HD2 LYS A 121 -12.957 13.937 -15.323 1.00 70.23 H new ATOM 0 HD3 LYS A 121 -11.945 12.759 -14.511 1.00 70.23 H new ATOM 0 HE2 LYS A 121 -13.841 11.622 -15.570 1.00 2.12 H new ATOM 0 HE3 LYS A 121 -13.964 11.478 -13.828 1.00 2.12 H new ATOM 0 HZ1 LYS A 121 -16.058 12.095 -15.010 1.00 32.21 H new ATOM 0 HZ2 LYS A 121 -15.620 13.145 -13.750 1.00 32.21 H new ATOM 0 HZ3 LYS A 121 -15.359 13.601 -15.365 1.00 32.21 H new ATOM 1764 N ALA A 122 -12.031 18.242 -11.496 1.00 73.41 N ATOM 1765 CA ALA A 122 -11.223 19.393 -11.210 1.00 12.51 C ATOM 1766 C ALA A 122 -11.761 20.121 -9.989 1.00 40.22 C ATOM 1767 O ALA A 122 -12.588 21.034 -10.098 1.00 3.30 O ATOM 1768 CB ALA A 122 -11.115 20.322 -12.415 1.00 43.21 C ATOM 0 H ALA A 122 -13.011 18.447 -11.691 1.00 73.41 H new ATOM 0 HA ALA A 122 -10.212 19.051 -10.988 1.00 12.51 H new ATOM 0 HB1 ALA A 122 -10.495 21.181 -12.158 1.00 43.21 H new ATOM 0 HB2 ALA A 122 -10.663 19.785 -13.249 1.00 43.21 H new ATOM 0 HB3 ALA A 122 -12.110 20.665 -12.701 1.00 43.21 H new ATOM 1774 N ASP A 123 -11.356 19.668 -8.831 1.00 53.02 N ATOM 1775 CA ASP A 123 -11.759 20.281 -7.573 1.00 33.50 C ATOM 1776 C ASP A 123 -10.550 20.461 -6.681 1.00 25.41 C ATOM 1777 O ASP A 123 -9.853 19.484 -6.347 1.00 64.40 O ATOM 1778 CB ASP A 123 -12.857 19.476 -6.846 1.00 21.35 C ATOM 1779 CG ASP A 123 -13.215 20.077 -5.505 1.00 25.22 C ATOM 1780 OD1 ASP A 123 -13.908 21.105 -5.469 1.00 42.55 O ATOM 1781 OD2 ASP A 123 -12.807 19.521 -4.468 1.00 24.44 O ATOM 0 H ASP A 123 -10.737 18.864 -8.724 1.00 53.02 H new ATOM 0 HA ASP A 123 -12.190 21.255 -7.806 1.00 33.50 H new ATOM 0 HB2 ASP A 123 -13.748 19.433 -7.472 1.00 21.35 H new ATOM 0 HB3 ASP A 123 -12.518 18.450 -6.703 1.00 21.35 H new ATOM 1786 N PRO A 124 -10.257 21.699 -6.297 1.00 43.41 N ATOM 1787 CA PRO A 124 -9.094 22.010 -5.480 1.00 31.32 C ATOM 1788 C PRO A 124 -9.270 21.642 -4.006 1.00 21.01 C ATOM 1789 O PRO A 124 -8.303 21.621 -3.248 1.00 0.42 O ATOM 1790 CB PRO A 124 -8.946 23.521 -5.640 1.00 71.12 C ATOM 1791 CG PRO A 124 -10.327 24.011 -5.906 1.00 13.43 C ATOM 1792 CD PRO A 124 -11.034 22.914 -6.645 1.00 24.55 C ATOM 0 HA PRO A 124 -8.222 21.439 -5.797 1.00 31.32 H new ATOM 0 HB2 PRO A 124 -8.531 23.976 -4.740 1.00 71.12 H new ATOM 0 HB3 PRO A 124 -8.273 23.768 -6.461 1.00 71.12 H new ATOM 0 HG2 PRO A 124 -10.842 24.245 -4.974 1.00 13.43 H new ATOM 0 HG3 PRO A 124 -10.307 24.926 -6.497 1.00 13.43 H new ATOM 0 HD2 PRO A 124 -12.075 22.827 -6.333 1.00 24.55 H new ATOM 0 HD3 PRO A 124 -11.038 23.093 -7.720 1.00 24.55 H new ATOM 1800 N ASP A 125 -10.489 21.330 -3.609 1.00 12.22 N ATOM 1801 CA ASP A 125 -10.757 21.032 -2.216 1.00 4.12 C ATOM 1802 C ASP A 125 -10.619 19.574 -1.871 1.00 44.54 C ATOM 1803 O ASP A 125 -10.481 19.223 -0.682 1.00 31.03 O ATOM 1804 CB ASP A 125 -12.068 21.610 -1.726 1.00 43.23 C ATOM 1805 CG ASP A 125 -12.022 23.117 -1.613 1.00 73.30 C ATOM 1806 OD1 ASP A 125 -11.470 23.633 -0.602 1.00 12.25 O ATOM 1807 OD2 ASP A 125 -12.521 23.810 -2.514 1.00 23.04 O ATOM 0 H ASP A 125 -11.301 21.277 -4.224 1.00 12.22 H new ATOM 0 HA ASP A 125 -9.966 21.544 -1.668 1.00 4.12 H new ATOM 0 HB2 ASP A 125 -12.867 21.323 -2.409 1.00 43.23 H new ATOM 0 HB3 ASP A 125 -12.311 21.182 -0.753 1.00 43.23 H new ATOM 1812 N MET A 126 -10.691 18.700 -2.856 1.00 51.42 N ATOM 1813 CA MET A 126 -10.370 17.331 -2.595 1.00 62.42 C ATOM 1814 C MET A 126 -8.866 17.177 -2.601 1.00 54.24 C ATOM 1815 O MET A 126 -8.225 16.969 -3.635 1.00 52.20 O ATOM 1816 CB MET A 126 -11.069 16.353 -3.544 1.00 25.24 C ATOM 1817 CG MET A 126 -10.821 16.615 -5.009 1.00 65.44 C ATOM 1818 SD MET A 126 -11.692 15.487 -6.087 1.00 23.41 S ATOM 1819 CE MET A 126 -11.171 16.145 -7.649 1.00 2.14 C ATOM 0 H MET A 126 -10.962 18.915 -3.816 1.00 51.42 H new ATOM 0 HA MET A 126 -10.754 17.066 -1.610 1.00 62.42 H new ATOM 0 HB2 MET A 126 -10.740 15.341 -3.309 1.00 25.24 H new ATOM 0 HB3 MET A 126 -12.142 16.391 -3.358 1.00 25.24 H new ATOM 0 HG2 MET A 126 -11.121 17.636 -5.244 1.00 65.44 H new ATOM 0 HG3 MET A 126 -9.752 16.544 -5.208 1.00 65.44 H new ATOM 0 HE1 MET A 126 -12.016 16.628 -8.140 1.00 2.14 H new ATOM 0 HE2 MET A 126 -10.378 16.875 -7.490 1.00 2.14 H new ATOM 0 HE3 MET A 126 -10.799 15.337 -8.278 1.00 2.14 H new ATOM 2066 N LYS A 140 8.101 16.918 -6.303 1.00 72.43 N ATOM 2067 CA LYS A 140 7.699 18.300 -6.549 1.00 32.21 C ATOM 2068 C LYS A 140 8.511 19.262 -5.679 1.00 4.44 C ATOM 2069 O LYS A 140 8.853 20.370 -6.104 1.00 12.32 O ATOM 2070 CB LYS A 140 6.214 18.446 -6.214 1.00 34.02 C ATOM 2071 CG LYS A 140 5.639 19.844 -6.386 1.00 15.42 C ATOM 2072 CD LYS A 140 4.172 19.888 -5.987 1.00 73.10 C ATOM 2073 CE LYS A 140 3.982 19.575 -4.506 1.00 61.12 C ATOM 2074 NZ LYS A 140 2.565 19.597 -4.108 1.00 44.25 N ATOM 0 HA LYS A 140 7.880 18.543 -7.596 1.00 32.21 H new ATOM 0 HB2 LYS A 140 5.648 17.759 -6.843 1.00 34.02 H new ATOM 0 HB3 LYS A 140 6.060 18.133 -5.181 1.00 34.02 H new ATOM 0 HG2 LYS A 140 6.205 20.550 -5.779 1.00 15.42 H new ATOM 0 HG3 LYS A 140 5.746 20.159 -7.424 1.00 15.42 H new ATOM 0 HD2 LYS A 140 3.765 20.875 -6.206 1.00 73.10 H new ATOM 0 HD3 LYS A 140 3.610 19.171 -6.586 1.00 73.10 H new ATOM 0 HE2 LYS A 140 4.403 18.594 -4.287 1.00 61.12 H new ATOM 0 HE3 LYS A 140 4.536 20.300 -3.910 1.00 61.12 H new ATOM 0 HZ1 LYS A 140 2.486 19.379 -3.094 1.00 44.25 H new ATOM 0 HZ2 LYS A 140 2.168 20.540 -4.291 1.00 44.25 H new ATOM 0 HZ3 LYS A 140 2.039 18.887 -4.657 1.00 44.25 H new ATOM 2088 N LYS A 141 8.825 18.799 -4.470 1.00 71.21 N ATOM 2089 CA LYS A 141 9.504 19.563 -3.416 1.00 14.32 C ATOM 2090 C LYS A 141 10.773 20.235 -3.922 1.00 22.00 C ATOM 2091 O LYS A 141 11.134 21.303 -3.462 1.00 20.15 O ATOM 2092 CB LYS A 141 9.803 18.649 -2.216 1.00 51.23 C ATOM 2093 CG LYS A 141 10.246 19.362 -0.952 1.00 2.43 C ATOM 2094 CD LYS A 141 10.465 18.368 0.181 1.00 63.32 C ATOM 2095 CE LYS A 141 10.776 19.065 1.498 1.00 4.03 C ATOM 2096 NZ LYS A 141 11.982 19.904 1.418 1.00 61.35 N ATOM 0 H LYS A 141 8.606 17.845 -4.183 1.00 71.21 H new ATOM 0 HA LYS A 141 8.834 20.361 -3.096 1.00 14.32 H new ATOM 0 HB2 LYS A 141 8.909 18.068 -1.991 1.00 51.23 H new ATOM 0 HB3 LYS A 141 10.579 17.940 -2.505 1.00 51.23 H new ATOM 0 HG2 LYS A 141 11.168 19.911 -1.143 1.00 2.43 H new ATOM 0 HG3 LYS A 141 9.493 20.094 -0.659 1.00 2.43 H new ATOM 0 HD2 LYS A 141 9.575 17.751 0.299 1.00 63.32 H new ATOM 0 HD3 LYS A 141 11.285 17.698 -0.077 1.00 63.32 H new ATOM 0 HE2 LYS A 141 9.926 19.682 1.789 1.00 4.03 H new ATOM 0 HE3 LYS A 141 10.909 18.317 2.279 1.00 4.03 H new ATOM 0 HZ1 LYS A 141 12.488 19.873 2.326 1.00 61.35 H new ATOM 0 HZ2 LYS A 141 12.603 19.548 0.663 1.00 61.35 H new ATOM 0 HZ3 LYS A 141 11.709 20.885 1.208 1.00 61.35 H new ATOM 2110 N LYS A 142 11.416 19.604 -4.893 1.00 43.14 N ATOM 2111 CA LYS A 142 12.633 20.124 -5.519 1.00 63.01 C ATOM 2112 C LYS A 142 12.394 21.551 -6.046 1.00 30.43 C ATOM 2113 O LYS A 142 13.203 22.464 -5.826 1.00 31.25 O ATOM 2114 CB LYS A 142 13.017 19.210 -6.687 1.00 71.10 C ATOM 2115 CG LYS A 142 14.311 19.585 -7.378 1.00 24.32 C ATOM 2116 CD LYS A 142 14.584 18.683 -8.567 1.00 12.44 C ATOM 2117 CE LYS A 142 15.930 18.996 -9.206 1.00 5.13 C ATOM 2118 NZ LYS A 142 17.055 18.775 -8.265 1.00 4.21 N ATOM 0 H LYS A 142 11.109 18.709 -5.275 1.00 43.14 H new ATOM 0 HA LYS A 142 13.435 20.151 -4.781 1.00 63.01 H new ATOM 0 HB2 LYS A 142 13.099 18.187 -6.320 1.00 71.10 H new ATOM 0 HB3 LYS A 142 12.211 19.221 -7.421 1.00 71.10 H new ATOM 0 HG2 LYS A 142 14.261 20.622 -7.710 1.00 24.32 H new ATOM 0 HG3 LYS A 142 15.137 19.516 -6.670 1.00 24.32 H new ATOM 0 HD2 LYS A 142 14.565 17.641 -8.247 1.00 12.44 H new ATOM 0 HD3 LYS A 142 13.792 18.804 -9.306 1.00 12.44 H new ATOM 0 HE2 LYS A 142 16.067 18.371 -10.088 1.00 5.13 H new ATOM 0 HE3 LYS A 142 15.939 20.032 -9.545 1.00 5.13 H new ATOM 0 HZ1 LYS A 142 17.948 18.733 -8.796 1.00 4.21 H new ATOM 0 HZ2 LYS A 142 17.095 19.558 -7.582 1.00 4.21 H new ATOM 0 HZ3 LYS A 142 16.912 17.879 -7.757 1.00 4.21 H new ATOM 2132 N PHE A 143 11.281 21.723 -6.733 1.00 14.45 N ATOM 2133 CA PHE A 143 10.887 23.011 -7.287 1.00 75.11 C ATOM 2134 C PHE A 143 10.321 23.893 -6.179 1.00 25.23 C ATOM 2135 O PHE A 143 10.494 25.120 -6.171 1.00 33.14 O ATOM 2136 CB PHE A 143 9.823 22.809 -8.376 1.00 2.11 C ATOM 2137 CG PHE A 143 10.243 21.877 -9.479 1.00 44.42 C ATOM 2138 CD1 PHE A 143 10.922 22.350 -10.586 1.00 4.43 C ATOM 2139 CD2 PHE A 143 9.954 20.522 -9.406 1.00 61.40 C ATOM 2140 CE1 PHE A 143 11.308 21.492 -11.597 1.00 4.23 C ATOM 2141 CE2 PHE A 143 10.336 19.659 -10.410 1.00 3.02 C ATOM 2142 CZ PHE A 143 11.016 20.145 -11.509 1.00 62.12 C ATOM 0 H PHE A 143 10.619 20.971 -6.925 1.00 14.45 H new ATOM 0 HA PHE A 143 11.761 23.493 -7.725 1.00 75.11 H new ATOM 0 HB2 PHE A 143 8.915 22.422 -7.914 1.00 2.11 H new ATOM 0 HB3 PHE A 143 9.573 23.778 -8.809 1.00 2.11 H new ATOM 0 HD1 PHE A 143 11.153 23.402 -10.661 1.00 4.43 H new ATOM 0 HD2 PHE A 143 9.421 20.138 -8.549 1.00 61.40 H new ATOM 0 HE1 PHE A 143 11.838 21.874 -12.457 1.00 4.23 H new ATOM 0 HE2 PHE A 143 10.104 18.607 -10.338 1.00 3.02 H new ATOM 0 HZ PHE A 143 11.319 19.473 -12.298 1.00 62.12 H new ATOM 2152 N ILE A 144 9.655 23.247 -5.240 1.00 1.31 N ATOM 2153 CA ILE A 144 8.989 23.924 -4.140 1.00 5.54 C ATOM 2154 C ILE A 144 9.981 24.640 -3.233 1.00 41.24 C ATOM 2155 O ILE A 144 9.669 25.675 -2.705 1.00 74.20 O ATOM 2156 CB ILE A 144 8.080 22.961 -3.322 1.00 54.20 C ATOM 2157 CG1 ILE A 144 7.048 22.301 -4.234 1.00 65.33 C ATOM 2158 CG2 ILE A 144 7.378 23.688 -2.184 1.00 43.31 C ATOM 2159 CD1 ILE A 144 6.128 23.277 -4.957 1.00 22.32 C ATOM 0 H ILE A 144 9.560 22.232 -5.218 1.00 1.31 H new ATOM 0 HA ILE A 144 8.343 24.679 -4.588 1.00 5.54 H new ATOM 0 HB ILE A 144 8.720 22.193 -2.888 1.00 54.20 H new ATOM 0 HG12 ILE A 144 7.571 21.697 -4.976 1.00 65.33 H new ATOM 0 HG13 ILE A 144 6.439 21.620 -3.640 1.00 65.33 H new ATOM 0 HG21 ILE A 144 6.752 22.985 -1.634 1.00 43.31 H new ATOM 0 HG22 ILE A 144 8.122 24.114 -1.511 1.00 43.31 H new ATOM 0 HG23 ILE A 144 6.757 24.486 -2.590 1.00 43.31 H new ATOM 0 HD11 ILE A 144 5.428 22.722 -5.582 1.00 22.32 H new ATOM 0 HD12 ILE A 144 5.574 23.865 -4.225 1.00 22.32 H new ATOM 0 HD13 ILE A 144 6.723 23.943 -5.582 1.00 22.32 H new ATOM 2171 N GLU A 145 11.179 24.088 -3.069 1.00 70.15 N ATOM 2172 CA GLU A 145 12.229 24.749 -2.268 1.00 43.43 C ATOM 2173 C GLU A 145 12.497 26.174 -2.791 1.00 30.53 C ATOM 2174 O GLU A 145 12.765 27.097 -2.021 1.00 54.12 O ATOM 2175 CB GLU A 145 13.525 23.937 -2.281 1.00 24.54 C ATOM 2176 CG GLU A 145 13.397 22.537 -1.705 1.00 21.31 C ATOM 2177 CD GLU A 145 12.932 22.525 -0.273 1.00 12.03 C ATOM 2178 OE1 GLU A 145 13.720 22.873 0.625 1.00 71.42 O ATOM 2179 OE2 GLU A 145 11.783 22.131 -0.012 1.00 45.23 O ATOM 0 H GLU A 145 11.455 23.193 -3.472 1.00 70.15 H new ATOM 0 HA GLU A 145 11.871 24.811 -1.240 1.00 43.43 H new ATOM 0 HB2 GLU A 145 13.882 23.862 -3.308 1.00 24.54 H new ATOM 0 HB3 GLU A 145 14.285 24.480 -1.718 1.00 24.54 H new ATOM 0 HG2 GLU A 145 12.697 21.964 -2.312 1.00 21.31 H new ATOM 0 HG3 GLU A 145 14.362 22.034 -1.771 1.00 21.31 H new ATOM 2186 N THR A 146 12.394 26.337 -4.102 1.00 33.13 N ATOM 2187 CA THR A 146 12.561 27.622 -4.738 1.00 13.42 C ATOM 2188 C THR A 146 11.318 28.500 -4.468 1.00 32.23 C ATOM 2189 O THR A 146 11.433 29.674 -4.075 1.00 64.40 O ATOM 2190 CB THR A 146 12.750 27.430 -6.262 1.00 2.23 C ATOM 2191 OG1 THR A 146 13.867 26.549 -6.495 1.00 52.22 O ATOM 2192 CG2 THR A 146 13.007 28.758 -6.963 1.00 34.21 C ATOM 0 H THR A 146 12.192 25.576 -4.750 1.00 33.13 H new ATOM 0 HA THR A 146 13.443 28.115 -4.330 1.00 13.42 H new ATOM 0 HB THR A 146 11.834 27.001 -6.667 1.00 2.23 H new ATOM 0 HG1 THR A 146 13.989 26.423 -7.459 1.00 52.22 H new ATOM 0 HG21 THR A 146 13.135 28.586 -8.032 1.00 34.21 H new ATOM 0 HG22 THR A 146 12.160 29.425 -6.801 1.00 34.21 H new ATOM 0 HG23 THR A 146 13.910 29.214 -6.558 1.00 34.21 H new ATOM 2200 N PHE A 147 10.142 27.909 -4.648 1.00 60.04 N ATOM 2201 CA PHE A 147 8.872 28.600 -4.439 1.00 44.43 C ATOM 2202 C PHE A 147 8.583 28.943 -3.008 1.00 51.12 C ATOM 2203 O PHE A 147 7.909 29.914 -2.744 1.00 64.32 O ATOM 2204 CB PHE A 147 7.697 27.897 -5.094 1.00 13.55 C ATOM 2205 CG PHE A 147 7.651 28.132 -6.557 1.00 52.35 C ATOM 2206 CD1 PHE A 147 7.214 29.350 -7.023 1.00 35.14 C ATOM 2207 CD2 PHE A 147 8.053 27.168 -7.462 1.00 34.55 C ATOM 2208 CE1 PHE A 147 7.168 29.622 -8.357 1.00 54.32 C ATOM 2209 CE2 PHE A 147 8.014 27.429 -8.819 1.00 72.44 C ATOM 2210 CZ PHE A 147 7.569 28.663 -9.270 1.00 33.41 C ATOM 0 H PHE A 147 10.041 26.938 -4.943 1.00 60.04 H new ATOM 0 HA PHE A 147 9.003 29.553 -4.951 1.00 44.43 H new ATOM 0 HB2 PHE A 147 7.763 26.826 -4.901 1.00 13.55 H new ATOM 0 HB3 PHE A 147 6.769 28.246 -4.642 1.00 13.55 H new ATOM 0 HD1 PHE A 147 6.901 30.106 -6.318 1.00 35.14 H new ATOM 0 HD2 PHE A 147 8.399 26.208 -7.108 1.00 34.55 H new ATOM 0 HE1 PHE A 147 6.819 30.584 -8.701 1.00 54.32 H new ATOM 0 HE2 PHE A 147 8.329 26.675 -9.525 1.00 72.44 H new ATOM 0 HZ PHE A 147 7.536 28.874 -10.329 1.00 33.41 H new ATOM 2220 N LYS A 148 9.081 28.148 -2.104 1.00 73.32 N ATOM 2221 CA LYS A 148 8.912 28.356 -0.679 1.00 64.23 C ATOM 2222 C LYS A 148 9.384 29.762 -0.294 1.00 33.15 C ATOM 2223 O LYS A 148 8.719 30.464 0.457 1.00 72.01 O ATOM 2224 CB LYS A 148 9.706 27.290 0.071 1.00 23.34 C ATOM 2225 CG LYS A 148 9.565 27.308 1.576 1.00 74.32 C ATOM 2226 CD LYS A 148 10.344 26.163 2.174 1.00 5.11 C ATOM 2227 CE LYS A 148 10.215 26.111 3.674 1.00 1.41 C ATOM 2228 NZ LYS A 148 10.950 24.960 4.240 1.00 62.42 N ATOM 0 H LYS A 148 9.628 27.318 -2.333 1.00 73.32 H new ATOM 0 HA LYS A 148 7.859 28.272 -0.411 1.00 64.23 H new ATOM 0 HB2 LYS A 148 9.398 26.310 -0.293 1.00 23.34 H new ATOM 0 HB3 LYS A 148 10.761 27.406 -0.178 1.00 23.34 H new ATOM 0 HG2 LYS A 148 9.929 28.255 1.974 1.00 74.32 H new ATOM 0 HG3 LYS A 148 8.514 27.229 1.853 1.00 74.32 H new ATOM 0 HD2 LYS A 148 9.992 25.224 1.748 1.00 5.11 H new ATOM 0 HD3 LYS A 148 11.396 26.261 1.904 1.00 5.11 H new ATOM 0 HE2 LYS A 148 10.597 27.036 4.106 1.00 1.41 H new ATOM 0 HE3 LYS A 148 9.162 26.042 3.948 1.00 1.41 H new ATOM 0 HZ1 LYS A 148 10.841 24.953 5.274 1.00 62.42 H new ATOM 0 HZ2 LYS A 148 10.568 24.077 3.846 1.00 62.42 H new ATOM 0 HZ3 LYS A 148 11.959 25.039 3.999 1.00 62.42 H new ATOM 2242 N LYS A 149 10.503 30.179 -0.885 1.00 41.21 N ATOM 2243 CA LYS A 149 11.070 31.506 -0.647 1.00 33.13 C ATOM 2244 C LYS A 149 10.112 32.572 -1.179 1.00 64.31 C ATOM 2245 O LYS A 149 9.941 33.640 -0.588 1.00 11.31 O ATOM 2246 CB LYS A 149 12.406 31.636 -1.380 1.00 33.04 C ATOM 2247 CG LYS A 149 13.440 30.593 -1.000 1.00 22.42 C ATOM 2248 CD LYS A 149 14.701 30.757 -1.821 1.00 65.21 C ATOM 2249 CE LYS A 149 15.744 29.714 -1.472 1.00 33.03 C ATOM 2250 NZ LYS A 149 16.951 29.844 -2.326 1.00 45.12 N ATOM 0 H LYS A 149 11.040 29.610 -1.539 1.00 41.21 H new ATOM 0 HA LYS A 149 11.222 31.641 0.424 1.00 33.13 H new ATOM 0 HB2 LYS A 149 12.224 31.574 -2.453 1.00 33.04 H new ATOM 0 HB3 LYS A 149 12.818 32.626 -1.183 1.00 33.04 H new ATOM 0 HG2 LYS A 149 13.678 30.681 0.060 1.00 22.42 H new ATOM 0 HG3 LYS A 149 13.029 29.595 -1.153 1.00 22.42 H new ATOM 0 HD2 LYS A 149 14.456 30.685 -2.881 1.00 65.21 H new ATOM 0 HD3 LYS A 149 15.114 31.752 -1.657 1.00 65.21 H new ATOM 0 HE2 LYS A 149 16.026 29.816 -0.424 1.00 33.03 H new ATOM 0 HE3 LYS A 149 15.318 28.718 -1.592 1.00 33.03 H new ATOM 0 HZ1 LYS A 149 17.644 29.115 -2.061 1.00 45.12 H new ATOM 0 HZ2 LYS A 149 16.685 29.722 -3.324 1.00 45.12 H new ATOM 0 HZ3 LYS A 149 17.371 30.786 -2.193 1.00 45.12 H new ATOM 2264 N ILE A 150 9.476 32.248 -2.291 1.00 43.23 N ATOM 2265 CA ILE A 150 8.545 33.135 -2.963 1.00 25.43 C ATOM 2266 C ILE A 150 7.229 33.216 -2.167 1.00 44.43 C ATOM 2267 O ILE A 150 6.631 34.278 -2.041 1.00 14.54 O ATOM 2268 CB ILE A 150 8.293 32.653 -4.434 1.00 63.01 C ATOM 2269 CG1 ILE A 150 9.640 32.595 -5.182 1.00 43.50 C ATOM 2270 CG2 ILE A 150 7.320 33.583 -5.154 1.00 73.34 C ATOM 2271 CD1 ILE A 150 9.553 32.057 -6.591 1.00 1.13 C ATOM 0 H ILE A 150 9.594 31.349 -2.758 1.00 43.23 H new ATOM 0 HA ILE A 150 8.976 34.135 -3.012 1.00 25.43 H new ATOM 0 HB ILE A 150 7.845 31.660 -4.413 1.00 63.01 H new ATOM 0 HG12 ILE A 150 10.066 33.598 -5.215 1.00 43.50 H new ATOM 0 HG13 ILE A 150 10.331 31.974 -4.612 1.00 43.50 H new ATOM 0 HG21 ILE A 150 7.162 33.227 -6.172 1.00 73.34 H new ATOM 0 HG22 ILE A 150 6.368 33.596 -4.622 1.00 73.34 H new ATOM 0 HG23 ILE A 150 7.734 34.591 -5.182 1.00 73.34 H new ATOM 0 HD11 ILE A 150 10.546 32.052 -7.041 1.00 1.13 H new ATOM 0 HD12 ILE A 150 9.160 31.041 -6.569 1.00 1.13 H new ATOM 0 HD13 ILE A 150 8.890 32.690 -7.182 1.00 1.13 H new ATOM 2283 N MET A 151 6.823 32.098 -1.601 1.00 62.52 N ATOM 2284 CA MET A 151 5.614 32.029 -0.786 1.00 2.14 C ATOM 2285 C MET A 151 5.790 32.820 0.503 1.00 31.44 C ATOM 2286 O MET A 151 4.872 33.529 0.938 1.00 3.04 O ATOM 2287 CB MET A 151 5.220 30.574 -0.494 1.00 1.32 C ATOM 2288 CG MET A 151 4.869 29.777 -1.745 1.00 72.01 C ATOM 2289 SD MET A 151 4.449 28.046 -1.414 1.00 75.33 S ATOM 2290 CE MET A 151 3.014 28.234 -0.352 1.00 31.11 C ATOM 0 H MET A 151 7.317 31.210 -1.689 1.00 62.52 H new ATOM 0 HA MET A 151 4.800 32.480 -1.353 1.00 2.14 H new ATOM 0 HB2 MET A 151 6.042 30.080 0.023 1.00 1.32 H new ATOM 0 HB3 MET A 151 4.366 30.566 0.184 1.00 1.32 H new ATOM 0 HG2 MET A 151 4.028 30.256 -2.246 1.00 72.01 H new ATOM 0 HG3 MET A 151 5.712 29.811 -2.435 1.00 72.01 H new ATOM 0 HE1 MET A 151 2.467 27.292 -0.310 1.00 31.11 H new ATOM 0 HE2 MET A 151 3.338 28.511 0.651 1.00 31.11 H new ATOM 0 HE3 MET A 151 2.365 29.013 -0.752 1.00 31.11 H new ATOM 2300 N GLU A 152 6.978 32.717 1.103 1.00 3.22 N ATOM 2301 CA GLU A 152 7.304 33.493 2.299 1.00 13.11 C ATOM 2302 C GLU A 152 7.328 34.983 1.958 1.00 31.43 C ATOM 2303 O GLU A 152 6.990 35.832 2.778 1.00 71.42 O ATOM 2304 CB GLU A 152 8.657 33.068 2.885 1.00 5.40 C ATOM 2305 CG GLU A 152 8.723 31.616 3.338 1.00 15.14 C ATOM 2306 CD GLU A 152 10.078 31.242 3.897 1.00 3.21 C ATOM 2307 OE1 GLU A 152 11.038 31.111 3.117 1.00 34.34 O ATOM 2308 OE2 GLU A 152 10.204 31.063 5.128 1.00 51.41 O ATOM 0 H GLU A 152 7.728 32.105 0.780 1.00 3.22 H new ATOM 0 HA GLU A 152 6.536 33.303 3.049 1.00 13.11 H new ATOM 0 HB2 GLU A 152 9.431 33.237 2.137 1.00 5.40 H new ATOM 0 HB3 GLU A 152 8.888 33.711 3.734 1.00 5.40 H new ATOM 0 HG2 GLU A 152 7.960 31.441 4.097 1.00 15.14 H new ATOM 0 HG3 GLU A 152 8.490 30.965 2.495 1.00 15.14 H new ATOM 2315 N CYS A 153 7.720 35.279 0.735 1.00 0.33 N ATOM 2316 CA CYS A 153 7.778 36.638 0.238 1.00 41.14 C ATOM 2317 C CYS A 153 6.375 37.207 0.021 1.00 13.44 C ATOM 2318 O CYS A 153 6.096 38.342 0.398 1.00 62.22 O ATOM 2319 CB CYS A 153 8.585 36.690 -1.070 1.00 73.35 C ATOM 2320 SG CYS A 153 8.746 38.332 -1.802 1.00 30.20 S ATOM 0 H CYS A 153 8.009 34.577 0.053 1.00 0.33 H new ATOM 0 HA CYS A 153 8.277 37.253 0.987 1.00 41.14 H new ATOM 0 HB2 CYS A 153 9.583 36.294 -0.880 1.00 73.35 H new ATOM 0 HB3 CYS A 153 8.113 36.029 -1.797 1.00 73.35 H new ATOM 0 HG CYS A 153 9.445 38.253 -2.895 1.00 30.20 H new ATOM 2326 N LYS A 154 5.495 36.416 -0.578 1.00 72.34 N ATOM 2327 CA LYS A 154 4.145 36.877 -0.870 1.00 11.24 C ATOM 2328 C LYS A 154 3.271 36.934 0.350 1.00 23.14 C ATOM 2329 O LYS A 154 2.563 37.910 0.565 1.00 11.11 O ATOM 2330 CB LYS A 154 3.469 35.983 -1.880 1.00 52.34 C ATOM 2331 CG LYS A 154 4.121 35.958 -3.222 1.00 55.31 C ATOM 2332 CD LYS A 154 3.297 35.134 -4.164 1.00 75.11 C ATOM 2333 CE LYS A 154 3.879 35.125 -5.556 1.00 33.43 C ATOM 2334 NZ LYS A 154 3.068 34.321 -6.488 1.00 24.41 N ATOM 0 H LYS A 154 5.690 35.458 -0.870 1.00 72.34 H new ATOM 0 HA LYS A 154 4.264 37.885 -1.267 1.00 11.24 H new ATOM 0 HB2 LYS A 154 3.441 34.967 -1.485 1.00 52.34 H new ATOM 0 HB3 LYS A 154 2.435 36.308 -1.999 1.00 52.34 H new ATOM 0 HG2 LYS A 154 4.225 36.973 -3.606 1.00 55.31 H new ATOM 0 HG3 LYS A 154 5.125 35.542 -3.142 1.00 55.31 H new ATOM 0 HD2 LYS A 154 3.231 34.112 -3.791 1.00 75.11 H new ATOM 0 HD3 LYS A 154 2.281 35.527 -4.197 1.00 75.11 H new ATOM 0 HE2 LYS A 154 3.949 36.148 -5.926 1.00 33.43 H new ATOM 0 HE3 LYS A 154 4.893 34.728 -5.522 1.00 33.43 H new ATOM 0 HZ1 LYS A 154 3.503 34.341 -7.433 1.00 24.41 H new ATOM 0 HZ2 LYS A 154 3.021 33.339 -6.149 1.00 24.41 H new ATOM 0 HZ3 LYS A 154 2.107 34.715 -6.541 1.00 24.41 H new