USER MOD reduce.3.24.130724 H: found=0, std=0, add=515, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 518 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 102 HIS : no HE2:sc= -2.08 K(o=-3.7,f=-10!) USER MOD Set 1.2: A 105 ASN : amide:sc= -1.65 K(o=-3.7,f=-9.2!) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 HIS : no HE2:sc= -0.02! C(o=-0.02!,f=-5!) USER MOD Single : A 95 HIS : no HD1:sc= -0.015 X(o=-0.015,f=-0.015) USER MOD Single : A 107 HIS : no HD1:sc= 0.694 K(o=0.69,f=-3.7!) USER MOD Single : A 108 LYS NZ :NH3+ -178:sc= 1.21 (180deg=1.08) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc=-0.00852 USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 124 MET CE :methyl 153:sc= -1.91 (180deg=-3.47!) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot -12:sc= 1.2 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 84:sc= 0.681 USER MOD Single : A 138 ASN : amide:sc= -0.0072 X(o=-0.0072,f=-0.39) USER MOD Single : A 143 ASN : amide:sc= -0.436 K(o=-0.44,f=-3.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 75 10.354 3.566 5.629 1.00 0.00 N ATOM 2 CA GLY A 75 10.782 4.542 4.607 1.00 0.00 C ATOM 3 C GLY A 75 9.921 5.787 4.631 1.00 0.00 C ATOM 4 O GLY A 75 8.702 5.689 4.796 1.00 0.00 O ATOM 0 HA2 GLY A 75 11.823 4.816 4.778 1.00 0.00 H new ATOM 0 HA3 GLY A 75 10.731 4.082 3.620 1.00 0.00 H new ATOM 10 N PRO A 76 10.527 6.980 4.484 1.00 0.00 N ATOM 11 CA PRO A 76 9.790 8.243 4.508 1.00 0.00 C ATOM 12 C PRO A 76 8.843 8.382 3.327 1.00 0.00 C ATOM 13 O PRO A 76 7.679 8.737 3.493 1.00 0.00 O ATOM 14 CB PRO A 76 10.886 9.316 4.460 1.00 0.00 C ATOM 15 CG PRO A 76 12.082 8.628 3.897 1.00 0.00 C ATOM 16 CD PRO A 76 11.975 7.184 4.296 1.00 0.00 C ATOM 0 HA PRO A 76 9.154 8.321 5.390 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.586 10.158 3.836 1.00 0.00 H new ATOM 0 HB3 PRO A 76 11.092 9.713 5.454 1.00 0.00 H new ATOM 0 HG2 PRO A 76 12.112 8.729 2.812 1.00 0.00 H new ATOM 0 HG3 PRO A 76 13.001 9.070 4.284 1.00 0.00 H new ATOM 0 HD2 PRO A 76 12.376 6.525 3.526 1.00 0.00 H new ATOM 0 HD3 PRO A 76 12.530 6.979 5.211 1.00 0.00 H new ATOM 24 N LEU A 77 9.340 8.096 2.152 1.00 0.00 N ATOM 25 CA LEU A 77 8.536 8.187 0.951 1.00 0.00 C ATOM 26 C LEU A 77 7.944 6.827 0.611 1.00 0.00 C ATOM 27 O LEU A 77 8.670 5.846 0.451 1.00 0.00 O ATOM 28 CB LEU A 77 9.374 8.714 -0.222 1.00 0.00 C ATOM 29 CG LEU A 77 8.626 8.913 -1.547 1.00 0.00 C ATOM 30 CD1 LEU A 77 7.522 9.950 -1.398 1.00 0.00 C ATOM 31 CD2 LEU A 77 9.595 9.318 -2.648 1.00 0.00 C ATOM 0 H LEU A 77 10.302 7.796 1.996 1.00 0.00 H new ATOM 0 HA LEU A 77 7.722 8.888 1.132 1.00 0.00 H new ATOM 0 HB2 LEU A 77 9.814 9.667 0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.199 8.022 -0.393 1.00 0.00 H new ATOM 0 HG LEU A 77 8.164 7.965 -1.823 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.007 10.073 -2.351 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.811 9.618 -0.641 1.00 0.00 H new ATOM 0 HD13 LEU A 77 7.956 10.903 -1.095 1.00 0.00 H new ATOM 0 HD21 LEU A 77 9.049 9.455 -3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.087 10.252 -2.375 1.00 0.00 H new ATOM 0 HD23 LEU A 77 10.345 8.538 -2.778 1.00 0.00 H new ATOM 43 N GLY A 78 6.632 6.776 0.499 1.00 0.00 N ATOM 44 CA GLY A 78 5.956 5.547 0.183 1.00 0.00 C ATOM 45 C GLY A 78 5.425 5.567 -1.222 1.00 0.00 C ATOM 46 O GLY A 78 4.312 5.124 -1.483 1.00 0.00 O ATOM 0 H GLY A 78 6.016 7.579 0.624 1.00 0.00 H new ATOM 0 HA2 GLY A 78 6.643 4.709 0.303 1.00 0.00 H new ATOM 0 HA3 GLY A 78 5.135 5.389 0.883 1.00 0.00 H new ATOM 50 N SER A 79 6.225 6.101 -2.128 1.00 0.00 N ATOM 51 CA SER A 79 5.857 6.163 -3.526 1.00 0.00 C ATOM 52 C SER A 79 6.025 4.779 -4.126 1.00 0.00 C ATOM 53 O SER A 79 5.442 4.449 -5.158 1.00 0.00 O ATOM 54 CB SER A 79 6.731 7.185 -4.262 1.00 0.00 C ATOM 55 OG SER A 79 6.284 7.393 -5.594 1.00 0.00 O ATOM 0 H SER A 79 7.139 6.500 -1.915 1.00 0.00 H new ATOM 0 HA SER A 79 4.820 6.482 -3.627 1.00 0.00 H new ATOM 0 HB2 SER A 79 6.718 8.131 -3.722 1.00 0.00 H new ATOM 0 HB3 SER A 79 7.764 6.839 -4.274 1.00 0.00 H new ATOM 0 HG SER A 79 6.862 8.051 -6.034 1.00 0.00 H new ATOM 61 N ASP A 80 6.831 3.982 -3.449 1.00 0.00 N ATOM 62 CA ASP A 80 7.105 2.607 -3.827 1.00 0.00 C ATOM 63 C ASP A 80 7.579 1.855 -2.600 1.00 0.00 C ATOM 64 O ASP A 80 8.756 1.905 -2.240 1.00 0.00 O ATOM 65 CB ASP A 80 8.165 2.526 -4.940 1.00 0.00 C ATOM 66 CG ASP A 80 8.445 1.094 -5.390 1.00 0.00 C ATOM 67 OD1 ASP A 80 7.619 0.526 -6.117 1.00 0.00 O ATOM 68 OD2 ASP A 80 9.507 0.541 -5.034 1.00 0.00 O ATOM 0 H ASP A 80 7.323 4.277 -2.606 1.00 0.00 H new ATOM 0 HA ASP A 80 6.191 2.159 -4.217 1.00 0.00 H new ATOM 0 HB2 ASP A 80 7.831 3.112 -5.796 1.00 0.00 H new ATOM 0 HB3 ASP A 80 9.092 2.978 -4.586 1.00 0.00 H new ATOM 73 N LEU A 81 6.653 1.229 -1.922 1.00 0.00 N ATOM 74 CA LEU A 81 6.962 0.474 -0.721 1.00 0.00 C ATOM 75 C LEU A 81 6.991 -1.007 -1.054 1.00 0.00 C ATOM 76 O LEU A 81 6.076 -1.516 -1.683 1.00 0.00 O ATOM 77 CB LEU A 81 5.913 0.794 0.372 1.00 0.00 C ATOM 78 CG LEU A 81 6.166 0.246 1.797 1.00 0.00 C ATOM 79 CD1 LEU A 81 5.712 -1.196 1.930 1.00 0.00 C ATOM 80 CD2 LEU A 81 7.630 0.389 2.186 1.00 0.00 C ATOM 0 H LEU A 81 5.666 1.224 -2.179 1.00 0.00 H new ATOM 0 HA LEU A 81 7.943 0.754 -0.337 1.00 0.00 H new ATOM 0 HB2 LEU A 81 5.821 1.878 0.441 1.00 0.00 H new ATOM 0 HB3 LEU A 81 4.949 0.414 0.033 1.00 0.00 H new ATOM 0 HG LEU A 81 5.570 0.845 2.486 1.00 0.00 H new ATOM 0 HD11 LEU A 81 5.906 -1.546 2.944 1.00 0.00 H new ATOM 0 HD12 LEU A 81 4.644 -1.262 1.721 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.260 -1.817 1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.779 -0.004 3.192 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.249 -0.168 1.483 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.912 1.442 2.162 1.00 0.00 H new ATOM 92 N ILE A 82 8.041 -1.691 -0.649 1.00 0.00 N ATOM 93 CA ILE A 82 8.172 -3.099 -0.949 1.00 0.00 C ATOM 94 C ILE A 82 7.639 -3.938 0.200 1.00 0.00 C ATOM 95 O ILE A 82 7.805 -3.584 1.368 1.00 0.00 O ATOM 96 CB ILE A 82 9.640 -3.488 -1.213 1.00 0.00 C ATOM 97 CG1 ILE A 82 10.265 -2.566 -2.250 1.00 0.00 C ATOM 98 CG2 ILE A 82 9.723 -4.922 -1.674 1.00 0.00 C ATOM 99 CD1 ILE A 82 11.678 -2.951 -2.636 1.00 0.00 C ATOM 0 H ILE A 82 8.813 -1.295 -0.113 1.00 0.00 H new ATOM 0 HA ILE A 82 7.591 -3.292 -1.851 1.00 0.00 H new ATOM 0 HB ILE A 82 10.196 -3.382 -0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 82 9.642 -2.564 -3.144 1.00 0.00 H new ATOM 0 HG13 ILE A 82 10.269 -1.547 -1.862 1.00 0.00 H new ATOM 0 HG21 ILE A 82 10.765 -5.186 -1.857 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.313 -5.576 -0.904 1.00 0.00 H new ATOM 0 HG23 ILE A 82 9.151 -5.042 -2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.057 -2.248 -3.378 1.00 0.00 H new ATOM 0 HD12 ILE A 82 12.316 -2.925 -1.753 1.00 0.00 H new ATOM 0 HD13 ILE A 82 11.679 -3.957 -3.055 1.00 0.00 H new ATOM 111 N VAL A 83 7.023 -5.052 -0.131 1.00 0.00 N ATOM 112 CA VAL A 83 6.464 -5.945 0.857 1.00 0.00 C ATOM 113 C VAL A 83 6.831 -7.377 0.526 1.00 0.00 C ATOM 114 O VAL A 83 7.287 -7.672 -0.578 1.00 0.00 O ATOM 115 CB VAL A 83 4.920 -5.831 0.957 1.00 0.00 C ATOM 116 CG1 VAL A 83 4.502 -4.464 1.459 1.00 0.00 C ATOM 117 CG2 VAL A 83 4.263 -6.131 -0.382 1.00 0.00 C ATOM 0 H VAL A 83 6.896 -5.363 -1.094 1.00 0.00 H new ATOM 0 HA VAL A 83 6.884 -5.654 1.820 1.00 0.00 H new ATOM 0 HB VAL A 83 4.582 -6.574 1.679 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.415 -4.415 1.518 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.927 -4.294 2.448 1.00 0.00 H new ATOM 0 HG13 VAL A 83 4.863 -3.698 0.772 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.181 -6.044 -0.284 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.618 -5.421 -1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.519 -7.144 -0.694 1.00 0.00 H new ATOM 127 N HIS A 84 6.644 -8.253 1.479 1.00 0.00 N ATOM 128 CA HIS A 84 6.943 -9.662 1.292 1.00 0.00 C ATOM 129 C HIS A 84 5.665 -10.465 1.369 1.00 0.00 C ATOM 130 O HIS A 84 4.955 -10.407 2.376 1.00 0.00 O ATOM 131 CB HIS A 84 7.938 -10.156 2.350 1.00 0.00 C ATOM 132 CG HIS A 84 9.252 -9.436 2.339 1.00 0.00 C ATOM 133 ND1 HIS A 84 10.341 -9.852 1.605 1.00 0.00 N ATOM 134 CD2 HIS A 84 9.649 -8.314 2.982 1.00 0.00 C ATOM 135 CE1 HIS A 84 11.346 -9.022 1.798 1.00 0.00 C ATOM 136 NE2 HIS A 84 10.951 -8.080 2.629 1.00 0.00 N ATOM 0 H HIS A 84 6.283 -8.019 2.404 1.00 0.00 H new ATOM 0 HA HIS A 84 7.398 -9.794 0.310 1.00 0.00 H new ATOM 0 HB2 HIS A 84 7.486 -10.049 3.336 1.00 0.00 H new ATOM 0 HB3 HIS A 84 8.118 -11.220 2.195 1.00 0.00 H new ATOM 0 HD2 HIS A 84 9.050 -7.714 3.650 1.00 0.00 H new ATOM 0 HE1 HIS A 84 12.326 -9.101 1.351 1.00 0.00 H new ATOM 0 HE2 HIS A 84 11.523 -7.302 2.957 1.00 0.00 H new ATOM 145 N GLU A 85 5.357 -11.199 0.318 1.00 0.00 N ATOM 146 CA GLU A 85 4.141 -11.982 0.295 1.00 0.00 C ATOM 147 C GLU A 85 4.343 -13.280 -0.470 1.00 0.00 C ATOM 148 O GLU A 85 4.621 -13.264 -1.669 1.00 0.00 O ATOM 149 CB GLU A 85 2.997 -11.181 -0.327 1.00 0.00 C ATOM 150 CG GLU A 85 1.644 -11.529 0.240 1.00 0.00 C ATOM 151 CD GLU A 85 1.544 -11.180 1.702 1.00 0.00 C ATOM 152 OE1 GLU A 85 1.236 -10.018 2.011 1.00 0.00 O ATOM 153 OE2 GLU A 85 1.771 -12.063 2.554 1.00 0.00 O ATOM 0 H GLU A 85 5.928 -11.269 -0.524 1.00 0.00 H new ATOM 0 HA GLU A 85 3.881 -12.226 1.325 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.184 -10.118 -0.175 1.00 0.00 H new ATOM 0 HB3 GLU A 85 2.987 -11.353 -1.403 1.00 0.00 H new ATOM 0 HG2 GLU A 85 0.870 -10.998 -0.314 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.457 -12.595 0.107 1.00 0.00 H new ATOM 160 N GLY A 86 4.232 -14.396 0.235 1.00 0.00 N ATOM 161 CA GLY A 86 4.352 -15.705 -0.391 1.00 0.00 C ATOM 162 C GLY A 86 5.713 -15.950 -1.018 1.00 0.00 C ATOM 163 O GLY A 86 5.825 -16.680 -2.008 1.00 0.00 O ATOM 0 H GLY A 86 4.059 -14.422 1.240 1.00 0.00 H new ATOM 0 HA2 GLY A 86 4.160 -16.476 0.355 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.584 -15.805 -1.158 1.00 0.00 H new ATOM 167 N GLY A 87 6.743 -15.334 -0.456 1.00 0.00 N ATOM 168 CA GLY A 87 8.087 -15.520 -0.970 1.00 0.00 C ATOM 169 C GLY A 87 8.437 -14.512 -2.047 1.00 0.00 C ATOM 170 O GLY A 87 9.570 -14.459 -2.515 1.00 0.00 O ATOM 0 H GLY A 87 6.673 -14.709 0.347 1.00 0.00 H new ATOM 0 HA2 GLY A 87 8.801 -15.436 -0.151 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.183 -16.528 -1.374 1.00 0.00 H new ATOM 174 N LYS A 88 7.465 -13.719 -2.438 1.00 0.00 N ATOM 175 CA LYS A 88 7.667 -12.709 -3.459 1.00 0.00 C ATOM 176 C LYS A 88 7.811 -11.334 -2.832 1.00 0.00 C ATOM 177 O LYS A 88 7.290 -11.083 -1.738 1.00 0.00 O ATOM 178 CB LYS A 88 6.489 -12.701 -4.425 1.00 0.00 C ATOM 179 CG LYS A 88 6.332 -13.964 -5.243 1.00 0.00 C ATOM 180 CD LYS A 88 7.346 -14.025 -6.365 1.00 0.00 C ATOM 181 CE LYS A 88 7.081 -15.208 -7.273 1.00 0.00 C ATOM 182 NZ LYS A 88 7.854 -15.113 -8.534 1.00 0.00 N ATOM 0 H LYS A 88 6.517 -13.753 -2.062 1.00 0.00 H new ATOM 0 HA LYS A 88 8.582 -12.949 -4.000 1.00 0.00 H new ATOM 0 HB2 LYS A 88 5.573 -12.536 -3.858 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.600 -11.856 -5.105 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.449 -14.834 -4.597 1.00 0.00 H new ATOM 0 HG3 LYS A 88 5.325 -14.008 -5.658 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.309 -13.102 -6.944 1.00 0.00 H new ATOM 0 HD3 LYS A 88 8.350 -14.100 -5.948 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.342 -16.131 -6.755 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.016 -15.261 -7.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.648 -15.939 -9.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.587 -14.245 -9.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 8.871 -15.088 -8.317 1.00 0.00 H new ATOM 196 N THR A 89 8.512 -10.456 -3.511 1.00 0.00 N ATOM 197 CA THR A 89 8.670 -9.097 -3.055 1.00 0.00 C ATOM 198 C THR A 89 7.823 -8.187 -3.934 1.00 0.00 C ATOM 199 O THR A 89 8.157 -7.943 -5.094 1.00 0.00 O ATOM 200 CB THR A 89 10.145 -8.660 -3.139 1.00 0.00 C ATOM 201 OG1 THR A 89 10.966 -9.791 -3.475 1.00 0.00 O ATOM 202 CG2 THR A 89 10.611 -8.086 -1.815 1.00 0.00 C ATOM 0 H THR A 89 8.986 -10.663 -4.390 1.00 0.00 H new ATOM 0 HA THR A 89 8.350 -9.030 -2.015 1.00 0.00 H new ATOM 0 HB THR A 89 10.232 -7.893 -3.908 1.00 0.00 H new ATOM 0 HG1 THR A 89 11.903 -9.510 -3.530 1.00 0.00 H new ATOM 0 HG21 THR A 89 11.655 -7.784 -1.897 1.00 0.00 H new ATOM 0 HG22 THR A 89 10.001 -7.219 -1.559 1.00 0.00 H new ATOM 0 HG23 THR A 89 10.512 -8.842 -1.036 1.00 0.00 H new ATOM 210 N TYR A 90 6.730 -7.703 -3.392 1.00 0.00 N ATOM 211 CA TYR A 90 5.814 -6.878 -4.152 1.00 0.00 C ATOM 212 C TYR A 90 6.050 -5.412 -3.884 1.00 0.00 C ATOM 213 O TYR A 90 6.421 -5.024 -2.783 1.00 0.00 O ATOM 214 CB TYR A 90 4.358 -7.233 -3.828 1.00 0.00 C ATOM 215 CG TYR A 90 3.944 -8.618 -4.268 1.00 0.00 C ATOM 216 CD1 TYR A 90 4.107 -9.713 -3.433 1.00 0.00 C ATOM 217 CD2 TYR A 90 3.384 -8.828 -5.520 1.00 0.00 C ATOM 218 CE1 TYR A 90 3.727 -10.979 -3.834 1.00 0.00 C ATOM 219 CE2 TYR A 90 3.000 -10.090 -5.926 1.00 0.00 C ATOM 220 CZ TYR A 90 3.176 -11.161 -5.080 1.00 0.00 C ATOM 221 OH TYR A 90 2.798 -12.424 -5.487 1.00 0.00 O ATOM 0 H TYR A 90 6.451 -7.866 -2.425 1.00 0.00 H new ATOM 0 HA TYR A 90 6.000 -7.075 -5.208 1.00 0.00 H new ATOM 0 HB2 TYR A 90 4.205 -7.145 -2.752 1.00 0.00 H new ATOM 0 HB3 TYR A 90 3.704 -6.502 -4.303 1.00 0.00 H new ATOM 0 HD1 TYR A 90 4.538 -9.574 -2.453 1.00 0.00 H new ATOM 0 HD2 TYR A 90 3.246 -7.990 -6.188 1.00 0.00 H new ATOM 0 HE1 TYR A 90 3.862 -11.821 -3.172 1.00 0.00 H new ATOM 0 HE2 TYR A 90 2.563 -10.236 -6.903 1.00 0.00 H new ATOM 0 HH TYR A 90 2.426 -12.378 -6.392 1.00 0.00 H new ATOM 231 N HIS A 91 5.852 -4.611 -4.898 1.00 0.00 N ATOM 232 CA HIS A 91 5.977 -3.179 -4.779 1.00 0.00 C ATOM 233 C HIS A 91 4.600 -2.568 -4.683 1.00 0.00 C ATOM 234 O HIS A 91 3.700 -2.930 -5.443 1.00 0.00 O ATOM 235 CB HIS A 91 6.713 -2.589 -5.987 1.00 0.00 C ATOM 236 CG HIS A 91 8.161 -2.955 -6.068 1.00 0.00 C ATOM 237 ND1 HIS A 91 9.179 -2.033 -5.946 1.00 0.00 N ATOM 238 CD2 HIS A 91 8.764 -4.149 -6.284 1.00 0.00 C ATOM 239 CE1 HIS A 91 10.340 -2.641 -6.086 1.00 0.00 C ATOM 240 NE2 HIS A 91 10.115 -3.922 -6.290 1.00 0.00 N ATOM 0 H HIS A 91 5.599 -4.932 -5.832 1.00 0.00 H new ATOM 0 HA HIS A 91 6.554 -2.953 -3.882 1.00 0.00 H new ATOM 0 HB2 HIS A 91 6.215 -2.921 -6.898 1.00 0.00 H new ATOM 0 HB3 HIS A 91 6.627 -1.503 -5.955 1.00 0.00 H new ATOM 0 HD1 HIS A 91 9.053 -1.035 -5.774 1.00 0.00 H new ATOM 0 HD2 HIS A 91 8.272 -5.100 -6.425 1.00 0.00 H new ATOM 0 HE1 HIS A 91 11.310 -2.169 -6.041 1.00 0.00 H new ATOM 249 N VAL A 92 4.428 -1.655 -3.765 1.00 0.00 N ATOM 250 CA VAL A 92 3.167 -0.991 -3.592 1.00 0.00 C ATOM 251 C VAL A 92 3.330 0.461 -3.962 1.00 0.00 C ATOM 252 O VAL A 92 4.125 1.185 -3.355 1.00 0.00 O ATOM 253 CB VAL A 92 2.646 -1.093 -2.140 1.00 0.00 C ATOM 254 CG1 VAL A 92 1.271 -0.449 -2.015 1.00 0.00 C ATOM 255 CG2 VAL A 92 2.604 -2.544 -1.681 1.00 0.00 C ATOM 0 H VAL A 92 5.157 -1.352 -3.119 1.00 0.00 H new ATOM 0 HA VAL A 92 2.437 -1.480 -4.237 1.00 0.00 H new ATOM 0 HB VAL A 92 3.337 -0.552 -1.493 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.923 -0.532 -0.985 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.335 0.603 -2.293 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.570 -0.957 -2.677 1.00 0.00 H new ATOM 0 HG21 VAL A 92 2.234 -2.591 -0.657 1.00 0.00 H new ATOM 0 HG22 VAL A 92 1.941 -3.113 -2.333 1.00 0.00 H new ATOM 0 HG23 VAL A 92 3.607 -2.969 -1.725 1.00 0.00 H new ATOM 265 N VAL A 93 2.603 0.876 -4.958 1.00 0.00 N ATOM 266 CA VAL A 93 2.666 2.234 -5.439 1.00 0.00 C ATOM 267 C VAL A 93 1.310 2.882 -5.299 1.00 0.00 C ATOM 268 O VAL A 93 0.291 2.302 -5.687 1.00 0.00 O ATOM 269 CB VAL A 93 3.116 2.290 -6.925 1.00 0.00 C ATOM 270 CG1 VAL A 93 3.132 3.726 -7.441 1.00 0.00 C ATOM 271 CG2 VAL A 93 4.488 1.651 -7.092 1.00 0.00 C ATOM 0 H VAL A 93 1.946 0.283 -5.465 1.00 0.00 H new ATOM 0 HA VAL A 93 3.402 2.771 -4.841 1.00 0.00 H new ATOM 0 HB VAL A 93 2.394 1.726 -7.516 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.451 3.735 -8.483 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.131 4.151 -7.364 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.825 4.319 -6.845 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.787 1.699 -8.139 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.215 2.186 -6.482 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.445 0.609 -6.775 1.00 0.00 H new ATOM 281 N CYS A 94 1.287 4.066 -4.744 1.00 0.00 N ATOM 282 CA CYS A 94 0.051 4.772 -4.552 1.00 0.00 C ATOM 283 C CYS A 94 0.036 6.028 -5.399 1.00 0.00 C ATOM 284 O CYS A 94 0.825 6.949 -5.182 1.00 0.00 O ATOM 285 CB CYS A 94 -0.147 5.103 -3.076 1.00 0.00 C ATOM 286 SG CYS A 94 -0.252 3.637 -2.003 1.00 0.00 S ATOM 0 H CYS A 94 2.116 4.562 -4.416 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.776 4.136 -4.867 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.679 5.730 -2.740 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -1.059 5.690 -2.964 1.00 0.00 H new ATOM 291 N HIS A 95 -0.845 6.049 -6.384 1.00 0.00 N ATOM 292 CA HIS A 95 -0.951 7.181 -7.293 1.00 0.00 C ATOM 293 C HIS A 95 -2.002 8.171 -6.805 1.00 0.00 C ATOM 294 O HIS A 95 -2.018 9.327 -7.221 1.00 0.00 O ATOM 295 CB HIS A 95 -1.296 6.688 -8.711 1.00 0.00 C ATOM 296 CG HIS A 95 -1.354 7.777 -9.748 1.00 0.00 C ATOM 297 ND1 HIS A 95 -0.245 8.237 -10.421 1.00 0.00 N ATOM 298 CD2 HIS A 95 -2.399 8.497 -10.219 1.00 0.00 C ATOM 299 CE1 HIS A 95 -0.605 9.192 -11.254 1.00 0.00 C ATOM 300 NE2 HIS A 95 -1.906 9.369 -11.153 1.00 0.00 N ATOM 0 H HIS A 95 -1.501 5.292 -6.577 1.00 0.00 H new ATOM 0 HA HIS A 95 0.011 7.694 -7.321 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -0.554 5.950 -9.017 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -2.259 6.179 -8.682 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -3.431 8.401 -9.915 1.00 0.00 H new ATOM 0 HE1 HIS A 95 0.056 9.738 -11.910 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -2.456 10.045 -11.683 1.00 0.00 H new ATOM 309 N GLU A 96 -2.859 7.725 -5.917 1.00 0.00 N ATOM 310 CA GLU A 96 -3.926 8.561 -5.413 1.00 0.00 C ATOM 311 C GLU A 96 -4.208 8.257 -3.959 1.00 0.00 C ATOM 312 O GLU A 96 -3.855 7.186 -3.460 1.00 0.00 O ATOM 313 CB GLU A 96 -5.187 8.375 -6.255 1.00 0.00 C ATOM 314 CG GLU A 96 -5.603 6.926 -6.435 1.00 0.00 C ATOM 315 CD GLU A 96 -6.796 6.785 -7.343 1.00 0.00 C ATOM 316 OE1 GLU A 96 -6.681 7.129 -8.533 1.00 0.00 O ATOM 317 OE2 GLU A 96 -7.855 6.331 -6.875 1.00 0.00 O ATOM 0 H GLU A 96 -2.839 6.783 -5.526 1.00 0.00 H new ATOM 0 HA GLU A 96 -3.609 9.602 -5.485 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -6.006 8.922 -5.789 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -5.025 8.820 -7.237 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -4.768 6.358 -6.845 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -5.836 6.493 -5.462 1.00 0.00 H new ATOM 324 N GLU A 97 -4.819 9.208 -3.278 1.00 0.00 N ATOM 325 CA GLU A 97 -5.162 9.046 -1.881 1.00 0.00 C ATOM 326 C GLU A 97 -6.349 8.108 -1.730 1.00 0.00 C ATOM 327 O GLU A 97 -7.374 8.275 -2.394 1.00 0.00 O ATOM 328 CB GLU A 97 -5.480 10.402 -1.251 1.00 0.00 C ATOM 329 CG GLU A 97 -4.323 11.386 -1.299 1.00 0.00 C ATOM 330 CD GLU A 97 -4.684 12.733 -0.716 1.00 0.00 C ATOM 331 OE1 GLU A 97 -4.532 12.917 0.508 1.00 0.00 O ATOM 332 OE2 GLU A 97 -5.128 13.617 -1.482 1.00 0.00 O ATOM 0 H GLU A 97 -5.089 10.108 -3.675 1.00 0.00 H new ATOM 0 HA GLU A 97 -4.306 8.611 -1.365 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -6.337 10.838 -1.763 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -5.773 10.250 -0.212 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -3.476 10.972 -0.752 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -4.003 11.515 -2.333 1.00 0.00 H new ATOM 339 N GLY A 98 -6.204 7.132 -0.864 1.00 0.00 N ATOM 340 CA GLY A 98 -7.261 6.179 -0.643 1.00 0.00 C ATOM 341 C GLY A 98 -6.743 4.765 -0.549 1.00 0.00 C ATOM 342 O GLY A 98 -5.638 4.477 -1.001 1.00 0.00 O ATOM 0 H GLY A 98 -5.366 6.979 -0.303 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.790 6.432 0.276 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.984 6.246 -1.456 1.00 0.00 H new ATOM 346 N PRO A 99 -7.509 3.865 0.065 1.00 0.00 N ATOM 347 CA PRO A 99 -7.129 2.459 0.196 1.00 0.00 C ATOM 348 C PRO A 99 -7.353 1.654 -1.094 1.00 0.00 C ATOM 349 O PRO A 99 -8.352 1.834 -1.789 1.00 0.00 O ATOM 350 CB PRO A 99 -8.056 1.959 1.300 1.00 0.00 C ATOM 351 CG PRO A 99 -9.276 2.799 1.171 1.00 0.00 C ATOM 352 CD PRO A 99 -8.802 4.151 0.722 1.00 0.00 C ATOM 0 HA PRO A 99 -6.067 2.344 0.411 1.00 0.00 H new ATOM 0 HB2 PRO A 99 -8.287 0.901 1.175 1.00 0.00 H new ATOM 0 HB3 PRO A 99 -7.599 2.071 2.283 1.00 0.00 H new ATOM 0 HG2 PRO A 99 -9.971 2.370 0.449 1.00 0.00 H new ATOM 0 HG3 PRO A 99 -9.805 2.867 2.121 1.00 0.00 H new ATOM 0 HD2 PRO A 99 -9.508 4.615 0.033 1.00 0.00 H new ATOM 0 HD3 PRO A 99 -8.682 4.834 1.563 1.00 0.00 H new ATOM 360 N ILE A 100 -6.416 0.773 -1.392 1.00 0.00 N ATOM 361 CA ILE A 100 -6.496 -0.105 -2.561 1.00 0.00 C ATOM 362 C ILE A 100 -6.038 -1.514 -2.180 1.00 0.00 C ATOM 363 O ILE A 100 -5.332 -1.673 -1.198 1.00 0.00 O ATOM 364 CB ILE A 100 -5.660 0.436 -3.770 1.00 0.00 C ATOM 365 CG1 ILE A 100 -4.352 1.120 -3.307 1.00 0.00 C ATOM 366 CG2 ILE A 100 -6.499 1.388 -4.619 1.00 0.00 C ATOM 367 CD1 ILE A 100 -3.294 0.171 -2.780 1.00 0.00 C ATOM 0 H ILE A 100 -5.573 0.640 -0.833 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.537 -0.133 -2.884 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.377 -0.420 -4.382 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -3.934 1.680 -4.144 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -4.592 1.844 -2.528 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.901 1.754 -5.454 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.373 0.860 -5.002 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.823 2.231 -4.008 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -2.413 0.739 -2.479 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.687 -0.371 -1.920 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.019 -0.538 -3.561 1.00 0.00 H new ATOM 379 N PRO A 101 -6.445 -2.558 -2.933 1.00 0.00 N ATOM 380 CA PRO A 101 -6.079 -3.949 -2.617 1.00 0.00 C ATOM 381 C PRO A 101 -4.568 -4.200 -2.669 1.00 0.00 C ATOM 382 O PRO A 101 -3.805 -3.406 -3.227 1.00 0.00 O ATOM 383 CB PRO A 101 -6.789 -4.766 -3.703 1.00 0.00 C ATOM 384 CG PRO A 101 -7.028 -3.797 -4.805 1.00 0.00 C ATOM 385 CD PRO A 101 -7.289 -2.483 -4.134 1.00 0.00 C ATOM 0 HA PRO A 101 -6.371 -4.212 -1.600 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -6.174 -5.602 -4.036 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -7.725 -5.186 -3.335 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -6.164 -3.735 -5.467 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -7.877 -4.101 -5.417 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -7.013 -1.642 -4.770 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -8.342 -2.360 -3.881 1.00 0.00 H new ATOM 393 N HIS A 102 -4.155 -5.317 -2.101 1.00 0.00 N ATOM 394 CA HIS A 102 -2.759 -5.696 -2.045 1.00 0.00 C ATOM 395 C HIS A 102 -2.402 -6.513 -3.288 1.00 0.00 C ATOM 396 O HIS A 102 -2.975 -7.569 -3.515 1.00 0.00 O ATOM 397 CB HIS A 102 -2.513 -6.520 -0.766 1.00 0.00 C ATOM 398 CG HIS A 102 -1.075 -6.770 -0.433 1.00 0.00 C ATOM 399 ND1 HIS A 102 -0.461 -7.983 -0.625 1.00 0.00 N ATOM 400 CD2 HIS A 102 -0.142 -5.966 0.114 1.00 0.00 C ATOM 401 CE1 HIS A 102 0.788 -7.914 -0.218 1.00 0.00 C ATOM 402 NE2 HIS A 102 1.012 -6.700 0.238 1.00 0.00 N ATOM 0 H HIS A 102 -4.784 -5.990 -1.663 1.00 0.00 H new ATOM 0 HA HIS A 102 -2.129 -4.807 -2.021 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -2.979 -6.005 0.074 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -3.017 -7.481 -0.870 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -0.905 -8.811 -1.022 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -0.277 -4.934 0.402 1.00 0.00 H new ATOM 0 HE1 HIS A 102 1.508 -8.718 -0.252 1.00 0.00 H new ATOM 411 N PRO A 103 -1.435 -6.033 -4.101 1.00 0.00 N ATOM 412 CA PRO A 103 -1.044 -6.692 -5.370 1.00 0.00 C ATOM 413 C PRO A 103 -0.610 -8.152 -5.189 1.00 0.00 C ATOM 414 O PRO A 103 -0.634 -8.937 -6.131 1.00 0.00 O ATOM 415 CB PRO A 103 0.136 -5.841 -5.876 1.00 0.00 C ATOM 416 CG PRO A 103 0.577 -5.037 -4.696 1.00 0.00 C ATOM 417 CD PRO A 103 -0.650 -4.811 -3.866 1.00 0.00 C ATOM 0 HA PRO A 103 -1.885 -6.740 -6.062 1.00 0.00 H new ATOM 0 HB2 PRO A 103 0.945 -6.471 -6.247 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -0.169 -5.196 -6.700 1.00 0.00 H new ATOM 0 HG2 PRO A 103 1.341 -5.567 -4.127 1.00 0.00 H new ATOM 0 HG3 PRO A 103 1.014 -4.090 -5.011 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -0.406 -4.684 -2.811 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -1.190 -3.917 -4.178 1.00 0.00 H new ATOM 425 N GLY A 104 -0.207 -8.501 -3.983 1.00 0.00 N ATOM 426 CA GLY A 104 0.221 -9.858 -3.719 1.00 0.00 C ATOM 427 C GLY A 104 -0.913 -10.773 -3.288 1.00 0.00 C ATOM 428 O GLY A 104 -0.797 -11.991 -3.399 1.00 0.00 O ATOM 0 H GLY A 104 -0.167 -7.872 -3.181 1.00 0.00 H new ATOM 0 HA2 GLY A 104 0.687 -10.266 -4.616 1.00 0.00 H new ATOM 0 HA3 GLY A 104 0.984 -9.846 -2.941 1.00 0.00 H new ATOM 432 N ASN A 105 -2.010 -10.187 -2.802 1.00 0.00 N ATOM 433 CA ASN A 105 -3.174 -10.949 -2.331 1.00 0.00 C ATOM 434 C ASN A 105 -4.366 -10.009 -2.088 1.00 0.00 C ATOM 435 O ASN A 105 -4.337 -9.189 -1.172 1.00 0.00 O ATOM 436 CB ASN A 105 -2.879 -11.830 -1.080 1.00 0.00 C ATOM 437 CG ASN A 105 -2.147 -11.128 0.054 1.00 0.00 C ATOM 438 OD1 ASN A 105 -2.144 -9.908 0.162 1.00 0.00 O ATOM 439 ND2 ASN A 105 -1.540 -11.912 0.923 1.00 0.00 N ATOM 0 H ASN A 105 -2.118 -9.176 -2.723 1.00 0.00 H new ATOM 0 HA ASN A 105 -3.430 -11.650 -3.125 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -3.824 -12.215 -0.697 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -2.288 -12.691 -1.394 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -1.046 -11.506 1.718 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -1.564 -12.924 0.800 1.00 0.00 H new ATOM 446 N VAL A 106 -5.392 -10.097 -2.931 1.00 0.00 N ATOM 447 CA VAL A 106 -6.590 -9.237 -2.800 1.00 0.00 C ATOM 448 C VAL A 106 -7.293 -9.350 -1.428 1.00 0.00 C ATOM 449 O VAL A 106 -8.171 -8.544 -1.114 1.00 0.00 O ATOM 450 CB VAL A 106 -7.615 -9.486 -3.932 1.00 0.00 C ATOM 451 CG1 VAL A 106 -7.007 -9.163 -5.288 1.00 0.00 C ATOM 452 CG2 VAL A 106 -8.126 -10.917 -3.901 1.00 0.00 C ATOM 0 H VAL A 106 -5.428 -10.750 -3.714 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.206 -8.220 -2.884 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.464 -8.822 -3.769 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -7.744 -9.345 -6.070 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -6.704 -8.116 -5.311 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -6.136 -9.796 -5.456 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -8.845 -11.064 -4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -7.290 -11.605 -4.030 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.610 -11.110 -2.944 1.00 0.00 H new ATOM 462 N HIS A 107 -6.911 -10.344 -0.622 1.00 0.00 N ATOM 463 CA HIS A 107 -7.482 -10.506 0.728 1.00 0.00 C ATOM 464 C HIS A 107 -6.888 -9.484 1.711 1.00 0.00 C ATOM 465 O HIS A 107 -7.196 -9.494 2.905 1.00 0.00 O ATOM 466 CB HIS A 107 -7.257 -11.931 1.259 1.00 0.00 C ATOM 467 CG HIS A 107 -8.021 -12.994 0.525 1.00 0.00 C ATOM 468 ND1 HIS A 107 -7.567 -14.285 0.390 1.00 0.00 N ATOM 469 CD2 HIS A 107 -9.219 -12.953 -0.103 1.00 0.00 C ATOM 470 CE1 HIS A 107 -8.450 -14.991 -0.287 1.00 0.00 C ATOM 471 NE2 HIS A 107 -9.461 -14.208 -0.599 1.00 0.00 N ATOM 0 H HIS A 107 -6.215 -11.046 -0.873 1.00 0.00 H new ATOM 0 HA HIS A 107 -8.554 -10.328 0.647 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -6.193 -12.162 1.205 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -7.536 -11.962 2.312 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -9.864 -12.092 -0.196 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -8.359 -16.036 -0.543 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -10.289 -14.489 -1.124 1.00 0.00 H new ATOM 480 N LYS A 108 -6.050 -8.604 1.193 1.00 0.00 N ATOM 481 CA LYS A 108 -5.424 -7.554 1.978 1.00 0.00 C ATOM 482 C LYS A 108 -5.419 -6.279 1.176 1.00 0.00 C ATOM 483 O LYS A 108 -5.583 -6.316 -0.044 1.00 0.00 O ATOM 484 CB LYS A 108 -3.991 -7.927 2.382 1.00 0.00 C ATOM 485 CG LYS A 108 -3.912 -9.119 3.317 1.00 0.00 C ATOM 486 CD LYS A 108 -2.653 -9.092 4.165 1.00 0.00 C ATOM 487 CE LYS A 108 -1.404 -9.228 3.324 1.00 0.00 C ATOM 488 NZ LYS A 108 -0.215 -9.553 4.149 1.00 0.00 N ATOM 0 H LYS A 108 -5.782 -8.597 0.209 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.997 -7.419 2.895 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -3.414 -8.143 1.483 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -3.523 -7.068 2.863 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -4.787 -9.129 3.967 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -3.937 -10.040 2.734 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -2.613 -8.158 4.726 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -2.689 -9.901 4.895 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -1.552 -10.008 2.577 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.227 -8.298 2.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.627 -9.604 3.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -0.078 -8.813 4.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.359 -10.470 4.619 1.00 0.00 H new ATOM 502 N TYR A 109 -5.253 -5.157 1.838 1.00 0.00 N ATOM 503 CA TYR A 109 -5.238 -3.889 1.146 1.00 0.00 C ATOM 504 C TYR A 109 -4.243 -2.928 1.778 1.00 0.00 C ATOM 505 O TYR A 109 -3.681 -3.211 2.826 1.00 0.00 O ATOM 506 CB TYR A 109 -6.644 -3.284 1.085 1.00 0.00 C ATOM 507 CG TYR A 109 -7.147 -2.685 2.374 1.00 0.00 C ATOM 508 CD1 TYR A 109 -7.472 -3.477 3.468 1.00 0.00 C ATOM 509 CD2 TYR A 109 -7.315 -1.319 2.485 1.00 0.00 C ATOM 510 CE1 TYR A 109 -7.948 -2.916 4.637 1.00 0.00 C ATOM 511 CE2 TYR A 109 -7.787 -0.746 3.644 1.00 0.00 C ATOM 512 CZ TYR A 109 -8.102 -1.550 4.719 1.00 0.00 C ATOM 513 OH TYR A 109 -8.579 -0.986 5.879 1.00 0.00 O ATOM 0 H TYR A 109 -5.127 -5.096 2.848 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.910 -4.068 0.122 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -6.656 -2.511 0.316 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -7.341 -4.059 0.768 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.351 -4.548 3.403 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -7.071 -0.687 1.644 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -8.197 -3.544 5.480 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -7.910 0.325 3.711 1.00 0.00 H new ATOM 0 HH TYR A 109 -8.627 -0.013 5.774 1.00 0.00 H new ATOM 523 N ILE A 110 -4.030 -1.800 1.139 1.00 0.00 N ATOM 524 CA ILE A 110 -3.130 -0.788 1.647 1.00 0.00 C ATOM 525 C ILE A 110 -3.834 0.557 1.655 1.00 0.00 C ATOM 526 O ILE A 110 -4.592 0.870 0.740 1.00 0.00 O ATOM 527 CB ILE A 110 -1.821 -0.651 0.799 1.00 0.00 C ATOM 528 CG1 ILE A 110 -1.168 -2.010 0.534 1.00 0.00 C ATOM 529 CG2 ILE A 110 -0.830 0.269 1.489 1.00 0.00 C ATOM 530 CD1 ILE A 110 -1.661 -2.686 -0.723 1.00 0.00 C ATOM 0 H ILE A 110 -4.475 -1.558 0.254 1.00 0.00 H new ATOM 0 HA ILE A 110 -2.847 -1.098 2.653 1.00 0.00 H new ATOM 0 HB ILE A 110 -2.105 -0.220 -0.161 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -0.088 -1.877 0.465 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -1.355 -2.665 1.385 1.00 0.00 H new ATOM 0 HG21 ILE A 110 0.073 0.351 0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -1.275 1.256 1.612 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -0.575 -0.139 2.467 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -1.154 -3.643 -0.844 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -2.736 -2.852 -0.649 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -1.450 -2.052 -1.584 1.00 0.00 H new ATOM 542 N ILE A 111 -3.601 1.336 2.687 1.00 0.00 N ATOM 543 CA ILE A 111 -4.162 2.663 2.770 1.00 0.00 C ATOM 544 C ILE A 111 -3.125 3.649 2.282 1.00 0.00 C ATOM 545 O ILE A 111 -2.013 3.702 2.821 1.00 0.00 O ATOM 546 CB ILE A 111 -4.596 3.051 4.218 1.00 0.00 C ATOM 547 CG1 ILE A 111 -5.681 2.105 4.748 1.00 0.00 C ATOM 548 CG2 ILE A 111 -5.093 4.491 4.260 1.00 0.00 C ATOM 549 CD1 ILE A 111 -5.152 0.799 5.297 1.00 0.00 C ATOM 0 H ILE A 111 -3.023 1.070 3.484 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.060 2.684 2.153 1.00 0.00 H new ATOM 0 HB ILE A 111 -3.721 2.959 4.861 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.241 2.615 5.532 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -6.384 1.890 3.943 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.391 4.743 5.278 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -4.295 5.161 3.939 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -5.949 4.600 3.594 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -5.984 0.189 5.650 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -4.618 0.264 4.512 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -4.473 1.001 6.125 1.00 0.00 H new ATOM 561 N CYS A 112 -3.468 4.413 1.269 1.00 0.00 N ATOM 562 CA CYS A 112 -2.542 5.367 0.700 1.00 0.00 C ATOM 563 C CYS A 112 -2.926 6.779 1.105 1.00 0.00 C ATOM 564 O CYS A 112 -4.064 7.201 0.907 1.00 0.00 O ATOM 565 CB CYS A 112 -2.537 5.251 -0.821 1.00 0.00 C ATOM 566 SG CYS A 112 -2.199 3.571 -1.443 1.00 0.00 S ATOM 0 H CYS A 112 -4.384 4.392 0.821 1.00 0.00 H new ATOM 0 HA CYS A 112 -1.543 5.149 1.078 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -3.504 5.579 -1.202 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -1.788 5.933 -1.223 1.00 0.00 H new ATOM 571 N SER A 113 -1.995 7.493 1.689 1.00 0.00 N ATOM 572 CA SER A 113 -2.237 8.858 2.101 1.00 0.00 C ATOM 573 C SER A 113 -1.118 9.761 1.612 1.00 0.00 C ATOM 574 O SER A 113 0.046 9.382 1.636 1.00 0.00 O ATOM 575 CB SER A 113 -2.350 8.931 3.620 1.00 0.00 C ATOM 576 OG SER A 113 -3.329 8.017 4.099 1.00 0.00 O ATOM 0 H SER A 113 -1.056 7.150 1.892 1.00 0.00 H new ATOM 0 HA SER A 113 -3.174 9.198 1.661 1.00 0.00 H new ATOM 0 HB2 SER A 113 -1.384 8.706 4.072 1.00 0.00 H new ATOM 0 HB3 SER A 113 -2.614 9.945 3.921 1.00 0.00 H new ATOM 0 HG SER A 113 -3.384 8.079 5.075 1.00 0.00 H new ATOM 582 N LYS A 114 -1.471 10.938 1.159 1.00 0.00 N ATOM 583 CA LYS A 114 -0.493 11.883 0.679 1.00 0.00 C ATOM 584 C LYS A 114 -0.420 13.076 1.614 1.00 0.00 C ATOM 585 O LYS A 114 -1.301 13.928 1.620 1.00 0.00 O ATOM 586 CB LYS A 114 -0.838 12.339 -0.740 1.00 0.00 C ATOM 587 CG LYS A 114 0.165 13.305 -1.343 1.00 0.00 C ATOM 588 CD LYS A 114 -0.217 13.681 -2.762 1.00 0.00 C ATOM 589 CE LYS A 114 0.777 14.655 -3.363 1.00 0.00 C ATOM 590 NZ LYS A 114 0.456 14.980 -4.773 1.00 0.00 N ATOM 0 H LYS A 114 -2.436 11.267 1.112 1.00 0.00 H new ATOM 0 HA LYS A 114 0.481 11.395 0.655 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -0.913 11.462 -1.383 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.820 12.812 -0.729 1.00 0.00 H new ATOM 0 HG2 LYS A 114 0.222 14.204 -0.729 1.00 0.00 H new ATOM 0 HG3 LYS A 114 1.157 12.853 -1.339 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -0.266 12.783 -3.377 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -1.212 14.125 -2.767 1.00 0.00 H new ATOM 0 HE2 LYS A 114 0.787 15.572 -2.773 1.00 0.00 H new ATOM 0 HE3 LYS A 114 1.779 14.230 -3.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 1.161 15.649 -5.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 0.471 14.110 -5.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -0.490 15.410 -4.824 1.00 0.00 H new ATOM 604 N SER A 115 0.621 13.119 2.406 1.00 0.00 N ATOM 605 CA SER A 115 0.824 14.200 3.338 1.00 0.00 C ATOM 606 C SER A 115 1.664 15.277 2.669 1.00 0.00 C ATOM 607 O SER A 115 2.900 15.251 2.727 1.00 0.00 O ATOM 608 CB SER A 115 1.511 13.680 4.602 1.00 0.00 C ATOM 609 OG SER A 115 1.519 14.650 5.632 1.00 0.00 O ATOM 0 H SER A 115 1.351 12.407 2.423 1.00 0.00 H new ATOM 0 HA SER A 115 -0.136 14.626 3.628 1.00 0.00 H new ATOM 0 HB2 SER A 115 0.999 12.783 4.951 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.535 13.391 4.367 1.00 0.00 H new ATOM 0 HG SER A 115 1.964 14.283 6.424 1.00 0.00 H new ATOM 615 N GLY A 116 0.993 16.193 2.003 1.00 0.00 N ATOM 616 CA GLY A 116 1.686 17.235 1.284 1.00 0.00 C ATOM 617 C GLY A 116 2.393 16.679 0.065 1.00 0.00 C ATOM 618 O GLY A 116 1.767 16.430 -0.957 1.00 0.00 O ATOM 0 H GLY A 116 -0.025 16.236 1.946 1.00 0.00 H new ATOM 0 HA2 GLY A 116 0.976 18.004 0.978 1.00 0.00 H new ATOM 0 HA3 GLY A 116 2.411 17.715 1.942 1.00 0.00 H new ATOM 622 N SER A 117 3.693 16.472 0.175 1.00 0.00 N ATOM 623 CA SER A 117 4.469 15.910 -0.914 1.00 0.00 C ATOM 624 C SER A 117 5.022 14.534 -0.532 1.00 0.00 C ATOM 625 O SER A 117 5.778 13.923 -1.290 1.00 0.00 O ATOM 626 CB SER A 117 5.613 16.852 -1.296 1.00 0.00 C ATOM 627 OG SER A 117 5.116 18.125 -1.684 1.00 0.00 O ATOM 0 H SER A 117 4.235 16.686 1.012 1.00 0.00 H new ATOM 0 HA SER A 117 3.811 15.790 -1.775 1.00 0.00 H new ATOM 0 HB2 SER A 117 6.293 16.965 -0.452 1.00 0.00 H new ATOM 0 HB3 SER A 117 6.189 16.418 -2.113 1.00 0.00 H new ATOM 0 HG SER A 117 5.865 18.710 -1.922 1.00 0.00 H new ATOM 633 N LEU A 118 4.623 14.042 0.635 1.00 0.00 N ATOM 634 CA LEU A 118 5.142 12.781 1.141 1.00 0.00 C ATOM 635 C LEU A 118 4.026 11.753 1.265 1.00 0.00 C ATOM 636 O LEU A 118 2.987 12.026 1.852 1.00 0.00 O ATOM 637 CB LEU A 118 5.810 13.001 2.501 1.00 0.00 C ATOM 638 CG LEU A 118 6.680 11.855 3.011 1.00 0.00 C ATOM 639 CD1 LEU A 118 7.838 11.605 2.058 1.00 0.00 C ATOM 640 CD2 LEU A 118 7.198 12.161 4.407 1.00 0.00 C ATOM 0 H LEU A 118 3.944 14.497 1.245 1.00 0.00 H new ATOM 0 HA LEU A 118 5.882 12.401 0.437 1.00 0.00 H new ATOM 0 HB2 LEU A 118 6.425 13.899 2.441 1.00 0.00 H new ATOM 0 HB3 LEU A 118 5.032 13.196 3.239 1.00 0.00 H new ATOM 0 HG LEU A 118 6.070 10.953 3.060 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.449 10.785 2.435 1.00 0.00 H new ATOM 0 HD12 LEU A 118 7.449 11.345 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 118 8.447 12.506 1.981 1.00 0.00 H new ATOM 0 HD21 LEU A 118 7.816 11.334 4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 118 7.794 13.074 4.382 1.00 0.00 H new ATOM 0 HD23 LEU A 118 6.356 12.296 5.086 1.00 0.00 H new ATOM 652 N TRP A 119 4.246 10.573 0.717 1.00 0.00 N ATOM 653 CA TRP A 119 3.238 9.527 0.755 1.00 0.00 C ATOM 654 C TRP A 119 3.416 8.603 1.952 1.00 0.00 C ATOM 655 O TRP A 119 4.522 8.134 2.232 1.00 0.00 O ATOM 656 CB TRP A 119 3.267 8.707 -0.538 1.00 0.00 C ATOM 657 CG TRP A 119 2.737 9.439 -1.729 1.00 0.00 C ATOM 658 CD1 TRP A 119 3.425 10.278 -2.555 1.00 0.00 C ATOM 659 CD2 TRP A 119 1.399 9.389 -2.230 1.00 0.00 C ATOM 660 NE1 TRP A 119 2.594 10.757 -3.537 1.00 0.00 N ATOM 661 CE2 TRP A 119 1.345 10.224 -3.360 1.00 0.00 C ATOM 662 CE3 TRP A 119 0.240 8.717 -1.832 1.00 0.00 C ATOM 663 CZ2 TRP A 119 0.179 10.405 -4.097 1.00 0.00 C ATOM 664 CZ3 TRP A 119 -0.916 8.900 -2.564 1.00 0.00 C ATOM 665 CH2 TRP A 119 -0.938 9.738 -3.684 1.00 0.00 C ATOM 0 H TRP A 119 5.110 10.314 0.241 1.00 0.00 H new ATOM 0 HA TRP A 119 2.271 10.020 0.853 1.00 0.00 H new ATOM 0 HB2 TRP A 119 4.293 8.400 -0.739 1.00 0.00 H new ATOM 0 HB3 TRP A 119 2.684 7.797 -0.393 1.00 0.00 H new ATOM 0 HD1 TRP A 119 4.470 10.529 -2.452 1.00 0.00 H new ATOM 0 HE1 TRP A 119 2.863 11.404 -4.278 1.00 0.00 H new ATOM 0 HE3 TRP A 119 0.249 8.068 -0.969 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 0.158 11.049 -4.964 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -1.819 8.387 -2.267 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -1.859 9.860 -4.234 1.00 0.00 H new ATOM 676 N TYR A 120 2.325 8.360 2.646 1.00 0.00 N ATOM 677 CA TYR A 120 2.288 7.438 3.764 1.00 0.00 C ATOM 678 C TYR A 120 1.428 6.244 3.404 1.00 0.00 C ATOM 679 O TYR A 120 0.357 6.399 2.809 1.00 0.00 O ATOM 680 CB TYR A 120 1.737 8.124 5.015 1.00 0.00 C ATOM 681 CG TYR A 120 2.683 9.126 5.633 1.00 0.00 C ATOM 682 CD1 TYR A 120 2.868 10.381 5.071 1.00 0.00 C ATOM 683 CD2 TYR A 120 3.391 8.817 6.785 1.00 0.00 C ATOM 684 CE1 TYR A 120 3.730 11.295 5.637 1.00 0.00 C ATOM 685 CE2 TYR A 120 4.257 9.730 7.356 1.00 0.00 C ATOM 686 CZ TYR A 120 4.420 10.965 6.777 1.00 0.00 C ATOM 687 OH TYR A 120 5.278 11.882 7.344 1.00 0.00 O ATOM 0 H TYR A 120 1.427 8.802 2.448 1.00 0.00 H new ATOM 0 HA TYR A 120 3.303 7.105 3.979 1.00 0.00 H new ATOM 0 HB2 TYR A 120 0.805 8.629 4.760 1.00 0.00 H new ATOM 0 HB3 TYR A 120 1.494 7.363 5.757 1.00 0.00 H new ATOM 0 HD1 TYR A 120 2.327 10.646 4.175 1.00 0.00 H new ATOM 0 HD2 TYR A 120 3.263 7.847 7.243 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.862 12.267 5.186 1.00 0.00 H new ATOM 0 HE2 TYR A 120 4.803 9.474 8.252 1.00 0.00 H new ATOM 0 HH TYR A 120 5.688 11.495 8.146 1.00 0.00 H new ATOM 697 N ILE A 121 1.889 5.066 3.756 1.00 0.00 N ATOM 698 CA ILE A 121 1.190 3.844 3.401 1.00 0.00 C ATOM 699 C ILE A 121 1.078 2.876 4.577 1.00 0.00 C ATOM 700 O ILE A 121 1.886 2.906 5.506 1.00 0.00 O ATOM 701 CB ILE A 121 1.868 3.142 2.180 1.00 0.00 C ATOM 702 CG1 ILE A 121 3.409 3.171 2.289 1.00 0.00 C ATOM 703 CG2 ILE A 121 1.424 3.795 0.886 1.00 0.00 C ATOM 704 CD1 ILE A 121 3.984 2.328 3.407 1.00 0.00 C ATOM 0 H ILE A 121 2.747 4.924 4.289 1.00 0.00 H new ATOM 0 HA ILE A 121 0.178 4.134 3.120 1.00 0.00 H new ATOM 0 HB ILE A 121 1.554 2.098 2.182 1.00 0.00 H new ATOM 0 HG12 ILE A 121 3.832 2.832 1.343 1.00 0.00 H new ATOM 0 HG13 ILE A 121 3.730 4.203 2.430 1.00 0.00 H new ATOM 0 HG21 ILE A 121 1.904 3.296 0.044 1.00 0.00 H new ATOM 0 HG22 ILE A 121 0.342 3.711 0.789 1.00 0.00 H new ATOM 0 HG23 ILE A 121 1.707 4.848 0.894 1.00 0.00 H new ATOM 0 HD11 ILE A 121 5.071 2.412 3.404 1.00 0.00 H new ATOM 0 HD12 ILE A 121 3.596 2.678 4.363 1.00 0.00 H new ATOM 0 HD13 ILE A 121 3.700 1.286 3.260 1.00 0.00 H new ATOM 716 N THR A 122 0.042 2.058 4.560 1.00 0.00 N ATOM 717 CA THR A 122 -0.154 1.038 5.583 1.00 0.00 C ATOM 718 C THR A 122 -0.925 -0.151 5.006 1.00 0.00 C ATOM 719 O THR A 122 -2.031 0.019 4.506 1.00 0.00 O ATOM 720 CB THR A 122 -0.932 1.615 6.791 1.00 0.00 C ATOM 721 OG1 THR A 122 -0.301 2.826 7.240 1.00 0.00 O ATOM 722 CG2 THR A 122 -0.970 0.613 7.938 1.00 0.00 C ATOM 0 H THR A 122 -0.684 2.078 3.844 1.00 0.00 H new ATOM 0 HA THR A 122 0.828 0.706 5.919 1.00 0.00 H new ATOM 0 HB THR A 122 -1.953 1.824 6.473 1.00 0.00 H new ATOM 0 HG1 THR A 122 -0.796 3.189 8.003 1.00 0.00 H new ATOM 0 HG21 THR A 122 -1.522 1.040 8.776 1.00 0.00 H new ATOM 0 HG22 THR A 122 -1.463 -0.301 7.607 1.00 0.00 H new ATOM 0 HG23 THR A 122 0.048 0.382 8.253 1.00 0.00 H new ATOM 730 N VAL A 123 -0.344 -1.347 5.068 1.00 0.00 N ATOM 731 CA VAL A 123 -1.005 -2.529 4.523 1.00 0.00 C ATOM 732 C VAL A 123 -1.776 -3.285 5.608 1.00 0.00 C ATOM 733 O VAL A 123 -1.193 -3.836 6.542 1.00 0.00 O ATOM 734 CB VAL A 123 -0.013 -3.481 3.779 1.00 0.00 C ATOM 735 CG1 VAL A 123 1.183 -3.840 4.646 1.00 0.00 C ATOM 736 CG2 VAL A 123 -0.725 -4.746 3.304 1.00 0.00 C ATOM 0 H VAL A 123 0.571 -1.522 5.484 1.00 0.00 H new ATOM 0 HA VAL A 123 -1.719 -2.170 3.781 1.00 0.00 H new ATOM 0 HB VAL A 123 0.359 -2.941 2.908 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.848 -4.503 4.092 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.720 -2.932 4.919 1.00 0.00 H new ATOM 0 HG13 VAL A 123 0.839 -4.343 5.550 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -0.014 -5.392 2.789 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -1.140 -5.274 4.162 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -1.530 -4.476 2.621 1.00 0.00 H new ATOM 746 N MET A 124 -3.086 -3.281 5.482 1.00 0.00 N ATOM 747 CA MET A 124 -3.960 -3.938 6.439 1.00 0.00 C ATOM 748 C MET A 124 -4.646 -5.140 5.802 1.00 0.00 C ATOM 749 O MET A 124 -5.046 -5.094 4.636 1.00 0.00 O ATOM 750 CB MET A 124 -5.022 -2.959 6.960 1.00 0.00 C ATOM 751 CG MET A 124 -4.467 -1.699 7.626 1.00 0.00 C ATOM 752 SD MET A 124 -4.019 -1.915 9.372 1.00 0.00 S ATOM 753 CE MET A 124 -2.547 -2.931 9.269 1.00 0.00 C ATOM 0 H MET A 124 -3.578 -2.823 4.715 1.00 0.00 H new ATOM 0 HA MET A 124 -3.348 -4.279 7.274 1.00 0.00 H new ATOM 0 HB2 MET A 124 -5.660 -2.661 6.128 1.00 0.00 H new ATOM 0 HB3 MET A 124 -5.656 -3.481 7.676 1.00 0.00 H new ATOM 0 HG2 MET A 124 -3.587 -1.368 7.075 1.00 0.00 H new ATOM 0 HG3 MET A 124 -5.209 -0.904 7.549 1.00 0.00 H new ATOM 0 HE1 MET A 124 -1.919 -2.750 10.141 1.00 0.00 H new ATOM 0 HE2 MET A 124 -2.832 -3.983 9.239 1.00 0.00 H new ATOM 0 HE3 MET A 124 -1.994 -2.679 8.364 1.00 0.00 H new ATOM 763 N PRO A 125 -4.772 -6.241 6.545 1.00 0.00 N ATOM 764 CA PRO A 125 -5.460 -7.427 6.068 1.00 0.00 C ATOM 765 C PRO A 125 -6.971 -7.322 6.277 1.00 0.00 C ATOM 766 O PRO A 125 -7.431 -6.798 7.295 1.00 0.00 O ATOM 767 CB PRO A 125 -4.876 -8.537 6.940 1.00 0.00 C ATOM 768 CG PRO A 125 -4.539 -7.869 8.234 1.00 0.00 C ATOM 769 CD PRO A 125 -4.230 -6.423 7.911 1.00 0.00 C ATOM 0 HA PRO A 125 -5.324 -7.591 4.999 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.594 -9.344 7.087 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -3.991 -8.977 6.480 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.372 -7.940 8.934 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -3.683 -8.351 8.707 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -4.702 -5.745 8.622 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.159 -6.226 7.946 1.00 0.00 H new ATOM 777 N CYS A 126 -7.739 -7.791 5.313 1.00 0.00 N ATOM 778 CA CYS A 126 -9.178 -7.772 5.450 1.00 0.00 C ATOM 779 C CYS A 126 -9.660 -9.101 5.997 1.00 0.00 C ATOM 780 O CYS A 126 -8.855 -9.999 6.273 1.00 0.00 O ATOM 781 CB CYS A 126 -9.868 -7.474 4.114 1.00 0.00 C ATOM 782 SG CYS A 126 -11.590 -6.892 4.311 1.00 0.00 S ATOM 0 H CYS A 126 -7.394 -8.185 4.438 1.00 0.00 H new ATOM 0 HA CYS A 126 -9.439 -6.974 6.145 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -9.295 -6.719 3.576 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -9.863 -8.375 3.500 1.00 0.00 H new ATOM 787 N SER A 127 -10.958 -9.226 6.156 1.00 0.00 N ATOM 788 CA SER A 127 -11.545 -10.435 6.663 1.00 0.00 C ATOM 789 C SER A 127 -11.387 -11.564 5.649 1.00 0.00 C ATOM 790 O SER A 127 -11.508 -11.349 4.432 1.00 0.00 O ATOM 791 CB SER A 127 -13.026 -10.198 6.975 1.00 0.00 C ATOM 792 OG SER A 127 -13.577 -11.267 7.727 1.00 0.00 O ATOM 0 H SER A 127 -11.631 -8.492 5.937 1.00 0.00 H new ATOM 0 HA SER A 127 -11.033 -10.724 7.581 1.00 0.00 H new ATOM 0 HB2 SER A 127 -13.137 -9.266 7.530 1.00 0.00 H new ATOM 0 HB3 SER A 127 -13.581 -10.083 6.044 1.00 0.00 H new ATOM 0 HG SER A 127 -14.522 -11.084 7.911 1.00 0.00 H new ATOM 798 N ILE A 128 -11.095 -12.754 6.141 1.00 0.00 N ATOM 799 CA ILE A 128 -10.953 -13.914 5.287 1.00 0.00 C ATOM 800 C ILE A 128 -12.271 -14.188 4.567 1.00 0.00 C ATOM 801 O ILE A 128 -13.352 -14.021 5.139 1.00 0.00 O ATOM 802 CB ILE A 128 -10.472 -15.175 6.085 1.00 0.00 C ATOM 803 CG1 ILE A 128 -8.981 -15.057 6.451 1.00 0.00 C ATOM 804 CG2 ILE A 128 -10.711 -16.459 5.300 1.00 0.00 C ATOM 805 CD1 ILE A 128 -8.665 -14.003 7.490 1.00 0.00 C ATOM 0 H ILE A 128 -10.951 -12.941 7.133 1.00 0.00 H new ATOM 0 HA ILE A 128 -10.181 -13.699 4.548 1.00 0.00 H new ATOM 0 HB ILE A 128 -11.060 -15.220 7.002 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -8.633 -16.023 6.816 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -8.415 -14.836 5.546 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -10.365 -17.312 5.884 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -11.776 -16.567 5.095 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -10.163 -16.418 4.359 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -7.592 -13.993 7.683 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -8.977 -13.025 7.123 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -9.198 -14.231 8.413 1.00 0.00 H new ATOM 817 N GLY A 129 -12.173 -14.590 3.321 1.00 0.00 N ATOM 818 CA GLY A 129 -13.352 -14.812 2.529 1.00 0.00 C ATOM 819 C GLY A 129 -13.732 -13.602 1.705 1.00 0.00 C ATOM 820 O GLY A 129 -14.472 -13.724 0.726 1.00 0.00 O ATOM 0 H GLY A 129 -11.292 -14.768 2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -13.186 -15.661 1.866 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -14.182 -15.076 3.185 1.00 0.00 H new ATOM 824 N THR A 130 -13.242 -12.427 2.087 1.00 0.00 N ATOM 825 CA THR A 130 -13.548 -11.217 1.352 1.00 0.00 C ATOM 826 C THR A 130 -12.292 -10.632 0.708 1.00 0.00 C ATOM 827 O THR A 130 -11.173 -10.870 1.171 1.00 0.00 O ATOM 828 CB THR A 130 -14.223 -10.145 2.250 1.00 0.00 C ATOM 829 OG1 THR A 130 -13.369 -9.787 3.345 1.00 0.00 O ATOM 830 CG2 THR A 130 -15.551 -10.651 2.795 1.00 0.00 C ATOM 0 H THR A 130 -12.636 -12.293 2.896 1.00 0.00 H new ATOM 0 HA THR A 130 -14.253 -11.497 0.569 1.00 0.00 H new ATOM 0 HB THR A 130 -14.402 -9.265 1.632 1.00 0.00 H new ATOM 0 HG1 THR A 130 -12.626 -10.424 3.402 1.00 0.00 H new ATOM 0 HG21 THR A 130 -16.004 -9.882 3.421 1.00 0.00 H new ATOM 0 HG22 THR A 130 -16.219 -10.885 1.966 1.00 0.00 H new ATOM 0 HG23 THR A 130 -15.382 -11.549 3.389 1.00 0.00 H new ATOM 838 N LYS A 131 -12.485 -9.883 -0.362 1.00 0.00 N ATOM 839 CA LYS A 131 -11.394 -9.248 -1.075 1.00 0.00 C ATOM 840 C LYS A 131 -11.663 -7.758 -1.215 1.00 0.00 C ATOM 841 O LYS A 131 -12.816 -7.342 -1.365 1.00 0.00 O ATOM 842 CB LYS A 131 -11.211 -9.885 -2.456 1.00 0.00 C ATOM 843 CG LYS A 131 -12.457 -9.852 -3.331 1.00 0.00 C ATOM 844 CD LYS A 131 -12.191 -10.480 -4.687 1.00 0.00 C ATOM 845 CE LYS A 131 -13.450 -10.538 -5.539 1.00 0.00 C ATOM 846 NZ LYS A 131 -13.170 -11.070 -6.897 1.00 0.00 N ATOM 0 H LYS A 131 -13.405 -9.698 -0.761 1.00 0.00 H new ATOM 0 HA LYS A 131 -10.475 -9.391 -0.506 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -10.402 -9.371 -2.976 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -10.899 -10.921 -2.327 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -13.268 -10.384 -2.834 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -12.785 -8.821 -3.463 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.425 -9.907 -5.209 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -11.798 -11.487 -4.550 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -14.193 -11.166 -5.048 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -13.880 -9.540 -5.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -14.051 -11.095 -7.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -12.480 -10.456 -7.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -12.783 -12.032 -6.820 1.00 0.00 H new ATOM 860 N PHE A 132 -10.619 -6.964 -1.157 1.00 0.00 N ATOM 861 CA PHE A 132 -10.758 -5.521 -1.246 1.00 0.00 C ATOM 862 C PHE A 132 -10.825 -5.066 -2.707 1.00 0.00 C ATOM 863 O PHE A 132 -10.024 -5.494 -3.540 1.00 0.00 O ATOM 864 CB PHE A 132 -9.594 -4.842 -0.527 1.00 0.00 C ATOM 865 CG PHE A 132 -9.852 -3.407 -0.166 1.00 0.00 C ATOM 866 CD1 PHE A 132 -10.503 -3.086 1.012 1.00 0.00 C ATOM 867 CD2 PHE A 132 -9.435 -2.383 -0.995 1.00 0.00 C ATOM 868 CE1 PHE A 132 -10.734 -1.773 1.357 1.00 0.00 C ATOM 869 CE2 PHE A 132 -9.664 -1.066 -0.657 1.00 0.00 C ATOM 870 CZ PHE A 132 -10.315 -0.761 0.522 1.00 0.00 C ATOM 0 H PHE A 132 -9.659 -7.290 -1.048 1.00 0.00 H new ATOM 0 HA PHE A 132 -11.691 -5.232 -0.762 1.00 0.00 H new ATOM 0 HB2 PHE A 132 -9.367 -5.399 0.382 1.00 0.00 H new ATOM 0 HB3 PHE A 132 -8.709 -4.893 -1.161 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -10.834 -3.876 1.670 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -8.924 -2.617 -1.917 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -11.243 -1.537 2.280 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -9.335 -0.274 -1.313 1.00 0.00 H new ATOM 0 HZ PHE A 132 -10.495 0.270 0.789 1.00 0.00 H new ATOM 880 N ASP A 133 -11.789 -4.210 -3.003 1.00 0.00 N ATOM 881 CA ASP A 133 -11.975 -3.677 -4.356 1.00 0.00 C ATOM 882 C ASP A 133 -11.260 -2.333 -4.503 1.00 0.00 C ATOM 883 O ASP A 133 -11.374 -1.473 -3.634 1.00 0.00 O ATOM 884 CB ASP A 133 -13.473 -3.520 -4.660 1.00 0.00 C ATOM 885 CG ASP A 133 -13.745 -3.044 -6.076 1.00 0.00 C ATOM 886 OD1 ASP A 133 -13.847 -3.890 -6.981 1.00 0.00 O ATOM 887 OD2 ASP A 133 -13.865 -1.827 -6.287 1.00 0.00 O ATOM 0 H ASP A 133 -12.464 -3.863 -2.322 1.00 0.00 H new ATOM 0 HA ASP A 133 -11.543 -4.378 -5.070 1.00 0.00 H new ATOM 0 HB2 ASP A 133 -13.972 -4.476 -4.502 1.00 0.00 H new ATOM 0 HB3 ASP A 133 -13.909 -2.812 -3.955 1.00 0.00 H new ATOM 892 N PRO A 134 -10.508 -2.145 -5.603 1.00 0.00 N ATOM 893 CA PRO A 134 -9.727 -0.918 -5.839 1.00 0.00 C ATOM 894 C PRO A 134 -10.574 0.339 -6.084 1.00 0.00 C ATOM 895 O PRO A 134 -10.249 1.416 -5.584 1.00 0.00 O ATOM 896 CB PRO A 134 -8.902 -1.256 -7.089 1.00 0.00 C ATOM 897 CG PRO A 134 -9.670 -2.332 -7.778 1.00 0.00 C ATOM 898 CD PRO A 134 -10.345 -3.124 -6.697 1.00 0.00 C ATOM 0 HA PRO A 134 -9.137 -0.664 -4.958 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.782 -0.383 -7.731 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -7.901 -1.595 -6.822 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -10.403 -1.908 -8.465 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -9.008 -2.965 -8.369 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -11.305 -3.519 -7.029 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -9.740 -3.976 -6.386 1.00 0.00 H new ATOM 906 N ILE A 135 -11.641 0.207 -6.851 1.00 0.00 N ATOM 907 CA ILE A 135 -12.470 1.355 -7.193 1.00 0.00 C ATOM 908 C ILE A 135 -13.473 1.681 -6.087 1.00 0.00 C ATOM 909 O ILE A 135 -13.548 2.821 -5.622 1.00 0.00 O ATOM 910 CB ILE A 135 -13.200 1.152 -8.560 1.00 0.00 C ATOM 911 CG1 ILE A 135 -12.227 1.356 -9.739 1.00 0.00 C ATOM 912 CG2 ILE A 135 -14.391 2.098 -8.696 1.00 0.00 C ATOM 913 CD1 ILE A 135 -11.084 0.364 -9.806 1.00 0.00 C ATOM 0 H ILE A 135 -11.955 -0.678 -7.249 1.00 0.00 H new ATOM 0 HA ILE A 135 -11.799 2.208 -7.294 1.00 0.00 H new ATOM 0 HB ILE A 135 -13.570 0.127 -8.585 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -12.791 1.300 -10.670 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -11.812 2.362 -9.678 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -14.879 1.933 -9.657 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -15.101 1.907 -7.891 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -14.045 3.130 -8.637 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -10.456 0.590 -10.668 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -10.489 0.433 -8.895 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -11.484 -0.645 -9.903 1.00 0.00 H new ATOM 925 N SER A 136 -14.226 0.685 -5.658 1.00 0.00 N ATOM 926 CA SER A 136 -15.227 0.875 -4.622 1.00 0.00 C ATOM 927 C SER A 136 -14.553 1.147 -3.283 1.00 0.00 C ATOM 928 O SER A 136 -15.051 1.925 -2.464 1.00 0.00 O ATOM 929 CB SER A 136 -16.104 -0.371 -4.525 1.00 0.00 C ATOM 930 OG SER A 136 -16.468 -0.833 -5.818 1.00 0.00 O ATOM 0 H SER A 136 -14.163 -0.269 -6.013 1.00 0.00 H new ATOM 0 HA SER A 136 -15.849 1.733 -4.878 1.00 0.00 H new ATOM 0 HB2 SER A 136 -15.570 -1.156 -3.990 1.00 0.00 H new ATOM 0 HB3 SER A 136 -17.001 -0.146 -3.948 1.00 0.00 H new ATOM 0 HG SER A 136 -15.748 -1.391 -6.181 1.00 0.00 H new ATOM 936 N ARG A 137 -13.417 0.488 -3.075 1.00 0.00 N ATOM 937 CA ARG A 137 -12.617 0.643 -1.873 1.00 0.00 C ATOM 938 C ARG A 137 -13.339 0.108 -0.651 1.00 0.00 C ATOM 939 O ARG A 137 -13.681 0.845 0.277 1.00 0.00 O ATOM 940 CB ARG A 137 -12.152 2.089 -1.682 1.00 0.00 C ATOM 941 CG ARG A 137 -11.248 2.564 -2.808 1.00 0.00 C ATOM 942 CD ARG A 137 -10.698 3.948 -2.556 1.00 0.00 C ATOM 943 NE ARG A 137 -11.732 4.977 -2.590 1.00 0.00 N ATOM 944 CZ ARG A 137 -11.497 6.265 -2.845 1.00 0.00 C ATOM 945 NH1 ARG A 137 -10.263 6.682 -3.127 1.00 0.00 N ATOM 946 NH2 ARG A 137 -12.496 7.135 -2.832 1.00 0.00 N ATOM 0 H ARG A 137 -13.026 -0.174 -3.745 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.718 0.040 -2.001 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -13.023 2.742 -1.620 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -11.621 2.174 -0.734 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -10.422 1.863 -2.928 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -11.806 2.562 -3.744 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -10.203 3.967 -1.585 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -9.939 4.175 -3.305 1.00 0.00 H new ATOM 0 HE ARG A 137 -12.695 4.694 -2.407 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -9.492 6.015 -3.149 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -10.090 7.668 -3.321 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -13.444 6.820 -2.627 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -12.317 8.120 -3.027 1.00 0.00 H new ATOM 960 N ASN A 138 -13.593 -1.186 -0.687 1.00 0.00 N ATOM 961 CA ASN A 138 -14.212 -1.920 0.402 1.00 0.00 C ATOM 962 C ASN A 138 -14.010 -3.398 0.148 1.00 0.00 C ATOM 963 O ASN A 138 -13.524 -3.775 -0.918 1.00 0.00 O ATOM 964 CB ASN A 138 -15.716 -1.592 0.535 1.00 0.00 C ATOM 965 CG ASN A 138 -16.554 -2.050 -0.652 1.00 0.00 C ATOM 966 OD1 ASN A 138 -16.701 -1.330 -1.633 1.00 0.00 O ATOM 967 ND2 ASN A 138 -17.131 -3.240 -0.554 1.00 0.00 N ATOM 0 H ASN A 138 -13.370 -1.770 -1.493 1.00 0.00 H new ATOM 0 HA ASN A 138 -13.745 -1.627 1.342 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -16.101 -2.059 1.441 1.00 0.00 H new ATOM 0 HB3 ASN A 138 -15.834 -0.515 0.657 1.00 0.00 H new ATOM 0 HD21 ASN A 138 -17.721 -3.585 -1.311 1.00 0.00 H new ATOM 0 HD22 ASN A 138 -16.985 -3.811 0.279 1.00 0.00 H new ATOM 974 N CYS A 139 -14.378 -4.232 1.091 1.00 0.00 N ATOM 975 CA CYS A 139 -14.198 -5.660 0.924 1.00 0.00 C ATOM 976 C CYS A 139 -15.497 -6.331 0.519 1.00 0.00 C ATOM 977 O CYS A 139 -16.532 -6.156 1.165 1.00 0.00 O ATOM 978 CB CYS A 139 -13.653 -6.300 2.204 1.00 0.00 C ATOM 979 SG CYS A 139 -11.959 -5.802 2.644 1.00 0.00 S ATOM 0 H CYS A 139 -14.801 -3.953 1.976 1.00 0.00 H new ATOM 0 HA CYS A 139 -13.470 -5.806 0.126 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -14.317 -6.048 3.031 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -13.681 -7.384 2.092 1.00 0.00 H new ATOM 984 N VAL A 140 -15.436 -7.073 -0.568 1.00 0.00 N ATOM 985 CA VAL A 140 -16.576 -7.813 -1.076 1.00 0.00 C ATOM 986 C VAL A 140 -16.305 -9.303 -0.947 1.00 0.00 C ATOM 987 O VAL A 140 -15.151 -9.710 -0.844 1.00 0.00 O ATOM 988 CB VAL A 140 -16.873 -7.469 -2.561 1.00 0.00 C ATOM 989 CG1 VAL A 140 -17.215 -5.995 -2.713 1.00 0.00 C ATOM 990 CG2 VAL A 140 -15.693 -7.837 -3.455 1.00 0.00 C ATOM 0 H VAL A 140 -14.590 -7.181 -1.128 1.00 0.00 H new ATOM 0 HA VAL A 140 -17.449 -7.532 -0.487 1.00 0.00 H new ATOM 0 HB VAL A 140 -17.734 -8.059 -2.876 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -17.420 -5.775 -3.761 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.096 -5.762 -2.115 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.375 -5.390 -2.373 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -15.928 -7.586 -4.489 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.810 -7.282 -3.138 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -15.497 -8.906 -3.377 1.00 0.00 H new ATOM 1000 N LEU A 141 -17.352 -10.106 -0.937 1.00 0.00 N ATOM 1001 CA LEU A 141 -17.199 -11.550 -0.813 1.00 0.00 C ATOM 1002 C LEU A 141 -16.393 -12.089 -1.996 1.00 0.00 C ATOM 1003 O LEU A 141 -16.805 -11.971 -3.150 1.00 0.00 O ATOM 1004 CB LEU A 141 -18.582 -12.229 -0.728 1.00 0.00 C ATOM 1005 CG LEU A 141 -18.645 -13.612 -0.035 1.00 0.00 C ATOM 1006 CD1 LEU A 141 -17.919 -14.677 -0.838 1.00 0.00 C ATOM 1007 CD2 LEU A 141 -18.082 -13.533 1.378 1.00 0.00 C ATOM 0 H LEU A 141 -18.318 -9.787 -1.013 1.00 0.00 H new ATOM 0 HA LEU A 141 -16.657 -11.777 0.105 1.00 0.00 H new ATOM 0 HB2 LEU A 141 -19.258 -11.555 -0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 141 -18.968 -12.340 -1.741 1.00 0.00 H new ATOM 0 HG LEU A 141 -19.695 -13.900 0.023 1.00 0.00 H new ATOM 0 HD11 LEU A 141 -17.986 -15.633 -0.319 1.00 0.00 H new ATOM 0 HD12 LEU A 141 -18.378 -14.766 -1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 141 -16.871 -14.397 -0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 141 -18.136 -14.516 1.847 1.00 0.00 H new ATOM 0 HD22 LEU A 141 -17.043 -13.207 1.338 1.00 0.00 H new ATOM 0 HD23 LEU A 141 -18.664 -12.820 1.962 1.00 0.00 H new ATOM 1019 N ASP A 142 -15.237 -12.658 -1.696 1.00 0.00 N ATOM 1020 CA ASP A 142 -14.351 -13.189 -2.718 1.00 0.00 C ATOM 1021 C ASP A 142 -14.843 -14.541 -3.196 1.00 0.00 C ATOM 1022 O ASP A 142 -14.534 -15.575 -2.600 1.00 0.00 O ATOM 1023 CB ASP A 142 -12.913 -13.295 -2.185 1.00 0.00 C ATOM 1024 CG ASP A 142 -11.930 -13.828 -3.216 1.00 0.00 C ATOM 1025 OD1 ASP A 142 -12.189 -13.682 -4.429 1.00 0.00 O ATOM 1026 OD2 ASP A 142 -10.884 -14.383 -2.812 1.00 0.00 O ATOM 0 H ASP A 142 -14.888 -12.764 -0.743 1.00 0.00 H new ATOM 0 HA ASP A 142 -14.352 -12.503 -3.565 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -12.582 -12.311 -1.852 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -12.903 -13.947 -1.312 1.00 0.00 H new ATOM 1031 N ASN A 143 -15.643 -14.524 -4.242 1.00 0.00 N ATOM 1032 CA ASN A 143 -16.176 -15.735 -4.823 1.00 0.00 C ATOM 1033 C ASN A 143 -15.976 -15.689 -6.324 1.00 0.00 C ATOM 1034 O ASN A 143 -16.839 -15.126 -7.026 1.00 0.00 O ATOM 1035 CB ASN A 143 -17.670 -15.870 -4.489 1.00 0.00 C ATOM 1036 CG ASN A 143 -18.273 -17.205 -4.908 1.00 0.00 C ATOM 1037 OD1 ASN A 143 -17.837 -17.839 -5.870 1.00 0.00 O ATOM 1038 ND2 ASN A 143 -19.289 -17.636 -4.185 1.00 0.00 N ATOM 1039 OXT ASN A 143 -14.930 -16.177 -6.795 1.00 0.00 O ATOM 0 H ASN A 143 -15.941 -13.669 -4.712 1.00 0.00 H new ATOM 0 HA ASN A 143 -15.654 -16.599 -4.412 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -17.806 -15.741 -3.415 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -18.217 -15.065 -4.979 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -19.740 -18.521 -4.416 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -19.623 -17.084 -3.395 1.00 0.00 H new TER 1046 ASN A 143