USER MOD reduce.3.24.130724 H: found=0, std=0, add=1011, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1011 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 115 THR OG1 : rot 170:sc= 0.95 USER MOD Set 1.2: A 119 LYS NZ :NH3+ -179:sc= 2.37 (180deg=1.23) USER MOD Set 2.1: A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 71 THR OG1 : rot 80:sc= 1.22 USER MOD Set 3.1: A 56 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 85 MET CE :methyl 161:sc=-0.00215 (180deg=-0.208) USER MOD Set 4.1: A 26 LYS NZ :NH3+ 174:sc= 0 (180deg=0) USER MOD Set 4.2: A 31 ASN : amide:sc= -0.416 X(o=-0.42,f=-0.031) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0204) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0.068 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -176:sc= 0 (180deg=-0.0552) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=-0.0003) USER MOD Single : A 32 ASN : amide:sc= 0.191 K(o=0.19,f=-1.8!) USER MOD Single : A 44 ASN : amide:sc= -0.397 K(o=-0.4,f=-2.1) USER MOD Single : A 45 LYS NZ :NH3+ -161:sc= 1.15 (180deg=0.41) USER MOD Single : A 47 GLN : amide:sc= 0.153 X(o=0.15,f=0) USER MOD Single : A 51 TYR OH : rot 150:sc= -0.0193 USER MOD Single : A 59 ASN : amide:sc= 0.319 X(o=0.32,f=0) USER MOD Single : A 60 MET CE :methyl -137:sc= -0.689 (180deg=-2.56) USER MOD Single : A 62 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 SER OG : rot -160:sc= 0 USER MOD Single : A 87 THR OG1 : rot 117:sc= 1.68 USER MOD Single : A 91 LYS NZ :NH3+ -141:sc= 1.34 (180deg=0.124) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -0.55 X(o=-0.55,f=-0.92) USER MOD Single : A 100 GLN : amide:sc= -0.1 X(o=-0.1,f=-0.034) USER MOD Single : A 104 SER OG : rot -83:sc= 1.31 USER MOD Single : A 106 TYR OH : rot -12:sc= 1.24 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 122 LYS NZ :NH3+ -119:sc= 0.00462 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 21.539 -16.213 -2.102 1.00 0.00 N ATOM 2 CA MET A 1 20.191 -15.642 -2.147 1.00 0.00 C ATOM 3 C MET A 1 19.619 -15.754 -0.746 1.00 0.00 C ATOM 4 O MET A 1 19.520 -16.866 -0.218 1.00 0.00 O ATOM 5 CB MET A 1 19.312 -16.304 -3.220 1.00 0.00 C ATOM 6 CG MET A 1 18.445 -15.265 -3.938 1.00 0.00 C ATOM 7 SD MET A 1 17.409 -14.256 -2.851 1.00 0.00 S ATOM 8 CE MET A 1 16.726 -13.083 -4.051 1.00 0.00 C ATOM 0 H1 MET A 1 21.971 -16.157 -3.046 1.00 0.00 H new ATOM 0 H2 MET A 1 22.119 -15.680 -1.423 1.00 0.00 H new ATOM 0 H3 MET A 1 21.485 -17.208 -1.805 1.00 0.00 H new ATOM 0 HA MET A 1 20.224 -14.595 -2.447 1.00 0.00 H new ATOM 0 HB2 MET A 1 19.943 -16.820 -3.944 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.675 -17.058 -2.758 1.00 0.00 H new ATOM 0 HG2 MET A 1 19.095 -14.605 -4.512 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.803 -15.780 -4.653 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.061 -12.386 -3.541 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.539 -12.530 -4.523 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.167 -13.626 -4.813 1.00 0.00 H new ATOM 20 N ALA A 2 19.340 -14.615 -0.110 1.00 0.00 N ATOM 21 CA ALA A 2 18.956 -14.538 1.289 1.00 0.00 C ATOM 22 C ALA A 2 17.581 -15.173 1.504 1.00 0.00 C ATOM 23 O ALA A 2 17.468 -16.244 2.106 1.00 0.00 O ATOM 24 CB ALA A 2 19.000 -13.074 1.756 1.00 0.00 C ATOM 0 H ALA A 2 19.377 -13.704 -0.568 1.00 0.00 H new ATOM 0 HA ALA A 2 19.664 -15.104 1.895 1.00 0.00 H new ATOM 0 HB1 ALA A 2 18.712 -13.018 2.806 1.00 0.00 H new ATOM 0 HB2 ALA A 2 20.011 -12.684 1.636 1.00 0.00 H new ATOM 0 HB3 ALA A 2 18.309 -12.480 1.158 1.00 0.00 H new ATOM 30 N ASP A 3 16.538 -14.508 1.018 1.00 0.00 N ATOM 31 CA ASP A 3 15.136 -14.714 1.376 1.00 0.00 C ATOM 32 C ASP A 3 14.296 -14.582 0.109 1.00 0.00 C ATOM 33 O ASP A 3 14.844 -14.433 -0.984 1.00 0.00 O ATOM 34 CB ASP A 3 14.695 -13.648 2.401 1.00 0.00 C ATOM 35 CG ASP A 3 15.382 -13.772 3.751 1.00 0.00 C ATOM 36 OD1 ASP A 3 15.244 -14.839 4.396 1.00 0.00 O ATOM 37 OD2 ASP A 3 16.069 -12.810 4.163 1.00 0.00 O ATOM 0 H ASP A 3 16.653 -13.769 0.325 1.00 0.00 H new ATOM 0 HA ASP A 3 15.004 -15.702 1.818 1.00 0.00 H new ATOM 0 HB2 ASP A 3 14.897 -12.658 1.991 1.00 0.00 H new ATOM 0 HB3 ASP A 3 13.617 -13.720 2.545 1.00 0.00 H new ATOM 42 N LYS A 4 12.963 -14.559 0.224 1.00 0.00 N ATOM 43 CA LYS A 4 12.135 -13.996 -0.838 1.00 0.00 C ATOM 44 C LYS A 4 12.558 -12.567 -1.147 1.00 0.00 C ATOM 45 O LYS A 4 12.458 -12.161 -2.306 1.00 0.00 O ATOM 46 CB LYS A 4 10.654 -14.038 -0.432 1.00 0.00 C ATOM 47 CG LYS A 4 10.023 -15.389 -0.771 1.00 0.00 C ATOM 48 CD LYS A 4 9.747 -15.483 -2.274 1.00 0.00 C ATOM 49 CE LYS A 4 9.281 -16.878 -2.684 1.00 0.00 C ATOM 50 NZ LYS A 4 10.375 -17.866 -2.651 1.00 0.00 N ATOM 0 H LYS A 4 12.446 -14.917 1.027 1.00 0.00 H new ATOM 0 HA LYS A 4 12.271 -14.596 -1.738 1.00 0.00 H new ATOM 0 HB2 LYS A 4 10.563 -13.850 0.638 1.00 0.00 H new ATOM 0 HB3 LYS A 4 10.112 -13.242 -0.943 1.00 0.00 H new ATOM 0 HG2 LYS A 4 10.689 -16.196 -0.465 1.00 0.00 H new ATOM 0 HG3 LYS A 4 9.094 -15.514 -0.215 1.00 0.00 H new ATOM 0 HD2 LYS A 4 8.987 -14.752 -2.549 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.652 -15.226 -2.825 1.00 0.00 H new ATOM 0 HE2 LYS A 4 8.482 -17.202 -2.018 1.00 0.00 H new ATOM 0 HE3 LYS A 4 8.861 -16.838 -3.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 10.036 -18.772 -3.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 11.170 -17.523 -3.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 10.691 -18.001 -1.670 1.00 0.00 H new ATOM 64 N GLU A 5 13.035 -11.840 -0.133 1.00 0.00 N ATOM 65 CA GLU A 5 13.316 -10.415 -0.181 1.00 0.00 C ATOM 66 C GLU A 5 12.075 -9.695 -0.714 1.00 0.00 C ATOM 67 O GLU A 5 12.166 -8.855 -1.613 1.00 0.00 O ATOM 68 CB GLU A 5 14.619 -10.118 -0.950 1.00 0.00 C ATOM 69 CG GLU A 5 15.834 -10.836 -0.340 1.00 0.00 C ATOM 70 CD GLU A 5 17.156 -10.236 -0.819 1.00 0.00 C ATOM 71 OE1 GLU A 5 17.406 -9.040 -0.540 1.00 0.00 O ATOM 72 OE2 GLU A 5 17.996 -10.951 -1.410 1.00 0.00 O ATOM 0 H GLU A 5 13.242 -12.251 0.777 1.00 0.00 H new ATOM 0 HA GLU A 5 13.511 -10.025 0.818 1.00 0.00 H new ATOM 0 HB2 GLU A 5 14.503 -10.425 -1.989 1.00 0.00 H new ATOM 0 HB3 GLU A 5 14.799 -9.043 -0.953 1.00 0.00 H new ATOM 0 HG2 GLU A 5 15.782 -10.776 0.747 1.00 0.00 H new ATOM 0 HG3 GLU A 5 15.800 -11.893 -0.603 1.00 0.00 H new ATOM 79 N LEU A 6 10.911 -10.077 -0.164 1.00 0.00 N ATOM 80 CA LEU A 6 9.585 -9.604 -0.551 1.00 0.00 C ATOM 81 C LEU A 6 9.609 -8.106 -0.726 1.00 0.00 C ATOM 82 O LEU A 6 10.064 -7.384 0.163 1.00 0.00 O ATOM 83 CB LEU A 6 8.558 -10.008 0.509 1.00 0.00 C ATOM 84 CG LEU A 6 7.136 -9.431 0.316 1.00 0.00 C ATOM 85 CD1 LEU A 6 6.098 -10.469 0.750 1.00 0.00 C ATOM 86 CD2 LEU A 6 6.891 -8.153 1.133 1.00 0.00 C ATOM 0 H LEU A 6 10.874 -10.755 0.597 1.00 0.00 H new ATOM 0 HA LEU A 6 9.300 -10.060 -1.499 1.00 0.00 H new ATOM 0 HB2 LEU A 6 8.490 -11.096 0.527 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.928 -9.695 1.485 1.00 0.00 H new ATOM 0 HG LEU A 6 7.044 -9.184 -0.742 1.00 0.00 H new ATOM 0 HD11 LEU A 6 5.096 -10.061 0.614 1.00 0.00 H new ATOM 0 HD12 LEU A 6 6.209 -11.369 0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 6 6.249 -10.717 1.801 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.876 -7.797 0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 6 7.019 -8.369 2.194 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.603 -7.386 0.830 1.00 0.00 H new ATOM 98 N LYS A 7 9.145 -7.649 -1.881 1.00 0.00 N ATOM 99 CA LYS A 7 9.113 -6.231 -2.153 1.00 0.00 C ATOM 100 C LYS A 7 7.849 -5.650 -1.548 1.00 0.00 C ATOM 101 O LYS A 7 6.747 -6.168 -1.784 1.00 0.00 O ATOM 102 CB LYS A 7 9.100 -5.964 -3.662 1.00 0.00 C ATOM 103 CG LYS A 7 9.873 -4.677 -3.987 1.00 0.00 C ATOM 104 CD LYS A 7 11.342 -5.001 -4.256 1.00 0.00 C ATOM 105 CE LYS A 7 11.487 -5.663 -5.633 1.00 0.00 C ATOM 106 NZ LYS A 7 12.798 -6.310 -5.798 1.00 0.00 N ATOM 0 H LYS A 7 8.790 -8.238 -2.634 1.00 0.00 H new ATOM 0 HA LYS A 7 10.002 -5.770 -1.722 1.00 0.00 H new ATOM 0 HB2 LYS A 7 9.546 -6.807 -4.190 1.00 0.00 H new ATOM 0 HB3 LYS A 7 8.072 -5.876 -4.013 1.00 0.00 H new ATOM 0 HG2 LYS A 7 9.434 -4.190 -4.858 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.793 -3.976 -3.156 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.938 -4.089 -4.217 1.00 0.00 H new ATOM 0 HD3 LYS A 7 11.725 -5.665 -3.481 1.00 0.00 H new ATOM 0 HE2 LYS A 7 10.698 -6.404 -5.764 1.00 0.00 H new ATOM 0 HE3 LYS A 7 11.352 -4.913 -6.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 12.854 -6.745 -6.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.551 -5.599 -5.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 12.917 -7.044 -5.071 1.00 0.00 H new ATOM 120 N PHE A 8 8.018 -4.560 -0.819 1.00 0.00 N ATOM 121 CA PHE A 8 6.951 -3.628 -0.550 1.00 0.00 C ATOM 122 C PHE A 8 6.913 -2.712 -1.768 1.00 0.00 C ATOM 123 O PHE A 8 7.957 -2.299 -2.279 1.00 0.00 O ATOM 124 CB PHE A 8 7.259 -2.850 0.734 1.00 0.00 C ATOM 125 CG PHE A 8 6.724 -3.537 1.967 1.00 0.00 C ATOM 126 CD1 PHE A 8 7.304 -4.729 2.440 1.00 0.00 C ATOM 127 CD2 PHE A 8 5.584 -3.016 2.599 1.00 0.00 C ATOM 128 CE1 PHE A 8 6.718 -5.404 3.524 1.00 0.00 C ATOM 129 CE2 PHE A 8 5.013 -3.679 3.694 1.00 0.00 C ATOM 130 CZ PHE A 8 5.576 -4.879 4.152 1.00 0.00 C ATOM 0 H PHE A 8 8.909 -4.300 -0.396 1.00 0.00 H new ATOM 0 HA PHE A 8 5.988 -4.114 -0.395 1.00 0.00 H new ATOM 0 HB2 PHE A 8 8.338 -2.726 0.830 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.828 -1.851 0.662 1.00 0.00 H new ATOM 0 HD1 PHE A 8 8.194 -5.123 1.972 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.144 -2.098 2.239 1.00 0.00 H new ATOM 0 HE1 PHE A 8 7.147 -6.330 3.876 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.143 -3.267 4.183 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.132 -5.400 4.987 1.00 0.00 H new ATOM 140 N LEU A 9 5.723 -2.380 -2.242 1.00 0.00 N ATOM 141 CA LEU A 9 5.544 -1.351 -3.242 1.00 0.00 C ATOM 142 C LEU A 9 4.844 -0.187 -2.569 1.00 0.00 C ATOM 143 O LEU A 9 3.898 -0.416 -1.815 1.00 0.00 O ATOM 144 CB LEU A 9 4.740 -1.908 -4.417 1.00 0.00 C ATOM 145 CG LEU A 9 4.720 -0.917 -5.584 1.00 0.00 C ATOM 146 CD1 LEU A 9 6.073 -0.836 -6.290 1.00 0.00 C ATOM 147 CD2 LEU A 9 3.697 -1.367 -6.609 1.00 0.00 C ATOM 0 H LEU A 9 4.854 -2.821 -1.940 1.00 0.00 H new ATOM 0 HA LEU A 9 6.497 -1.011 -3.647 1.00 0.00 H new ATOM 0 HB2 LEU A 9 5.174 -2.853 -4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.720 -2.120 -4.097 1.00 0.00 H new ATOM 0 HG LEU A 9 4.474 0.061 -5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 9 6.013 -0.121 -7.111 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.834 -0.511 -5.581 1.00 0.00 H new ATOM 0 HD13 LEU A 9 6.338 -1.818 -6.682 1.00 0.00 H new ATOM 0 HD21 LEU A 9 3.681 -0.663 -7.441 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.963 -2.358 -6.978 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.711 -1.404 -6.146 1.00 0.00 H new ATOM 159 N VAL A 10 5.313 1.028 -2.833 1.00 0.00 N ATOM 160 CA VAL A 10 4.799 2.255 -2.247 1.00 0.00 C ATOM 161 C VAL A 10 4.552 3.215 -3.410 1.00 0.00 C ATOM 162 O VAL A 10 5.460 3.476 -4.202 1.00 0.00 O ATOM 163 CB VAL A 10 5.807 2.797 -1.208 1.00 0.00 C ATOM 164 CG1 VAL A 10 5.216 3.987 -0.451 1.00 0.00 C ATOM 165 CG2 VAL A 10 6.227 1.739 -0.167 1.00 0.00 C ATOM 0 H VAL A 10 6.085 1.188 -3.481 1.00 0.00 H new ATOM 0 HA VAL A 10 3.866 2.106 -1.703 1.00 0.00 H new ATOM 0 HB VAL A 10 6.687 3.094 -1.779 1.00 0.00 H new ATOM 0 HG11 VAL A 10 5.942 4.353 0.275 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.975 4.783 -1.156 1.00 0.00 H new ATOM 0 HG13 VAL A 10 4.310 3.674 0.068 1.00 0.00 H new ATOM 0 HG21 VAL A 10 6.935 2.180 0.535 1.00 0.00 H new ATOM 0 HG22 VAL A 10 5.347 1.393 0.375 1.00 0.00 H new ATOM 0 HG23 VAL A 10 6.696 0.896 -0.674 1.00 0.00 H new ATOM 175 N VAL A 11 3.321 3.703 -3.563 1.00 0.00 N ATOM 176 CA VAL A 11 2.926 4.565 -4.672 1.00 0.00 C ATOM 177 C VAL A 11 2.146 5.756 -4.086 1.00 0.00 C ATOM 178 O VAL A 11 1.062 6.102 -4.551 1.00 0.00 O ATOM 179 CB VAL A 11 2.176 3.752 -5.767 1.00 0.00 C ATOM 180 CG1 VAL A 11 2.228 4.487 -7.116 1.00 0.00 C ATOM 181 CG2 VAL A 11 2.724 2.328 -5.953 1.00 0.00 C ATOM 0 H VAL A 11 2.562 3.507 -2.911 1.00 0.00 H new ATOM 0 HA VAL A 11 3.789 4.973 -5.198 1.00 0.00 H new ATOM 0 HB VAL A 11 1.147 3.665 -5.419 1.00 0.00 H new ATOM 0 HG11 VAL A 11 1.698 3.903 -7.869 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.756 5.464 -7.016 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.267 4.615 -7.421 1.00 0.00 H new ATOM 0 HG21 VAL A 11 2.156 1.818 -6.731 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.773 2.377 -6.243 1.00 0.00 H new ATOM 0 HG23 VAL A 11 2.632 1.778 -5.017 1.00 0.00 H new ATOM 191 N ASP A 12 2.671 6.399 -3.037 1.00 0.00 N ATOM 192 CA ASP A 12 2.034 7.596 -2.477 1.00 0.00 C ATOM 193 C ASP A 12 2.034 8.697 -3.542 1.00 0.00 C ATOM 194 O ASP A 12 2.873 8.672 -4.452 1.00 0.00 O ATOM 195 CB ASP A 12 2.746 8.136 -1.234 1.00 0.00 C ATOM 196 CG ASP A 12 2.891 7.130 -0.096 1.00 0.00 C ATOM 197 OD1 ASP A 12 1.910 6.429 0.225 1.00 0.00 O ATOM 198 OD2 ASP A 12 4.028 7.001 0.394 1.00 0.00 O ATOM 0 H ASP A 12 3.528 6.114 -2.562 1.00 0.00 H new ATOM 0 HA ASP A 12 1.025 7.309 -2.180 1.00 0.00 H new ATOM 0 HB2 ASP A 12 3.738 8.484 -1.522 1.00 0.00 H new ATOM 0 HB3 ASP A 12 2.198 9.004 -0.866 1.00 0.00 H new ATOM 203 N ASP A 13 1.141 9.682 -3.445 1.00 0.00 N ATOM 204 CA ASP A 13 1.071 10.787 -4.409 1.00 0.00 C ATOM 205 C ASP A 13 2.277 11.726 -4.265 1.00 0.00 C ATOM 206 O ASP A 13 2.754 12.312 -5.246 1.00 0.00 O ATOM 207 CB ASP A 13 -0.243 11.575 -4.243 1.00 0.00 C ATOM 208 CG ASP A 13 -0.070 12.861 -3.425 1.00 0.00 C ATOM 209 OD1 ASP A 13 -0.086 12.805 -2.176 1.00 0.00 O ATOM 210 OD2 ASP A 13 0.162 13.931 -4.031 1.00 0.00 O ATOM 0 H ASP A 13 0.447 9.739 -2.700 1.00 0.00 H new ATOM 0 HA ASP A 13 1.094 10.355 -5.410 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -0.636 11.827 -5.228 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -0.983 10.939 -3.758 1.00 0.00 H new ATOM 215 N PHE A 14 2.762 11.877 -3.035 1.00 0.00 N ATOM 216 CA PHE A 14 3.766 12.847 -2.650 1.00 0.00 C ATOM 217 C PHE A 14 5.088 12.113 -2.520 1.00 0.00 C ATOM 218 O PHE A 14 5.168 11.118 -1.805 1.00 0.00 O ATOM 219 CB PHE A 14 3.357 13.477 -1.314 1.00 0.00 C ATOM 220 CG PHE A 14 4.237 14.624 -0.852 1.00 0.00 C ATOM 221 CD1 PHE A 14 4.461 15.728 -1.697 1.00 0.00 C ATOM 222 CD2 PHE A 14 4.798 14.616 0.441 1.00 0.00 C ATOM 223 CE1 PHE A 14 5.244 16.807 -1.256 1.00 0.00 C ATOM 224 CE2 PHE A 14 5.555 15.712 0.890 1.00 0.00 C ATOM 225 CZ PHE A 14 5.786 16.804 0.039 1.00 0.00 C ATOM 0 H PHE A 14 2.449 11.301 -2.253 1.00 0.00 H new ATOM 0 HA PHE A 14 3.861 13.642 -3.390 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.331 13.836 -1.397 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.362 12.703 -0.547 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.029 15.745 -2.687 1.00 0.00 H new ATOM 0 HD2 PHE A 14 4.646 13.765 1.089 1.00 0.00 H new ATOM 0 HE1 PHE A 14 5.430 17.642 -1.915 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.960 15.714 1.891 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.379 17.640 0.380 1.00 0.00 H new ATOM 235 N SER A 15 6.141 12.594 -3.179 1.00 0.00 N ATOM 236 CA SER A 15 7.410 11.877 -3.260 1.00 0.00 C ATOM 237 C SER A 15 7.968 11.632 -1.849 1.00 0.00 C ATOM 238 O SER A 15 8.261 10.499 -1.463 1.00 0.00 O ATOM 239 CB SER A 15 8.391 12.634 -4.172 1.00 0.00 C ATOM 240 OG SER A 15 7.730 13.547 -5.049 1.00 0.00 O ATOM 0 H SER A 15 6.138 13.488 -3.670 1.00 0.00 H new ATOM 0 HA SER A 15 7.254 10.898 -3.713 1.00 0.00 H new ATOM 0 HB2 SER A 15 9.106 13.180 -3.557 1.00 0.00 H new ATOM 0 HB3 SER A 15 8.961 11.916 -4.762 1.00 0.00 H new ATOM 0 HG SER A 15 8.394 14.004 -5.606 1.00 0.00 H new ATOM 246 N THR A 16 8.006 12.686 -1.029 1.00 0.00 N ATOM 247 CA THR A 16 8.441 12.602 0.358 1.00 0.00 C ATOM 248 C THR A 16 7.520 11.698 1.189 1.00 0.00 C ATOM 249 O THR A 16 7.988 11.122 2.168 1.00 0.00 O ATOM 250 CB THR A 16 8.573 14.037 0.899 1.00 0.00 C ATOM 251 OG1 THR A 16 9.734 14.630 0.338 1.00 0.00 O ATOM 252 CG2 THR A 16 8.621 14.168 2.421 1.00 0.00 C ATOM 0 H THR A 16 7.733 13.626 -1.316 1.00 0.00 H new ATOM 0 HA THR A 16 9.416 12.121 0.430 1.00 0.00 H new ATOM 0 HB THR A 16 7.659 14.550 0.601 1.00 0.00 H new ATOM 0 HG1 THR A 16 9.828 15.546 0.674 1.00 0.00 H new ATOM 0 HG21 THR A 16 8.715 15.219 2.693 1.00 0.00 H new ATOM 0 HG22 THR A 16 7.705 13.762 2.850 1.00 0.00 H new ATOM 0 HG23 THR A 16 9.478 13.616 2.807 1.00 0.00 H new ATOM 260 N MET A 17 6.256 11.491 0.810 1.00 0.00 N ATOM 261 CA MET A 17 5.432 10.531 1.527 1.00 0.00 C ATOM 262 C MET A 17 6.000 9.119 1.349 1.00 0.00 C ATOM 263 O MET A 17 6.022 8.389 2.337 1.00 0.00 O ATOM 264 CB MET A 17 3.957 10.649 1.136 1.00 0.00 C ATOM 265 CG MET A 17 3.057 9.948 2.145 1.00 0.00 C ATOM 266 SD MET A 17 1.318 9.674 1.715 1.00 0.00 S ATOM 267 CE MET A 17 0.869 11.224 0.916 1.00 0.00 C ATOM 0 H MET A 17 5.796 11.964 0.032 1.00 0.00 H new ATOM 0 HA MET A 17 5.465 10.758 2.593 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.680 11.701 1.068 1.00 0.00 H new ATOM 0 HB3 MET A 17 3.805 10.215 0.148 1.00 0.00 H new ATOM 0 HG2 MET A 17 3.500 8.977 2.365 1.00 0.00 H new ATOM 0 HG3 MET A 17 3.082 10.526 3.069 1.00 0.00 H new ATOM 0 HE1 MET A 17 -0.193 11.212 0.669 1.00 0.00 H new ATOM 0 HE2 MET A 17 1.075 12.054 1.591 1.00 0.00 H new ATOM 0 HE3 MET A 17 1.453 11.345 0.003 1.00 0.00 H new ATOM 277 N ARG A 18 6.594 8.765 0.193 1.00 0.00 N ATOM 278 CA ARG A 18 7.179 7.434 0.036 1.00 0.00 C ATOM 279 C ARG A 18 8.400 7.277 0.933 1.00 0.00 C ATOM 280 O ARG A 18 8.583 6.219 1.542 1.00 0.00 O ATOM 281 CB ARG A 18 7.518 7.130 -1.430 1.00 0.00 C ATOM 282 CG ARG A 18 6.290 7.063 -2.355 1.00 0.00 C ATOM 283 CD ARG A 18 6.102 8.333 -3.193 1.00 0.00 C ATOM 284 NE ARG A 18 6.822 8.252 -4.476 1.00 0.00 N ATOM 285 CZ ARG A 18 6.350 7.666 -5.583 1.00 0.00 C ATOM 286 NH1 ARG A 18 5.064 7.361 -5.727 1.00 0.00 N ATOM 287 NH2 ARG A 18 7.189 7.359 -6.561 1.00 0.00 N ATOM 0 H ARG A 18 6.677 9.371 -0.624 1.00 0.00 H new ATOM 0 HA ARG A 18 6.432 6.703 0.346 1.00 0.00 H new ATOM 0 HB2 ARG A 18 8.199 7.896 -1.801 1.00 0.00 H new ATOM 0 HB3 ARG A 18 8.050 6.180 -1.480 1.00 0.00 H new ATOM 0 HG2 ARG A 18 6.390 6.206 -3.021 1.00 0.00 H new ATOM 0 HG3 ARG A 18 5.397 6.896 -1.753 1.00 0.00 H new ATOM 0 HD2 ARG A 18 5.040 8.491 -3.381 1.00 0.00 H new ATOM 0 HD3 ARG A 18 6.458 9.196 -2.630 1.00 0.00 H new ATOM 0 HE ARG A 18 7.749 8.674 -4.524 1.00 0.00 H new ATOM 0 HH11 ARG A 18 4.403 7.573 -4.980 1.00 0.00 H new ATOM 0 HH12 ARG A 18 4.739 6.915 -6.584 1.00 0.00 H new ATOM 0 HH21 ARG A 18 8.182 7.569 -6.465 1.00 0.00 H new ATOM 0 HH22 ARG A 18 6.842 6.912 -7.410 1.00 0.00 H new ATOM 301 N ARG A 19 9.192 8.351 1.092 1.00 0.00 N ATOM 302 CA ARG A 19 10.247 8.407 2.102 1.00 0.00 C ATOM 303 C ARG A 19 9.663 8.041 3.464 1.00 0.00 C ATOM 304 O ARG A 19 10.229 7.179 4.142 1.00 0.00 O ATOM 305 CB ARG A 19 10.916 9.793 2.192 1.00 0.00 C ATOM 306 CG ARG A 19 12.307 9.877 1.572 1.00 0.00 C ATOM 307 CD ARG A 19 12.271 10.187 0.078 1.00 0.00 C ATOM 308 NE ARG A 19 13.627 10.505 -0.391 1.00 0.00 N ATOM 309 CZ ARG A 19 13.976 10.916 -1.613 1.00 0.00 C ATOM 310 NH1 ARG A 19 13.048 11.194 -2.520 1.00 0.00 N ATOM 311 NH2 ARG A 19 15.260 11.061 -1.916 1.00 0.00 N ATOM 0 H ARG A 19 9.115 9.196 0.526 1.00 0.00 H new ATOM 0 HA ARG A 19 11.016 7.695 1.804 1.00 0.00 H new ATOM 0 HB2 ARG A 19 10.272 10.524 1.703 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.984 10.080 3.241 1.00 0.00 H new ATOM 0 HG2 ARG A 19 12.882 10.648 2.085 1.00 0.00 H new ATOM 0 HG3 ARG A 19 12.828 8.933 1.730 1.00 0.00 H new ATOM 0 HD2 ARG A 19 11.876 9.333 -0.472 1.00 0.00 H new ATOM 0 HD3 ARG A 19 11.603 11.026 -0.114 1.00 0.00 H new ATOM 0 HE ARG A 19 14.381 10.401 0.288 1.00 0.00 H new ATOM 0 HH11 ARG A 19 12.060 11.094 -2.286 1.00 0.00 H new ATOM 0 HH12 ARG A 19 13.323 11.507 -3.451 1.00 0.00 H new ATOM 0 HH21 ARG A 19 15.975 10.859 -1.217 1.00 0.00 H new ATOM 0 HH22 ARG A 19 15.532 11.375 -2.848 1.00 0.00 H new ATOM 325 N ILE A 20 8.584 8.723 3.867 1.00 0.00 N ATOM 326 CA ILE A 20 7.898 8.514 5.134 1.00 0.00 C ATOM 327 C ILE A 20 7.460 7.052 5.218 1.00 0.00 C ATOM 328 O ILE A 20 7.956 6.364 6.102 1.00 0.00 O ATOM 329 CB ILE A 20 6.778 9.569 5.359 1.00 0.00 C ATOM 330 CG1 ILE A 20 7.308 10.814 6.106 1.00 0.00 C ATOM 331 CG2 ILE A 20 5.606 9.030 6.198 1.00 0.00 C ATOM 332 CD1 ILE A 20 8.334 11.648 5.335 1.00 0.00 C ATOM 0 H ILE A 20 8.157 9.455 3.299 1.00 0.00 H new ATOM 0 HA ILE A 20 8.570 8.683 5.975 1.00 0.00 H new ATOM 0 HB ILE A 20 6.436 9.822 4.356 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.462 11.452 6.361 1.00 0.00 H new ATOM 0 HG13 ILE A 20 7.758 10.491 7.045 1.00 0.00 H new ATOM 0 HG21 ILE A 20 4.857 9.812 6.321 1.00 0.00 H new ATOM 0 HG22 ILE A 20 5.159 8.175 5.691 1.00 0.00 H new ATOM 0 HG23 ILE A 20 5.971 8.721 7.177 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.643 12.498 5.944 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.203 11.032 5.103 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.887 12.009 4.409 1.00 0.00 H new ATOM 344 N VAL A 21 6.572 6.556 4.352 1.00 0.00 N ATOM 345 CA VAL A 21 6.011 5.210 4.441 1.00 0.00 C ATOM 346 C VAL A 21 7.126 4.166 4.542 1.00 0.00 C ATOM 347 O VAL A 21 7.055 3.317 5.433 1.00 0.00 O ATOM 348 CB VAL A 21 5.049 4.949 3.260 1.00 0.00 C ATOM 349 CG1 VAL A 21 4.609 3.477 3.180 1.00 0.00 C ATOM 350 CG2 VAL A 21 3.782 5.801 3.394 1.00 0.00 C ATOM 0 H VAL A 21 6.219 7.089 3.557 1.00 0.00 H new ATOM 0 HA VAL A 21 5.422 5.125 5.354 1.00 0.00 H new ATOM 0 HB VAL A 21 5.602 5.211 2.358 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.934 3.344 2.334 1.00 0.00 H new ATOM 0 HG12 VAL A 21 5.485 2.842 3.048 1.00 0.00 H new ATOM 0 HG13 VAL A 21 4.096 3.200 4.101 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.119 5.602 2.552 1.00 0.00 H new ATOM 0 HG22 VAL A 21 3.272 5.551 4.325 1.00 0.00 H new ATOM 0 HG23 VAL A 21 4.053 6.857 3.401 1.00 0.00 H new ATOM 360 N ARG A 22 8.181 4.233 3.713 1.00 0.00 N ATOM 361 CA ARG A 22 9.299 3.301 3.868 1.00 0.00 C ATOM 362 C ARG A 22 9.921 3.447 5.249 1.00 0.00 C ATOM 363 O ARG A 22 10.198 2.439 5.885 1.00 0.00 O ATOM 364 CB ARG A 22 10.373 3.480 2.784 1.00 0.00 C ATOM 365 CG ARG A 22 11.445 2.369 2.894 1.00 0.00 C ATOM 366 CD ARG A 22 12.880 2.875 3.058 1.00 0.00 C ATOM 367 NE ARG A 22 13.380 3.440 1.798 1.00 0.00 N ATOM 368 CZ ARG A 22 14.534 3.159 1.184 1.00 0.00 C ATOM 369 NH1 ARG A 22 15.511 2.502 1.806 1.00 0.00 N ATOM 370 NH2 ARG A 22 14.725 3.550 -0.063 1.00 0.00 N ATOM 0 H ARG A 22 8.279 4.904 2.951 1.00 0.00 H new ATOM 0 HA ARG A 22 8.892 2.296 3.754 1.00 0.00 H new ATOM 0 HB2 ARG A 22 9.911 3.451 1.797 1.00 0.00 H new ATOM 0 HB3 ARG A 22 10.843 4.458 2.887 1.00 0.00 H new ATOM 0 HG2 ARG A 22 11.201 1.731 3.743 1.00 0.00 H new ATOM 0 HG3 ARG A 22 11.394 1.745 2.001 1.00 0.00 H new ATOM 0 HD2 ARG A 22 12.916 3.632 3.841 1.00 0.00 H new ATOM 0 HD3 ARG A 22 13.525 2.056 3.376 1.00 0.00 H new ATOM 0 HE ARG A 22 12.779 4.124 1.339 1.00 0.00 H new ATOM 0 HH11 ARG A 22 15.388 2.201 2.773 1.00 0.00 H new ATOM 0 HH12 ARG A 22 16.382 2.300 1.316 1.00 0.00 H new ATOM 0 HH21 ARG A 22 13.994 4.064 -0.554 1.00 0.00 H new ATOM 0 HH22 ARG A 22 15.604 3.338 -0.535 1.00 0.00 H new ATOM 384 N ASN A 23 10.172 4.664 5.725 1.00 0.00 N ATOM 385 CA ASN A 23 10.797 4.868 7.025 1.00 0.00 C ATOM 386 C ASN A 23 9.944 4.304 8.164 1.00 0.00 C ATOM 387 O ASN A 23 10.487 3.700 9.086 1.00 0.00 O ATOM 388 CB ASN A 23 11.087 6.354 7.249 1.00 0.00 C ATOM 389 CG ASN A 23 12.024 6.535 8.427 1.00 0.00 C ATOM 390 OD1 ASN A 23 13.173 6.097 8.375 1.00 0.00 O ATOM 391 ND2 ASN A 23 11.608 7.210 9.476 1.00 0.00 N ATOM 0 H ASN A 23 9.950 5.526 5.226 1.00 0.00 H new ATOM 0 HA ASN A 23 11.740 4.321 7.027 1.00 0.00 H new ATOM 0 HB2 ASN A 23 11.532 6.784 6.352 1.00 0.00 H new ATOM 0 HB3 ASN A 23 10.155 6.890 7.431 1.00 0.00 H new ATOM 0 HD21 ASN A 23 12.240 7.376 10.259 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.653 7.568 9.507 1.00 0.00 H new ATOM 398 N LEU A 24 8.620 4.466 8.085 1.00 0.00 N ATOM 399 CA LEU A 24 7.669 3.913 9.048 1.00 0.00 C ATOM 400 C LEU A 24 7.704 2.383 9.002 1.00 0.00 C ATOM 401 O LEU A 24 7.665 1.730 10.042 1.00 0.00 O ATOM 402 CB LEU A 24 6.240 4.411 8.779 1.00 0.00 C ATOM 403 CG LEU A 24 6.052 5.939 8.795 1.00 0.00 C ATOM 404 CD1 LEU A 24 4.609 6.259 8.412 1.00 0.00 C ATOM 405 CD2 LEU A 24 6.427 6.609 10.117 1.00 0.00 C ATOM 0 H LEU A 24 8.173 4.995 7.336 1.00 0.00 H new ATOM 0 HA LEU A 24 7.964 4.254 10.040 1.00 0.00 H new ATOM 0 HB2 LEU A 24 5.920 4.034 7.807 1.00 0.00 H new ATOM 0 HB3 LEU A 24 5.576 3.974 9.525 1.00 0.00 H new ATOM 0 HG LEU A 24 6.749 6.355 8.067 1.00 0.00 H new ATOM 0 HD11 LEU A 24 4.462 7.339 8.419 1.00 0.00 H new ATOM 0 HD12 LEU A 24 4.403 5.871 7.414 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.931 5.795 9.129 1.00 0.00 H new ATOM 0 HD21 LEU A 24 6.264 7.684 10.039 1.00 0.00 H new ATOM 0 HD22 LEU A 24 5.808 6.205 10.918 1.00 0.00 H new ATOM 0 HD23 LEU A 24 7.477 6.416 10.338 1.00 0.00 H new ATOM 417 N LEU A 25 7.784 1.805 7.799 1.00 0.00 N ATOM 418 CA LEU A 25 7.966 0.371 7.612 1.00 0.00 C ATOM 419 C LEU A 25 9.282 -0.096 8.213 1.00 0.00 C ATOM 420 O LEU A 25 9.299 -1.115 8.894 1.00 0.00 O ATOM 421 CB LEU A 25 7.909 0.007 6.119 1.00 0.00 C ATOM 422 CG LEU A 25 6.473 -0.306 5.688 1.00 0.00 C ATOM 423 CD1 LEU A 25 6.304 -0.098 4.184 1.00 0.00 C ATOM 424 CD2 LEU A 25 6.116 -1.749 6.072 1.00 0.00 C ATOM 0 H LEU A 25 7.723 2.327 6.925 1.00 0.00 H new ATOM 0 HA LEU A 25 7.152 -0.138 8.129 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.300 0.832 5.524 1.00 0.00 H new ATOM 0 HB3 LEU A 25 8.547 -0.855 5.926 1.00 0.00 H new ATOM 0 HG LEU A 25 5.797 0.376 6.203 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.277 -0.326 3.898 1.00 0.00 H new ATOM 0 HD12 LEU A 25 6.529 0.938 3.932 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.985 -0.758 3.647 1.00 0.00 H new ATOM 0 HD21 LEU A 25 5.093 -1.965 5.763 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.799 -2.438 5.574 1.00 0.00 H new ATOM 0 HD23 LEU A 25 6.202 -1.870 7.152 1.00 0.00 H new ATOM 436 N LYS A 26 10.384 0.613 7.974 1.00 0.00 N ATOM 437 CA LYS A 26 11.684 0.211 8.486 1.00 0.00 C ATOM 438 C LYS A 26 11.695 0.230 10.006 1.00 0.00 C ATOM 439 O LYS A 26 12.298 -0.658 10.608 1.00 0.00 O ATOM 440 CB LYS A 26 12.799 1.104 7.931 1.00 0.00 C ATOM 441 CG LYS A 26 13.024 0.909 6.418 1.00 0.00 C ATOM 442 CD LYS A 26 14.510 0.866 6.058 1.00 0.00 C ATOM 443 CE LYS A 26 15.131 -0.441 6.552 1.00 0.00 C ATOM 444 NZ LYS A 26 16.595 -0.436 6.413 1.00 0.00 N ATOM 0 H LYS A 26 10.397 1.473 7.425 1.00 0.00 H new ATOM 0 HA LYS A 26 11.871 -0.810 8.152 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.553 2.148 8.125 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.727 0.891 8.462 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.547 -0.017 6.097 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.543 1.721 5.873 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.634 0.951 4.978 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.026 1.715 6.506 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.866 -0.597 7.598 1.00 0.00 H new ATOM 0 HE3 LYS A 26 14.715 -1.277 5.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 16.988 -1.294 6.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.848 -0.414 5.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 16.986 0.404 6.886 1.00 0.00 H new ATOM 458 N GLU A 27 11.061 1.217 10.644 1.00 0.00 N ATOM 459 CA GLU A 27 11.204 1.368 12.085 1.00 0.00 C ATOM 460 C GLU A 27 10.479 0.279 12.893 1.00 0.00 C ATOM 461 O GLU A 27 10.730 0.189 14.095 1.00 0.00 O ATOM 462 CB GLU A 27 10.857 2.798 12.543 1.00 0.00 C ATOM 463 CG GLU A 27 9.370 3.155 12.577 1.00 0.00 C ATOM 464 CD GLU A 27 9.135 4.424 13.394 1.00 0.00 C ATOM 465 OE1 GLU A 27 9.161 4.319 14.644 1.00 0.00 O ATOM 466 OE2 GLU A 27 8.952 5.529 12.831 1.00 0.00 O ATOM 0 H GLU A 27 10.458 1.906 10.194 1.00 0.00 H new ATOM 0 HA GLU A 27 12.260 1.214 12.307 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.268 2.947 13.542 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.363 3.502 11.882 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.003 3.298 11.561 1.00 0.00 H new ATOM 0 HG3 GLU A 27 8.803 2.330 13.008 1.00 0.00 H new ATOM 473 N LEU A 28 9.587 -0.541 12.310 1.00 0.00 N ATOM 474 CA LEU A 28 8.894 -1.611 13.054 1.00 0.00 C ATOM 475 C LEU A 28 8.275 -2.731 12.199 1.00 0.00 C ATOM 476 O LEU A 28 7.452 -3.504 12.701 1.00 0.00 O ATOM 477 CB LEU A 28 7.862 -1.004 14.024 1.00 0.00 C ATOM 478 CG LEU A 28 6.813 -0.046 13.433 1.00 0.00 C ATOM 479 CD1 LEU A 28 5.807 -0.719 12.495 1.00 0.00 C ATOM 480 CD2 LEU A 28 6.101 0.592 14.628 1.00 0.00 C ATOM 0 H LEU A 28 9.328 -0.484 11.325 1.00 0.00 H new ATOM 0 HA LEU A 28 9.678 -2.120 13.614 1.00 0.00 H new ATOM 0 HB2 LEU A 28 7.333 -1.824 14.510 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.406 -0.469 14.803 1.00 0.00 H new ATOM 0 HG LEU A 28 7.315 0.689 12.804 1.00 0.00 H new ATOM 0 HD11 LEU A 28 5.103 0.025 12.122 1.00 0.00 H new ATOM 0 HD12 LEU A 28 6.337 -1.170 11.656 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.264 -1.492 13.038 1.00 0.00 H new ATOM 0 HD21 LEU A 28 5.340 1.286 14.270 1.00 0.00 H new ATOM 0 HD22 LEU A 28 5.629 -0.186 15.228 1.00 0.00 H new ATOM 0 HD23 LEU A 28 6.826 1.131 15.238 1.00 0.00 H new ATOM 492 N GLY A 29 8.626 -2.828 10.918 1.00 0.00 N ATOM 493 CA GLY A 29 8.034 -3.758 9.968 1.00 0.00 C ATOM 494 C GLY A 29 9.107 -4.474 9.156 1.00 0.00 C ATOM 495 O GLY A 29 9.555 -5.551 9.559 1.00 0.00 O ATOM 0 H GLY A 29 9.352 -2.243 10.504 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.428 -4.491 10.501 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.365 -3.220 9.297 1.00 0.00 H new ATOM 499 N PHE A 30 9.490 -3.912 8.007 1.00 0.00 N ATOM 500 CA PHE A 30 10.149 -4.647 6.930 1.00 0.00 C ATOM 501 C PHE A 30 11.143 -3.787 6.146 1.00 0.00 C ATOM 502 O PHE A 30 11.261 -2.577 6.342 1.00 0.00 O ATOM 503 CB PHE A 30 9.076 -5.198 5.972 1.00 0.00 C ATOM 504 CG PHE A 30 8.181 -6.266 6.561 1.00 0.00 C ATOM 505 CD1 PHE A 30 8.643 -7.593 6.658 1.00 0.00 C ATOM 506 CD2 PHE A 30 6.879 -5.945 6.986 1.00 0.00 C ATOM 507 CE1 PHE A 30 7.801 -8.595 7.172 1.00 0.00 C ATOM 508 CE2 PHE A 30 6.032 -6.952 7.476 1.00 0.00 C ATOM 509 CZ PHE A 30 6.494 -8.277 7.578 1.00 0.00 C ATOM 0 H PHE A 30 9.349 -2.924 7.798 1.00 0.00 H new ATOM 0 HA PHE A 30 10.719 -5.457 7.385 1.00 0.00 H new ATOM 0 HB2 PHE A 30 8.454 -4.370 5.633 1.00 0.00 H new ATOM 0 HB3 PHE A 30 9.572 -5.606 5.091 1.00 0.00 H new ATOM 0 HD1 PHE A 30 9.644 -7.841 6.338 1.00 0.00 H new ATOM 0 HD2 PHE A 30 6.531 -4.924 6.935 1.00 0.00 H new ATOM 0 HE1 PHE A 30 8.159 -9.610 7.255 1.00 0.00 H new ATOM 0 HE2 PHE A 30 5.023 -6.709 7.775 1.00 0.00 H new ATOM 0 HZ PHE A 30 5.846 -9.048 7.967 1.00 0.00 H new ATOM 519 N ASN A 31 11.834 -4.447 5.216 1.00 0.00 N ATOM 520 CA ASN A 31 12.811 -3.923 4.273 1.00 0.00 C ATOM 521 C ASN A 31 12.314 -4.165 2.848 1.00 0.00 C ATOM 522 O ASN A 31 11.405 -4.970 2.639 1.00 0.00 O ATOM 523 CB ASN A 31 14.142 -4.674 4.458 1.00 0.00 C ATOM 524 CG ASN A 31 14.864 -4.273 5.730 1.00 0.00 C ATOM 525 OD1 ASN A 31 14.497 -4.681 6.826 1.00 0.00 O ATOM 526 ND2 ASN A 31 15.890 -3.459 5.611 1.00 0.00 N ATOM 0 H ASN A 31 11.710 -5.452 5.097 1.00 0.00 H new ATOM 0 HA ASN A 31 12.951 -2.856 4.447 1.00 0.00 H new ATOM 0 HB2 ASN A 31 13.950 -5.747 4.476 1.00 0.00 H new ATOM 0 HB3 ASN A 31 14.787 -4.479 3.601 1.00 0.00 H new ATOM 0 HD21 ASN A 31 16.398 -3.154 6.441 1.00 0.00 H new ATOM 0 HD22 ASN A 31 16.178 -3.132 4.688 1.00 0.00 H new ATOM 533 N ASN A 32 13.023 -3.583 1.877 1.00 0.00 N ATOM 534 CA ASN A 32 12.943 -3.809 0.431 1.00 0.00 C ATOM 535 C ASN A 32 11.746 -3.130 -0.217 1.00 0.00 C ATOM 536 O ASN A 32 10.639 -3.662 -0.178 1.00 0.00 O ATOM 537 CB ASN A 32 13.053 -5.299 0.017 1.00 0.00 C ATOM 538 CG ASN A 32 13.988 -5.485 -1.172 1.00 0.00 C ATOM 539 OD1 ASN A 32 14.968 -4.756 -1.317 1.00 0.00 O ATOM 540 ND2 ASN A 32 13.753 -6.467 -2.021 1.00 0.00 N ATOM 0 H ASN A 32 13.728 -2.881 2.102 1.00 0.00 H new ATOM 0 HA ASN A 32 13.835 -3.323 0.035 1.00 0.00 H new ATOM 0 HB2 ASN A 32 13.416 -5.886 0.861 1.00 0.00 H new ATOM 0 HB3 ASN A 32 12.064 -5.681 -0.235 1.00 0.00 H new ATOM 0 HD21 ASN A 32 14.386 -6.626 -2.805 1.00 0.00 H new ATOM 0 HD22 ASN A 32 12.938 -7.067 -1.894 1.00 0.00 H new ATOM 547 N VAL A 33 11.962 -1.966 -0.834 1.00 0.00 N ATOM 548 CA VAL A 33 10.894 -1.200 -1.466 1.00 0.00 C ATOM 549 C VAL A 33 11.143 -0.971 -2.953 1.00 0.00 C ATOM 550 O VAL A 33 12.288 -0.912 -3.416 1.00 0.00 O ATOM 551 CB VAL A 33 10.654 0.142 -0.744 1.00 0.00 C ATOM 552 CG1 VAL A 33 9.883 -0.077 0.564 1.00 0.00 C ATOM 553 CG2 VAL A 33 11.955 0.926 -0.498 1.00 0.00 C ATOM 0 H VAL A 33 12.882 -1.531 -0.908 1.00 0.00 H new ATOM 0 HA VAL A 33 9.991 -1.804 -1.376 1.00 0.00 H new ATOM 0 HB VAL A 33 10.046 0.756 -1.408 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.724 0.882 1.058 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.919 -0.537 0.346 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.457 -0.732 1.219 1.00 0.00 H new ATOM 0 HG21 VAL A 33 11.725 1.861 0.013 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.627 0.331 0.120 1.00 0.00 H new ATOM 0 HG23 VAL A 33 12.435 1.142 -1.452 1.00 0.00 H new ATOM 563 N GLU A 34 10.051 -0.769 -3.681 1.00 0.00 N ATOM 564 CA GLU A 34 10.009 -0.112 -4.977 1.00 0.00 C ATOM 565 C GLU A 34 9.043 1.071 -4.815 1.00 0.00 C ATOM 566 O GLU A 34 8.060 0.976 -4.073 1.00 0.00 O ATOM 567 CB GLU A 34 9.579 -1.114 -6.061 1.00 0.00 C ATOM 568 CG GLU A 34 10.753 -1.962 -6.587 1.00 0.00 C ATOM 569 CD GLU A 34 11.461 -1.358 -7.806 1.00 0.00 C ATOM 570 OE1 GLU A 34 11.586 -0.118 -7.895 1.00 0.00 O ATOM 571 OE2 GLU A 34 11.857 -2.136 -8.709 1.00 0.00 O ATOM 0 H GLU A 34 9.130 -1.074 -3.367 1.00 0.00 H new ATOM 0 HA GLU A 34 10.982 0.257 -5.300 1.00 0.00 H new ATOM 0 HB2 GLU A 34 8.812 -1.774 -5.656 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.127 -0.572 -6.892 1.00 0.00 H new ATOM 0 HG2 GLU A 34 11.480 -2.094 -5.786 1.00 0.00 H new ATOM 0 HG3 GLU A 34 10.383 -2.953 -6.849 1.00 0.00 H new ATOM 578 N GLU A 35 9.315 2.182 -5.500 1.00 0.00 N ATOM 579 CA GLU A 35 8.539 3.417 -5.436 1.00 0.00 C ATOM 580 C GLU A 35 8.025 3.687 -6.849 1.00 0.00 C ATOM 581 O GLU A 35 8.775 4.210 -7.684 1.00 0.00 O ATOM 582 CB GLU A 35 9.398 4.575 -4.879 1.00 0.00 C ATOM 583 CG GLU A 35 9.753 4.427 -3.387 1.00 0.00 C ATOM 584 CD GLU A 35 10.719 5.516 -2.888 1.00 0.00 C ATOM 585 OE1 GLU A 35 11.759 5.775 -3.537 1.00 0.00 O ATOM 586 OE2 GLU A 35 10.541 6.068 -1.781 1.00 0.00 O ATOM 0 H GLU A 35 10.110 2.247 -6.136 1.00 0.00 H new ATOM 0 HA GLU A 35 7.695 3.327 -4.752 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.320 4.641 -5.457 1.00 0.00 H new ATOM 0 HB3 GLU A 35 8.863 5.514 -5.024 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.838 4.463 -2.796 1.00 0.00 H new ATOM 0 HG3 GLU A 35 10.202 3.447 -3.221 1.00 0.00 H new ATOM 593 N ALA A 36 6.804 3.239 -7.164 1.00 0.00 N ATOM 594 CA ALA A 36 6.283 3.310 -8.529 1.00 0.00 C ATOM 595 C ALA A 36 5.848 4.730 -8.877 1.00 0.00 C ATOM 596 O ALA A 36 5.632 5.574 -8.003 1.00 0.00 O ATOM 597 CB ALA A 36 5.099 2.360 -8.731 1.00 0.00 C ATOM 0 H ALA A 36 6.160 2.824 -6.490 1.00 0.00 H new ATOM 0 HA ALA A 36 7.094 3.007 -9.191 1.00 0.00 H new ATOM 0 HB1 ALA A 36 4.739 2.440 -9.757 1.00 0.00 H new ATOM 0 HB2 ALA A 36 5.417 1.336 -8.538 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.297 2.627 -8.043 1.00 0.00 H new ATOM 603 N GLU A 37 5.685 4.984 -10.167 1.00 0.00 N ATOM 604 CA GLU A 37 5.307 6.273 -10.702 1.00 0.00 C ATOM 605 C GLU A 37 3.819 6.552 -10.481 1.00 0.00 C ATOM 606 O GLU A 37 3.438 7.710 -10.326 1.00 0.00 O ATOM 607 CB GLU A 37 5.628 6.252 -12.200 1.00 0.00 C ATOM 608 CG GLU A 37 7.093 5.874 -12.481 1.00 0.00 C ATOM 609 CD GLU A 37 8.017 7.085 -12.466 1.00 0.00 C ATOM 610 OE1 GLU A 37 8.433 7.521 -11.370 1.00 0.00 O ATOM 611 OE2 GLU A 37 8.406 7.582 -13.548 1.00 0.00 O ATOM 0 H GLU A 37 5.817 4.274 -10.887 1.00 0.00 H new ATOM 0 HA GLU A 37 5.857 7.065 -10.194 1.00 0.00 H new ATOM 0 HB2 GLU A 37 4.970 5.541 -12.700 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.420 7.233 -12.627 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.429 5.154 -11.735 1.00 0.00 H new ATOM 0 HG3 GLU A 37 7.159 5.382 -13.451 1.00 0.00 H new ATOM 618 N ASP A 38 2.982 5.512 -10.509 1.00 0.00 N ATOM 619 CA ASP A 38 1.527 5.599 -10.654 1.00 0.00 C ATOM 620 C ASP A 38 0.969 4.176 -10.568 1.00 0.00 C ATOM 621 O ASP A 38 1.722 3.230 -10.777 1.00 0.00 O ATOM 622 CB ASP A 38 1.232 6.211 -12.036 1.00 0.00 C ATOM 623 CG ASP A 38 -0.137 5.843 -12.602 1.00 0.00 C ATOM 624 OD1 ASP A 38 -1.181 6.209 -12.026 1.00 0.00 O ATOM 625 OD2 ASP A 38 -0.142 5.155 -13.643 1.00 0.00 O ATOM 0 H ASP A 38 3.312 4.550 -10.428 1.00 0.00 H new ATOM 0 HA ASP A 38 1.071 6.216 -9.880 1.00 0.00 H new ATOM 0 HB2 ASP A 38 1.303 7.296 -11.963 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.002 5.887 -12.737 1.00 0.00 H new ATOM 630 N GLY A 39 -0.320 3.987 -10.290 1.00 0.00 N ATOM 631 CA GLY A 39 -0.998 2.692 -10.322 1.00 0.00 C ATOM 632 C GLY A 39 -0.710 1.834 -11.565 1.00 0.00 C ATOM 633 O GLY A 39 -0.516 0.626 -11.429 1.00 0.00 O ATOM 0 H GLY A 39 -0.940 4.754 -10.028 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -0.710 2.127 -9.435 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.073 2.861 -10.258 1.00 0.00 H new ATOM 637 N VAL A 40 -0.637 2.403 -12.775 1.00 0.00 N ATOM 638 CA VAL A 40 -0.365 1.605 -13.976 1.00 0.00 C ATOM 639 C VAL A 40 1.056 1.030 -13.885 1.00 0.00 C ATOM 640 O VAL A 40 1.289 -0.130 -14.245 1.00 0.00 O ATOM 641 CB VAL A 40 -0.568 2.454 -15.253 1.00 0.00 C ATOM 642 CG1 VAL A 40 -0.407 1.608 -16.521 1.00 0.00 C ATOM 643 CG2 VAL A 40 -1.961 3.106 -15.312 1.00 0.00 C ATOM 0 H VAL A 40 -0.761 3.401 -12.947 1.00 0.00 H new ATOM 0 HA VAL A 40 -1.069 0.775 -14.036 1.00 0.00 H new ATOM 0 HB VAL A 40 0.197 3.229 -15.207 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.556 2.236 -17.399 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.595 1.179 -16.548 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.145 0.806 -16.519 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.051 3.690 -16.228 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -2.727 2.330 -15.300 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.093 3.760 -14.450 1.00 0.00 H new ATOM 653 N ASP A 41 1.998 1.834 -13.379 1.00 0.00 N ATOM 654 CA ASP A 41 3.367 1.417 -13.102 1.00 0.00 C ATOM 655 C ASP A 41 3.421 0.474 -11.896 1.00 0.00 C ATOM 656 O ASP A 41 4.270 -0.412 -11.839 1.00 0.00 O ATOM 657 CB ASP A 41 4.255 2.639 -12.842 1.00 0.00 C ATOM 658 CG ASP A 41 5.720 2.233 -12.687 1.00 0.00 C ATOM 659 OD1 ASP A 41 6.236 1.434 -13.498 1.00 0.00 O ATOM 660 OD2 ASP A 41 6.377 2.720 -11.741 1.00 0.00 O ATOM 0 H ASP A 41 1.821 2.812 -13.148 1.00 0.00 H new ATOM 0 HA ASP A 41 3.737 0.883 -13.977 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.156 3.346 -13.666 1.00 0.00 H new ATOM 0 HB3 ASP A 41 3.919 3.151 -11.940 1.00 0.00 H new ATOM 665 N ALA A 42 2.501 0.607 -10.936 1.00 0.00 N ATOM 666 CA ALA A 42 2.418 -0.269 -9.795 1.00 0.00 C ATOM 667 C ALA A 42 2.156 -1.689 -10.267 1.00 0.00 C ATOM 668 O ALA A 42 2.900 -2.594 -9.904 1.00 0.00 O ATOM 669 CB ALA A 42 1.330 0.215 -8.830 1.00 0.00 C ATOM 0 H ALA A 42 1.791 1.339 -10.942 1.00 0.00 H new ATOM 0 HA ALA A 42 3.363 -0.256 -9.253 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.279 -0.457 -7.973 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.569 1.222 -8.488 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.368 0.224 -9.342 1.00 0.00 H new ATOM 675 N LEU A 43 1.136 -1.874 -11.109 1.00 0.00 N ATOM 676 CA LEU A 43 0.756 -3.166 -11.669 1.00 0.00 C ATOM 677 C LEU A 43 1.920 -3.795 -12.452 1.00 0.00 C ATOM 678 O LEU A 43 2.183 -5.002 -12.355 1.00 0.00 O ATOM 679 CB LEU A 43 -0.482 -2.972 -12.556 1.00 0.00 C ATOM 680 CG LEU A 43 -1.372 -4.226 -12.561 1.00 0.00 C ATOM 681 CD1 LEU A 43 -2.319 -4.244 -11.356 1.00 0.00 C ATOM 682 CD2 LEU A 43 -2.198 -4.240 -13.844 1.00 0.00 C ATOM 0 H LEU A 43 0.540 -1.109 -11.425 1.00 0.00 H new ATOM 0 HA LEU A 43 0.514 -3.858 -10.862 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -1.057 -2.118 -12.199 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -0.169 -2.742 -13.575 1.00 0.00 H new ATOM 0 HG LEU A 43 -0.730 -5.105 -12.504 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -2.934 -5.143 -11.390 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -1.736 -4.237 -10.435 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.961 -3.364 -11.385 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.833 -5.126 -13.858 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -2.820 -3.346 -13.886 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -1.531 -4.258 -14.706 1.00 0.00 H new ATOM 694 N ASN A 44 2.637 -2.962 -13.216 1.00 0.00 N ATOM 695 CA ASN A 44 3.873 -3.332 -13.902 1.00 0.00 C ATOM 696 C ASN A 44 4.897 -3.864 -12.899 1.00 0.00 C ATOM 697 O ASN A 44 5.431 -4.953 -13.111 1.00 0.00 O ATOM 698 CB ASN A 44 4.414 -2.134 -14.698 1.00 0.00 C ATOM 699 CG ASN A 44 5.812 -2.360 -15.262 1.00 0.00 C ATOM 700 OD1 ASN A 44 6.790 -2.488 -14.527 1.00 0.00 O ATOM 701 ND2 ASN A 44 5.970 -2.325 -16.566 1.00 0.00 N ATOM 0 H ASN A 44 2.365 -1.992 -13.376 1.00 0.00 H new ATOM 0 HA ASN A 44 3.667 -4.133 -14.612 1.00 0.00 H new ATOM 0 HB2 ASN A 44 3.731 -1.915 -15.519 1.00 0.00 H new ATOM 0 HB3 ASN A 44 4.429 -1.256 -14.052 1.00 0.00 H new ATOM 0 HD21 ASN A 44 6.904 -2.404 -16.969 1.00 0.00 H new ATOM 0 HD22 ASN A 44 5.159 -2.219 -17.175 1.00 0.00 H new ATOM 708 N LYS A 45 5.156 -3.132 -11.806 1.00 0.00 N ATOM 709 CA LYS A 45 6.034 -3.586 -10.729 1.00 0.00 C ATOM 710 C LYS A 45 5.566 -4.943 -10.206 1.00 0.00 C ATOM 711 O LYS A 45 6.400 -5.838 -10.131 1.00 0.00 O ATOM 712 CB LYS A 45 6.149 -2.543 -9.597 1.00 0.00 C ATOM 713 CG LYS A 45 7.401 -1.652 -9.679 1.00 0.00 C ATOM 714 CD LYS A 45 7.365 -0.618 -10.812 1.00 0.00 C ATOM 715 CE LYS A 45 8.630 0.254 -10.788 1.00 0.00 C ATOM 716 NZ LYS A 45 8.655 1.208 -11.912 1.00 0.00 N ATOM 0 H LYS A 45 4.759 -2.206 -11.648 1.00 0.00 H new ATOM 0 HA LYS A 45 7.038 -3.704 -11.138 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.264 -1.907 -9.614 1.00 0.00 H new ATOM 0 HB3 LYS A 45 6.150 -3.063 -8.639 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.524 -1.130 -8.730 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.277 -2.287 -9.810 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.285 -1.126 -11.773 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.481 0.011 -10.710 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.678 0.800 -9.846 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.513 -0.384 -10.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.628 1.545 -12.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 8.317 0.737 -12.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.038 2.017 -11.695 1.00 0.00 H new ATOM 730 N LEU A 46 4.276 -5.130 -9.878 1.00 0.00 N ATOM 731 CA LEU A 46 3.778 -6.407 -9.339 1.00 0.00 C ATOM 732 C LEU A 46 4.170 -7.551 -10.267 1.00 0.00 C ATOM 733 O LEU A 46 4.641 -8.586 -9.804 1.00 0.00 O ATOM 734 CB LEU A 46 2.247 -6.462 -9.130 1.00 0.00 C ATOM 735 CG LEU A 46 1.591 -5.238 -8.503 1.00 0.00 C ATOM 736 CD1 LEU A 46 0.107 -5.506 -8.299 1.00 0.00 C ATOM 737 CD2 LEU A 46 2.224 -4.765 -7.195 1.00 0.00 C ATOM 0 H LEU A 46 3.559 -4.412 -9.977 1.00 0.00 H new ATOM 0 HA LEU A 46 4.240 -6.502 -8.356 1.00 0.00 H new ATOM 0 HB2 LEU A 46 1.779 -6.639 -10.098 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.021 -7.326 -8.504 1.00 0.00 H new ATOM 0 HG LEU A 46 1.750 -4.422 -9.208 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.363 -4.631 -7.850 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -0.360 -5.716 -9.261 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.020 -6.364 -7.639 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.688 -3.890 -6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.168 -5.563 -6.454 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.268 -4.504 -7.369 1.00 0.00 H new ATOM 749 N GLN A 47 4.008 -7.342 -11.576 1.00 0.00 N ATOM 750 CA GLN A 47 4.338 -8.320 -12.610 1.00 0.00 C ATOM 751 C GLN A 47 5.847 -8.582 -12.799 1.00 0.00 C ATOM 752 O GLN A 47 6.222 -9.251 -13.763 1.00 0.00 O ATOM 753 CB GLN A 47 3.645 -7.893 -13.912 1.00 0.00 C ATOM 754 CG GLN A 47 2.133 -8.116 -13.795 1.00 0.00 C ATOM 755 CD GLN A 47 1.407 -7.582 -15.022 1.00 0.00 C ATOM 756 OE1 GLN A 47 1.220 -8.296 -16.010 1.00 0.00 O ATOM 757 NE2 GLN A 47 1.019 -6.318 -14.983 1.00 0.00 N ATOM 0 H GLN A 47 3.636 -6.470 -11.952 1.00 0.00 H new ATOM 0 HA GLN A 47 3.963 -9.290 -12.282 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.852 -6.843 -14.117 1.00 0.00 H new ATOM 0 HB3 GLN A 47 4.042 -8.465 -14.750 1.00 0.00 H new ATOM 0 HG2 GLN A 47 1.926 -9.180 -13.680 1.00 0.00 H new ATOM 0 HG3 GLN A 47 1.757 -7.620 -12.900 1.00 0.00 H new ATOM 0 HE21 GLN A 47 1.191 -5.757 -14.148 1.00 0.00 H new ATOM 0 HE22 GLN A 47 0.548 -5.904 -15.788 1.00 0.00 H new ATOM 766 N ALA A 48 6.724 -8.101 -11.914 1.00 0.00 N ATOM 767 CA ALA A 48 8.101 -8.591 -11.796 1.00 0.00 C ATOM 768 C ALA A 48 8.255 -9.681 -10.721 1.00 0.00 C ATOM 769 O ALA A 48 9.341 -10.259 -10.591 1.00 0.00 O ATOM 770 CB ALA A 48 9.045 -7.423 -11.517 1.00 0.00 C ATOM 0 H ALA A 48 6.498 -7.356 -11.255 1.00 0.00 H new ATOM 0 HA ALA A 48 8.363 -9.055 -12.747 1.00 0.00 H new ATOM 0 HB1 ALA A 48 10.066 -7.793 -11.430 1.00 0.00 H new ATOM 0 HB2 ALA A 48 8.987 -6.705 -12.335 1.00 0.00 H new ATOM 0 HB3 ALA A 48 8.756 -6.936 -10.586 1.00 0.00 H new ATOM 776 N GLY A 49 7.196 -9.984 -9.968 1.00 0.00 N ATOM 777 CA GLY A 49 7.123 -11.094 -9.030 1.00 0.00 C ATOM 778 C GLY A 49 7.924 -10.862 -7.751 1.00 0.00 C ATOM 779 O GLY A 49 8.788 -9.983 -7.658 1.00 0.00 O ATOM 0 H GLY A 49 6.335 -9.439 -10.000 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.080 -11.271 -8.769 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.487 -11.998 -9.519 1.00 0.00 H new ATOM 783 N GLY A 50 7.628 -11.659 -6.723 1.00 0.00 N ATOM 784 CA GLY A 50 8.225 -11.499 -5.403 1.00 0.00 C ATOM 785 C GLY A 50 7.742 -10.227 -4.697 1.00 0.00 C ATOM 786 O GLY A 50 8.463 -9.680 -3.862 1.00 0.00 O ATOM 0 H GLY A 50 6.967 -12.433 -6.786 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.983 -12.367 -4.789 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.310 -11.469 -5.499 1.00 0.00 H new ATOM 790 N TYR A 51 6.580 -9.691 -5.074 1.00 0.00 N ATOM 791 CA TYR A 51 5.908 -8.605 -4.364 1.00 0.00 C ATOM 792 C TYR A 51 4.967 -9.223 -3.345 1.00 0.00 C ATOM 793 O TYR A 51 4.512 -10.357 -3.529 1.00 0.00 O ATOM 794 CB TYR A 51 5.138 -7.709 -5.350 1.00 0.00 C ATOM 795 CG TYR A 51 6.076 -6.849 -6.169 1.00 0.00 C ATOM 796 CD1 TYR A 51 6.858 -7.448 -7.167 1.00 0.00 C ATOM 797 CD2 TYR A 51 6.266 -5.491 -5.853 1.00 0.00 C ATOM 798 CE1 TYR A 51 7.889 -6.735 -7.785 1.00 0.00 C ATOM 799 CE2 TYR A 51 7.258 -4.747 -6.518 1.00 0.00 C ATOM 800 CZ TYR A 51 8.078 -5.372 -7.485 1.00 0.00 C ATOM 801 OH TYR A 51 9.058 -4.684 -8.129 1.00 0.00 O ATOM 0 H TYR A 51 6.070 -10.007 -5.899 1.00 0.00 H new ATOM 0 HA TYR A 51 6.640 -7.975 -3.859 1.00 0.00 H new ATOM 0 HB2 TYR A 51 4.538 -8.330 -6.015 1.00 0.00 H new ATOM 0 HB3 TYR A 51 4.446 -7.072 -4.799 1.00 0.00 H new ATOM 0 HD1 TYR A 51 6.662 -8.469 -7.460 1.00 0.00 H new ATOM 0 HD2 TYR A 51 5.651 -5.020 -5.101 1.00 0.00 H new ATOM 0 HE1 TYR A 51 8.540 -7.229 -8.492 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.393 -3.700 -6.290 1.00 0.00 H new ATOM 0 HH TYR A 51 8.800 -3.742 -8.205 1.00 0.00 H new ATOM 811 N GLY A 52 4.620 -8.485 -2.293 1.00 0.00 N ATOM 812 CA GLY A 52 3.645 -8.972 -1.329 1.00 0.00 C ATOM 813 C GLY A 52 3.000 -7.881 -0.488 1.00 0.00 C ATOM 814 O GLY A 52 2.299 -8.213 0.460 1.00 0.00 O ATOM 0 H GLY A 52 4.996 -7.559 -2.090 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.864 -9.514 -1.862 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.133 -9.686 -0.665 1.00 0.00 H new ATOM 818 N PHE A 53 3.216 -6.608 -0.818 1.00 0.00 N ATOM 819 CA PHE A 53 2.546 -5.466 -0.214 1.00 0.00 C ATOM 820 C PHE A 53 2.424 -4.398 -1.282 1.00 0.00 C ATOM 821 O PHE A 53 3.408 -4.129 -1.975 1.00 0.00 O ATOM 822 CB PHE A 53 3.360 -4.933 0.965 1.00 0.00 C ATOM 823 CG PHE A 53 2.769 -5.324 2.294 1.00 0.00 C ATOM 824 CD1 PHE A 53 1.829 -4.477 2.906 1.00 0.00 C ATOM 825 CD2 PHE A 53 3.178 -6.506 2.935 1.00 0.00 C ATOM 826 CE1 PHE A 53 1.322 -4.799 4.172 1.00 0.00 C ATOM 827 CE2 PHE A 53 2.655 -6.841 4.193 1.00 0.00 C ATOM 828 CZ PHE A 53 1.725 -5.989 4.811 1.00 0.00 C ATOM 0 H PHE A 53 3.886 -6.339 -1.538 1.00 0.00 H new ATOM 0 HA PHE A 53 1.564 -5.755 0.161 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.380 -5.311 0.899 1.00 0.00 H new ATOM 0 HB3 PHE A 53 3.418 -3.846 0.902 1.00 0.00 H new ATOM 0 HD1 PHE A 53 1.499 -3.581 2.402 1.00 0.00 H new ATOM 0 HD2 PHE A 53 3.896 -7.157 2.459 1.00 0.00 H new ATOM 0 HE1 PHE A 53 0.622 -4.135 4.658 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.966 -7.751 4.684 1.00 0.00 H new ATOM 0 HZ PHE A 53 1.318 -6.246 5.778 1.00 0.00 H new ATOM 838 N VAL A 54 1.233 -3.817 -1.430 1.00 0.00 N ATOM 839 CA VAL A 54 0.929 -2.915 -2.535 1.00 0.00 C ATOM 840 C VAL A 54 0.235 -1.681 -1.960 1.00 0.00 C ATOM 841 O VAL A 54 -0.981 -1.620 -1.810 1.00 0.00 O ATOM 842 CB VAL A 54 0.167 -3.670 -3.646 1.00 0.00 C ATOM 843 CG1 VAL A 54 0.135 -2.870 -4.946 1.00 0.00 C ATOM 844 CG2 VAL A 54 0.864 -4.995 -3.981 1.00 0.00 C ATOM 0 H VAL A 54 0.454 -3.960 -0.787 1.00 0.00 H new ATOM 0 HA VAL A 54 1.825 -2.551 -3.038 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.841 -3.832 -3.265 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.409 -3.432 -5.705 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.363 -1.916 -4.774 1.00 0.00 H new ATOM 0 HG13 VAL A 54 1.154 -2.691 -5.288 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.310 -5.509 -4.766 1.00 0.00 H new ATOM 0 HG22 VAL A 54 1.879 -4.795 -4.325 1.00 0.00 H new ATOM 0 HG23 VAL A 54 0.899 -5.623 -3.091 1.00 0.00 H new ATOM 854 N ILE A 55 1.048 -0.731 -1.534 1.00 0.00 N ATOM 855 CA ILE A 55 0.667 0.456 -0.797 1.00 0.00 C ATOM 856 C ILE A 55 0.561 1.582 -1.827 1.00 0.00 C ATOM 857 O ILE A 55 1.430 1.699 -2.696 1.00 0.00 O ATOM 858 CB ILE A 55 1.664 0.653 0.383 1.00 0.00 C ATOM 859 CG1 ILE A 55 1.994 -0.714 1.061 1.00 0.00 C ATOM 860 CG2 ILE A 55 1.141 1.684 1.387 1.00 0.00 C ATOM 861 CD1 ILE A 55 2.791 -0.685 2.367 1.00 0.00 C ATOM 0 H ILE A 55 2.053 -0.772 -1.705 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.303 0.406 -0.303 1.00 0.00 H new ATOM 0 HB ILE A 55 2.596 1.051 -0.019 1.00 0.00 H new ATOM 0 HG12 ILE A 55 1.053 -1.229 1.254 1.00 0.00 H new ATOM 0 HG13 ILE A 55 2.548 -1.320 0.343 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.860 1.799 2.198 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.003 2.642 0.886 1.00 0.00 H new ATOM 0 HG23 ILE A 55 0.187 1.346 1.792 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.945 -1.704 2.722 1.00 0.00 H new ATOM 0 HD12 ILE A 55 3.757 -0.211 2.193 1.00 0.00 H new ATOM 0 HD13 ILE A 55 2.239 -0.119 3.118 1.00 0.00 H new ATOM 873 N SER A 56 -0.532 2.352 -1.809 1.00 0.00 N ATOM 874 CA SER A 56 -0.855 3.284 -2.890 1.00 0.00 C ATOM 875 C SER A 56 -1.672 4.464 -2.365 1.00 0.00 C ATOM 876 O SER A 56 -2.533 4.249 -1.504 1.00 0.00 O ATOM 877 CB SER A 56 -1.660 2.516 -3.956 1.00 0.00 C ATOM 878 OG SER A 56 -2.767 1.832 -3.384 1.00 0.00 O ATOM 0 H SER A 56 -1.213 2.346 -1.049 1.00 0.00 H new ATOM 0 HA SER A 56 0.064 3.683 -3.319 1.00 0.00 H new ATOM 0 HB2 SER A 56 -2.015 3.212 -4.716 1.00 0.00 H new ATOM 0 HB3 SER A 56 -1.009 1.800 -4.458 1.00 0.00 H new ATOM 0 HG SER A 56 -3.257 1.357 -4.087 1.00 0.00 H new ATOM 884 N ASP A 57 -1.476 5.664 -2.926 1.00 0.00 N ATOM 885 CA ASP A 57 -2.472 6.727 -2.759 1.00 0.00 C ATOM 886 C ASP A 57 -3.742 6.361 -3.527 1.00 0.00 C ATOM 887 O ASP A 57 -3.742 5.508 -4.419 1.00 0.00 O ATOM 888 CB ASP A 57 -1.941 8.120 -3.154 1.00 0.00 C ATOM 889 CG ASP A 57 -2.668 9.259 -2.416 1.00 0.00 C ATOM 890 OD1 ASP A 57 -3.886 9.470 -2.633 1.00 0.00 O ATOM 891 OD2 ASP A 57 -2.037 9.947 -1.591 1.00 0.00 O ATOM 0 H ASP A 57 -0.661 5.918 -3.484 1.00 0.00 H new ATOM 0 HA ASP A 57 -2.707 6.801 -1.697 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -0.874 8.174 -2.937 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -2.055 8.257 -4.229 1.00 0.00 H new ATOM 896 N TRP A 58 -4.837 7.023 -3.182 1.00 0.00 N ATOM 897 CA TRP A 58 -6.056 7.056 -3.953 1.00 0.00 C ATOM 898 C TRP A 58 -5.832 7.872 -5.226 1.00 0.00 C ATOM 899 O TRP A 58 -6.157 7.436 -6.328 1.00 0.00 O ATOM 900 CB TRP A 58 -7.147 7.695 -3.084 1.00 0.00 C ATOM 901 CG TRP A 58 -8.520 7.380 -3.557 1.00 0.00 C ATOM 902 CD1 TRP A 58 -9.176 7.947 -4.593 1.00 0.00 C ATOM 903 CD2 TRP A 58 -9.359 6.285 -3.107 1.00 0.00 C ATOM 904 NE1 TRP A 58 -10.377 7.298 -4.781 1.00 0.00 N ATOM 905 CE2 TRP A 58 -10.554 6.270 -3.879 1.00 0.00 C ATOM 906 CE3 TRP A 58 -9.183 5.268 -2.152 1.00 0.00 C ATOM 907 CZ2 TRP A 58 -11.567 5.322 -3.665 1.00 0.00 C ATOM 908 CZ3 TRP A 58 -10.165 4.289 -1.967 1.00 0.00 C ATOM 909 CH2 TRP A 58 -11.361 4.329 -2.693 1.00 0.00 C ATOM 0 H TRP A 58 -4.895 7.570 -2.323 1.00 0.00 H new ATOM 0 HA TRP A 58 -6.360 6.050 -4.244 1.00 0.00 H new ATOM 0 HB2 TRP A 58 -7.034 7.350 -2.056 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -7.010 8.776 -3.075 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -8.816 8.778 -5.181 1.00 0.00 H new ATOM 0 HE1 TRP A 58 -11.054 7.548 -5.501 1.00 0.00 H new ATOM 0 HE3 TRP A 58 -8.282 5.242 -1.556 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 -12.484 5.355 -4.235 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 -9.998 3.493 -1.256 1.00 0.00 H new ATOM 0 HH2 TRP A 58 -12.129 3.593 -2.505 1.00 0.00 H new ATOM 920 N ASN A 59 -5.328 9.094 -5.053 1.00 0.00 N ATOM 921 CA ASN A 59 -5.238 10.127 -6.071 1.00 0.00 C ATOM 922 C ASN A 59 -4.021 9.847 -6.943 1.00 0.00 C ATOM 923 O ASN A 59 -2.963 10.450 -6.745 1.00 0.00 O ATOM 924 CB ASN A 59 -5.124 11.512 -5.399 1.00 0.00 C ATOM 925 CG ASN A 59 -6.436 12.115 -4.916 1.00 0.00 C ATOM 926 OD1 ASN A 59 -6.545 13.335 -4.841 1.00 0.00 O ATOM 927 ND2 ASN A 59 -7.438 11.325 -4.572 1.00 0.00 N ATOM 0 H ASN A 59 -4.955 9.400 -4.154 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.133 10.124 -6.693 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -4.447 11.429 -4.549 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -4.665 12.203 -6.106 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.314 11.728 -4.240 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.335 10.312 -4.639 1.00 0.00 H new ATOM 934 N MET A 60 -4.149 8.958 -7.927 1.00 0.00 N ATOM 935 CA MET A 60 -3.080 8.743 -8.898 1.00 0.00 C ATOM 936 C MET A 60 -3.195 9.724 -10.067 1.00 0.00 C ATOM 937 O MET A 60 -4.222 10.393 -10.210 1.00 0.00 O ATOM 938 CB MET A 60 -3.144 7.304 -9.403 1.00 0.00 C ATOM 939 CG MET A 60 -2.720 6.311 -8.329 1.00 0.00 C ATOM 940 SD MET A 60 -1.122 6.571 -7.527 1.00 0.00 S ATOM 941 CE MET A 60 -1.166 5.008 -6.627 1.00 0.00 C ATOM 0 H MET A 60 -4.976 8.379 -8.072 1.00 0.00 H new ATOM 0 HA MET A 60 -2.120 8.918 -8.412 1.00 0.00 H new ATOM 0 HB2 MET A 60 -4.159 7.077 -9.728 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.499 7.195 -10.275 1.00 0.00 H new ATOM 0 HG2 MET A 60 -3.487 6.307 -7.555 1.00 0.00 H new ATOM 0 HG3 MET A 60 -2.713 5.317 -8.776 1.00 0.00 H new ATOM 0 HE1 MET A 60 -0.828 5.168 -5.603 1.00 0.00 H new ATOM 0 HE2 MET A 60 -2.186 4.623 -6.616 1.00 0.00 H new ATOM 0 HE3 MET A 60 -0.511 4.287 -7.117 1.00 0.00 H new ATOM 951 N PRO A 61 -2.165 9.818 -10.928 1.00 0.00 N ATOM 952 CA PRO A 61 -2.270 10.461 -12.230 1.00 0.00 C ATOM 953 C PRO A 61 -2.842 9.530 -13.318 1.00 0.00 C ATOM 954 O PRO A 61 -2.909 9.951 -14.478 1.00 0.00 O ATOM 955 CB PRO A 61 -0.839 10.890 -12.560 1.00 0.00 C ATOM 956 CG PRO A 61 -0.013 9.761 -11.955 1.00 0.00 C ATOM 957 CD PRO A 61 -0.781 9.425 -10.676 1.00 0.00 C ATOM 0 HA PRO A 61 -2.967 11.299 -12.200 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -0.679 10.980 -13.634 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -0.592 11.856 -12.119 1.00 0.00 H new ATOM 0 HG2 PRO A 61 0.051 8.904 -12.625 1.00 0.00 H new ATOM 0 HG3 PRO A 61 1.008 10.077 -11.742 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -0.712 8.362 -10.446 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -0.371 9.963 -9.821 1.00 0.00 H new ATOM 965 N ASN A 62 -3.207 8.272 -13.029 1.00 0.00 N ATOM 966 CA ASN A 62 -3.852 7.401 -14.014 1.00 0.00 C ATOM 967 C ASN A 62 -4.780 6.381 -13.357 1.00 0.00 C ATOM 968 O ASN A 62 -5.995 6.578 -13.342 1.00 0.00 O ATOM 969 CB ASN A 62 -2.809 6.709 -14.909 1.00 0.00 C ATOM 970 CG ASN A 62 -3.367 6.323 -16.266 1.00 0.00 C ATOM 971 OD1 ASN A 62 -4.554 6.075 -16.437 1.00 0.00 O ATOM 972 ND2 ASN A 62 -2.524 6.266 -17.278 1.00 0.00 N ATOM 0 H ASN A 62 -3.064 7.837 -12.117 1.00 0.00 H new ATOM 0 HA ASN A 62 -4.472 8.036 -14.647 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -1.956 7.374 -15.047 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -2.439 5.816 -14.405 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -2.860 6.015 -18.208 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -1.536 6.473 -17.131 1.00 0.00 H new ATOM 979 N MET A 63 -4.230 5.287 -12.830 1.00 0.00 N ATOM 980 CA MET A 63 -4.996 4.191 -12.245 1.00 0.00 C ATOM 981 C MET A 63 -5.159 4.499 -10.765 1.00 0.00 C ATOM 982 O MET A 63 -4.259 4.202 -9.986 1.00 0.00 O ATOM 983 CB MET A 63 -4.299 2.851 -12.525 1.00 0.00 C ATOM 984 CG MET A 63 -4.914 1.656 -11.787 1.00 0.00 C ATOM 985 SD MET A 63 -4.136 0.058 -12.170 1.00 0.00 S ATOM 986 CE MET A 63 -4.936 -0.309 -13.752 1.00 0.00 C ATOM 0 H MET A 63 -3.222 5.137 -12.798 1.00 0.00 H new ATOM 0 HA MET A 63 -5.987 4.099 -12.689 1.00 0.00 H new ATOM 0 HB2 MET A 63 -4.329 2.656 -13.597 1.00 0.00 H new ATOM 0 HB3 MET A 63 -3.249 2.935 -12.245 1.00 0.00 H new ATOM 0 HG2 MET A 63 -4.845 1.832 -10.714 1.00 0.00 H new ATOM 0 HG3 MET A 63 -5.974 1.599 -12.033 1.00 0.00 H new ATOM 0 HE1 MET A 63 -4.571 -1.263 -14.132 1.00 0.00 H new ATOM 0 HE2 MET A 63 -6.015 -0.364 -13.610 1.00 0.00 H new ATOM 0 HE3 MET A 63 -4.705 0.479 -14.468 1.00 0.00 H new ATOM 996 N ASP A 64 -6.275 5.125 -10.402 1.00 0.00 N ATOM 997 CA ASP A 64 -6.686 5.469 -9.038 1.00 0.00 C ATOM 998 C ASP A 64 -6.501 4.280 -8.078 1.00 0.00 C ATOM 999 O ASP A 64 -6.561 3.119 -8.486 1.00 0.00 O ATOM 1000 CB ASP A 64 -8.132 5.987 -9.144 1.00 0.00 C ATOM 1001 CG ASP A 64 -9.015 5.930 -7.897 1.00 0.00 C ATOM 1002 OD1 ASP A 64 -9.286 4.806 -7.403 1.00 0.00 O ATOM 1003 OD2 ASP A 64 -9.605 6.969 -7.545 1.00 0.00 O ATOM 0 H ASP A 64 -6.962 5.426 -11.094 1.00 0.00 H new ATOM 0 HA ASP A 64 -6.061 6.248 -8.601 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -8.090 7.025 -9.475 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -8.631 5.422 -9.931 1.00 0.00 H new ATOM 1008 N GLY A 65 -6.210 4.556 -6.804 1.00 0.00 N ATOM 1009 CA GLY A 65 -5.853 3.553 -5.798 1.00 0.00 C ATOM 1010 C GLY A 65 -6.847 2.402 -5.699 1.00 0.00 C ATOM 1011 O GLY A 65 -6.447 1.253 -5.468 1.00 0.00 O ATOM 0 H GLY A 65 -6.216 5.507 -6.435 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -4.868 3.151 -6.033 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -5.775 4.039 -4.825 1.00 0.00 H new ATOM 1015 N LEU A 66 -8.134 2.703 -5.872 1.00 0.00 N ATOM 1016 CA LEU A 66 -9.207 1.731 -5.792 1.00 0.00 C ATOM 1017 C LEU A 66 -9.267 0.901 -7.065 1.00 0.00 C ATOM 1018 O LEU A 66 -9.563 -0.289 -6.998 1.00 0.00 O ATOM 1019 CB LEU A 66 -10.526 2.481 -5.555 1.00 0.00 C ATOM 1020 CG LEU A 66 -11.679 1.712 -4.893 1.00 0.00 C ATOM 1021 CD1 LEU A 66 -12.566 0.903 -5.831 1.00 0.00 C ATOM 1022 CD2 LEU A 66 -11.200 0.768 -3.798 1.00 0.00 C ATOM 0 H LEU A 66 -8.458 3.648 -6.075 1.00 0.00 H new ATOM 0 HA LEU A 66 -9.029 1.044 -4.965 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -10.309 3.354 -4.939 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -10.879 2.850 -6.518 1.00 0.00 H new ATOM 0 HG LEU A 66 -12.282 2.523 -4.484 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -13.345 0.403 -5.255 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.026 1.569 -6.561 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -11.963 0.157 -6.349 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -12.055 0.250 -3.364 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -10.511 0.038 -4.223 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -10.690 1.339 -3.022 1.00 0.00 H new ATOM 1034 N GLU A 67 -8.953 1.499 -8.214 1.00 0.00 N ATOM 1035 CA GLU A 67 -8.841 0.787 -9.476 1.00 0.00 C ATOM 1036 C GLU A 67 -7.649 -0.167 -9.421 1.00 0.00 C ATOM 1037 O GLU A 67 -7.793 -1.318 -9.829 1.00 0.00 O ATOM 1038 CB GLU A 67 -8.708 1.755 -10.662 1.00 0.00 C ATOM 1039 CG GLU A 67 -9.885 2.730 -10.823 1.00 0.00 C ATOM 1040 CD GLU A 67 -11.140 2.074 -11.398 1.00 0.00 C ATOM 1041 OE1 GLU A 67 -11.718 1.142 -10.792 1.00 0.00 O ATOM 1042 OE2 GLU A 67 -11.588 2.494 -12.492 1.00 0.00 O ATOM 0 H GLU A 67 -8.769 2.499 -8.290 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.755 0.214 -9.629 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.790 2.330 -10.544 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -8.605 1.175 -11.579 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.123 3.165 -9.852 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.582 3.550 -11.474 1.00 0.00 H new ATOM 1049 N LEU A 68 -6.497 0.249 -8.882 1.00 0.00 N ATOM 1050 CA LEU A 68 -5.339 -0.633 -8.693 1.00 0.00 C ATOM 1051 C LEU A 68 -5.719 -1.809 -7.800 1.00 0.00 C ATOM 1052 O LEU A 68 -5.487 -2.959 -8.182 1.00 0.00 O ATOM 1053 CB LEU A 68 -4.146 0.144 -8.117 1.00 0.00 C ATOM 1054 CG LEU A 68 -2.902 -0.718 -7.810 1.00 0.00 C ATOM 1055 CD1 LEU A 68 -2.262 -1.273 -9.088 1.00 0.00 C ATOM 1056 CD2 LEU A 68 -1.851 0.105 -7.056 1.00 0.00 C ATOM 0 H LEU A 68 -6.341 1.206 -8.565 1.00 0.00 H new ATOM 0 HA LEU A 68 -5.034 -1.024 -9.664 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.864 0.926 -8.822 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.462 0.641 -7.200 1.00 0.00 H new ATOM 0 HG LEU A 68 -3.240 -1.552 -7.195 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.390 -1.873 -8.827 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -2.985 -1.894 -9.617 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -1.955 -0.447 -9.729 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.981 -0.518 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -1.550 0.957 -7.666 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -2.274 0.463 -6.117 1.00 0.00 H new ATOM 1068 N LEU A 69 -6.357 -1.532 -6.655 1.00 0.00 N ATOM 1069 CA LEU A 69 -6.903 -2.557 -5.771 1.00 0.00 C ATOM 1070 C LEU A 69 -7.791 -3.479 -6.584 1.00 0.00 C ATOM 1071 O LEU A 69 -7.539 -4.671 -6.598 1.00 0.00 O ATOM 1072 CB LEU A 69 -7.639 -1.932 -4.574 1.00 0.00 C ATOM 1073 CG LEU A 69 -8.741 -2.774 -3.879 1.00 0.00 C ATOM 1074 CD1 LEU A 69 -8.444 -4.226 -3.452 1.00 0.00 C ATOM 1075 CD2 LEU A 69 -9.133 -2.050 -2.592 1.00 0.00 C ATOM 0 H LEU A 69 -6.507 -0.581 -6.318 1.00 0.00 H new ATOM 0 HA LEU A 69 -6.091 -3.146 -5.344 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.894 -1.671 -3.823 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -8.093 -1.000 -4.910 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.495 -2.862 -4.662 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -9.329 -4.656 -2.984 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.175 -4.815 -4.329 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -7.618 -4.234 -2.741 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.909 -2.617 -2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -8.260 -1.959 -1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -9.510 -1.056 -2.834 1.00 0.00 H new ATOM 1087 N LYS A 70 -8.814 -2.986 -7.274 1.00 0.00 N ATOM 1088 CA LYS A 70 -9.742 -3.860 -7.985 1.00 0.00 C ATOM 1089 C LYS A 70 -9.093 -4.611 -9.147 1.00 0.00 C ATOM 1090 O LYS A 70 -9.563 -5.701 -9.475 1.00 0.00 O ATOM 1091 CB LYS A 70 -10.958 -3.060 -8.451 1.00 0.00 C ATOM 1092 CG LYS A 70 -11.896 -2.771 -7.270 1.00 0.00 C ATOM 1093 CD LYS A 70 -13.211 -2.173 -7.779 1.00 0.00 C ATOM 1094 CE LYS A 70 -14.279 -2.184 -6.684 1.00 0.00 C ATOM 1095 NZ LYS A 70 -15.617 -1.908 -7.232 1.00 0.00 N ATOM 0 H LYS A 70 -9.022 -1.991 -7.356 1.00 0.00 H new ATOM 0 HA LYS A 70 -10.064 -4.628 -7.281 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -10.633 -2.123 -8.903 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -11.493 -3.616 -9.221 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -12.094 -3.690 -6.719 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.418 -2.080 -6.576 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.043 -1.151 -8.117 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -13.563 -2.740 -8.641 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -14.281 -3.154 -6.187 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -14.034 -1.438 -5.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -16.317 -1.923 -6.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -15.620 -0.972 -7.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -15.860 -2.634 -7.936 1.00 0.00 H new ATOM 1109 N THR A 71 -8.028 -4.088 -9.747 1.00 0.00 N ATOM 1110 CA THR A 71 -7.244 -4.795 -10.748 1.00 0.00 C ATOM 1111 C THR A 71 -6.572 -6.001 -10.081 1.00 0.00 C ATOM 1112 O THR A 71 -6.680 -7.122 -10.575 1.00 0.00 O ATOM 1113 CB THR A 71 -6.233 -3.833 -11.398 1.00 0.00 C ATOM 1114 OG1 THR A 71 -6.891 -2.679 -11.886 1.00 0.00 O ATOM 1115 CG2 THR A 71 -5.539 -4.471 -12.599 1.00 0.00 C ATOM 0 H THR A 71 -7.683 -3.149 -9.547 1.00 0.00 H new ATOM 0 HA THR A 71 -7.881 -5.166 -11.551 1.00 0.00 H new ATOM 0 HB THR A 71 -5.506 -3.585 -10.625 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.054 -2.058 -11.146 1.00 0.00 H new ATOM 0 HG21 THR A 71 -4.833 -3.761 -13.031 1.00 0.00 H new ATOM 0 HG22 THR A 71 -5.004 -5.365 -12.278 1.00 0.00 H new ATOM 0 HG23 THR A 71 -6.283 -4.743 -13.347 1.00 0.00 H new ATOM 1123 N ILE A 72 -5.916 -5.798 -8.937 1.00 0.00 N ATOM 1124 CA ILE A 72 -5.305 -6.855 -8.134 1.00 0.00 C ATOM 1125 C ILE A 72 -6.397 -7.834 -7.668 1.00 0.00 C ATOM 1126 O ILE A 72 -6.237 -9.047 -7.751 1.00 0.00 O ATOM 1127 CB ILE A 72 -4.563 -6.159 -6.969 1.00 0.00 C ATOM 1128 CG1 ILE A 72 -3.211 -5.588 -7.458 1.00 0.00 C ATOM 1129 CG2 ILE A 72 -4.350 -7.069 -5.751 1.00 0.00 C ATOM 1130 CD1 ILE A 72 -2.748 -4.446 -6.542 1.00 0.00 C ATOM 0 H ILE A 72 -5.793 -4.869 -8.534 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.586 -7.451 -8.696 1.00 0.00 H new ATOM 0 HB ILE A 72 -5.207 -5.345 -6.636 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -2.460 -6.378 -7.473 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -3.311 -5.224 -8.481 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -3.824 -6.517 -4.972 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -5.316 -7.401 -5.371 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -3.758 -7.936 -6.044 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.795 -4.056 -6.900 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -3.492 -3.650 -6.549 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.627 -4.821 -5.526 1.00 0.00 H new ATOM 1142 N ARG A 73 -7.533 -7.319 -7.200 1.00 0.00 N ATOM 1143 CA ARG A 73 -8.667 -8.070 -6.668 1.00 0.00 C ATOM 1144 C ARG A 73 -9.507 -8.701 -7.789 1.00 0.00 C ATOM 1145 O ARG A 73 -10.616 -9.159 -7.518 1.00 0.00 O ATOM 1146 CB ARG A 73 -9.493 -7.166 -5.723 1.00 0.00 C ATOM 1147 CG ARG A 73 -9.806 -7.833 -4.373 1.00 0.00 C ATOM 1148 CD ARG A 73 -11.066 -8.698 -4.374 1.00 0.00 C ATOM 1149 NE ARG A 73 -12.286 -7.883 -4.352 1.00 0.00 N ATOM 1150 CZ ARG A 73 -13.185 -7.677 -5.317 1.00 0.00 C ATOM 1151 NH1 ARG A 73 -13.040 -8.211 -6.528 1.00 0.00 N ATOM 1152 NH2 ARG A 73 -14.229 -6.906 -5.035 1.00 0.00 N ATOM 0 H ARG A 73 -7.695 -6.312 -7.181 1.00 0.00 H new ATOM 0 HA ARG A 73 -8.296 -8.909 -6.079 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -8.946 -6.240 -5.546 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -10.428 -6.896 -6.214 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -8.956 -8.450 -4.081 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -9.913 -7.058 -3.614 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -11.070 -9.334 -5.259 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -11.054 -9.358 -3.507 1.00 0.00 H new ATOM 0 HE ARG A 73 -12.475 -7.404 -3.471 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -12.228 -8.792 -6.735 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -13.741 -8.039 -7.249 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -14.323 -6.494 -4.107 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -14.937 -6.726 -5.747 1.00 0.00 H new ATOM 1166 N ALA A 74 -9.044 -8.696 -9.045 1.00 0.00 N ATOM 1167 CA ALA A 74 -9.756 -9.319 -10.155 1.00 0.00 C ATOM 1168 C ALA A 74 -9.812 -10.845 -10.009 1.00 0.00 C ATOM 1169 O ALA A 74 -10.609 -11.487 -10.701 1.00 0.00 O ATOM 1170 CB ALA A 74 -9.080 -8.942 -11.477 1.00 0.00 C ATOM 0 H ALA A 74 -8.163 -8.258 -9.315 1.00 0.00 H new ATOM 0 HA ALA A 74 -10.782 -8.950 -10.147 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.614 -9.409 -12.305 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.097 -7.859 -11.599 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.047 -9.290 -11.470 1.00 0.00 H new ATOM 1176 N ASP A 75 -8.984 -11.420 -9.129 1.00 0.00 N ATOM 1177 CA ASP A 75 -8.769 -12.851 -8.931 1.00 0.00 C ATOM 1178 C ASP A 75 -8.258 -13.502 -10.220 1.00 0.00 C ATOM 1179 O ASP A 75 -7.907 -12.815 -11.183 1.00 0.00 O ATOM 1180 CB ASP A 75 -10.027 -13.515 -8.329 1.00 0.00 C ATOM 1181 CG ASP A 75 -9.724 -14.739 -7.459 1.00 0.00 C ATOM 1182 OD1 ASP A 75 -8.642 -15.357 -7.588 1.00 0.00 O ATOM 1183 OD2 ASP A 75 -10.569 -15.087 -6.603 1.00 0.00 O ATOM 0 H ASP A 75 -8.412 -10.859 -8.498 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.981 -13.008 -8.194 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -10.563 -12.779 -7.730 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -10.692 -13.813 -9.139 1.00 0.00 H new ATOM 1188 N GLY A 76 -8.068 -14.818 -10.231 1.00 0.00 N ATOM 1189 CA GLY A 76 -7.208 -15.486 -11.196 1.00 0.00 C ATOM 1190 C GLY A 76 -5.737 -15.287 -10.840 1.00 0.00 C ATOM 1191 O GLY A 76 -4.943 -16.210 -11.025 1.00 0.00 O ATOM 0 H GLY A 76 -8.510 -15.452 -9.566 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.440 -16.551 -11.221 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.401 -15.094 -12.195 1.00 0.00 H new ATOM 1195 N ALA A 77 -5.374 -14.133 -10.277 1.00 0.00 N ATOM 1196 CA ALA A 77 -4.173 -13.897 -9.510 1.00 0.00 C ATOM 1197 C ALA A 77 -4.450 -12.751 -8.532 1.00 0.00 C ATOM 1198 O ALA A 77 -5.424 -12.018 -8.677 1.00 0.00 O ATOM 1199 CB ALA A 77 -3.040 -13.502 -10.468 1.00 0.00 C ATOM 0 H ALA A 77 -5.952 -13.296 -10.355 1.00 0.00 H new ATOM 0 HA ALA A 77 -3.881 -14.792 -8.961 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -2.128 -13.322 -9.898 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.869 -14.308 -11.181 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -3.318 -12.595 -11.005 1.00 0.00 H new ATOM 1205 N MET A 78 -3.548 -12.596 -7.570 1.00 0.00 N ATOM 1206 CA MET A 78 -3.238 -11.430 -6.749 1.00 0.00 C ATOM 1207 C MET A 78 -4.262 -11.067 -5.683 1.00 0.00 C ATOM 1208 O MET A 78 -3.950 -10.248 -4.817 1.00 0.00 O ATOM 1209 CB MET A 78 -2.890 -10.219 -7.630 1.00 0.00 C ATOM 1210 CG MET A 78 -1.759 -10.494 -8.624 1.00 0.00 C ATOM 1211 SD MET A 78 -0.560 -9.140 -8.807 1.00 0.00 S ATOM 1212 CE MET A 78 0.388 -9.769 -10.221 1.00 0.00 C ATOM 0 H MET A 78 -2.944 -13.378 -7.317 1.00 0.00 H new ATOM 0 HA MET A 78 -2.364 -11.731 -6.172 1.00 0.00 H new ATOM 0 HB2 MET A 78 -3.780 -9.912 -8.180 1.00 0.00 H new ATOM 0 HB3 MET A 78 -2.606 -9.383 -6.990 1.00 0.00 H new ATOM 0 HG2 MET A 78 -1.227 -11.392 -8.309 1.00 0.00 H new ATOM 0 HG3 MET A 78 -2.196 -10.708 -9.599 1.00 0.00 H new ATOM 0 HE1 MET A 78 1.175 -9.060 -10.476 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.834 -10.729 -9.962 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.276 -9.897 -11.076 1.00 0.00 H new ATOM 1222 N SER A 79 -5.435 -11.694 -5.671 1.00 0.00 N ATOM 1223 CA SER A 79 -6.505 -11.271 -4.767 1.00 0.00 C ATOM 1224 C SER A 79 -6.123 -11.343 -3.284 1.00 0.00 C ATOM 1225 O SER A 79 -6.716 -10.612 -2.486 1.00 0.00 O ATOM 1226 CB SER A 79 -7.795 -12.059 -5.011 1.00 0.00 C ATOM 1227 OG SER A 79 -8.510 -11.502 -6.090 1.00 0.00 O ATOM 0 H SER A 79 -5.669 -12.487 -6.268 1.00 0.00 H new ATOM 0 HA SER A 79 -6.675 -10.220 -5.002 1.00 0.00 H new ATOM 0 HB2 SER A 79 -7.558 -13.102 -5.222 1.00 0.00 H new ATOM 0 HB3 SER A 79 -8.412 -12.048 -4.112 1.00 0.00 H new ATOM 0 HG SER A 79 -9.447 -11.787 -6.044 1.00 0.00 H new ATOM 1233 N ALA A 80 -5.155 -12.170 -2.874 1.00 0.00 N ATOM 1234 CA ALA A 80 -4.766 -12.245 -1.471 1.00 0.00 C ATOM 1235 C ALA A 80 -3.938 -11.041 -0.999 1.00 0.00 C ATOM 1236 O ALA A 80 -3.816 -10.856 0.215 1.00 0.00 O ATOM 1237 CB ALA A 80 -3.995 -13.539 -1.220 1.00 0.00 C ATOM 0 H ALA A 80 -4.633 -12.791 -3.493 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.688 -12.231 -0.889 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -3.706 -13.592 -0.170 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.627 -14.393 -1.466 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -3.102 -13.557 -1.844 1.00 0.00 H new ATOM 1243 N LEU A 81 -3.391 -10.229 -1.917 1.00 0.00 N ATOM 1244 CA LEU A 81 -2.428 -9.173 -1.604 1.00 0.00 C ATOM 1245 C LEU A 81 -2.978 -8.203 -0.556 1.00 0.00 C ATOM 1246 O LEU A 81 -4.112 -7.729 -0.718 1.00 0.00 O ATOM 1247 CB LEU A 81 -2.097 -8.335 -2.854 1.00 0.00 C ATOM 1248 CG LEU A 81 -0.928 -8.826 -3.723 1.00 0.00 C ATOM 1249 CD1 LEU A 81 -0.835 -7.907 -4.949 1.00 0.00 C ATOM 1250 CD2 LEU A 81 0.398 -8.783 -2.949 1.00 0.00 C ATOM 0 H LEU A 81 -3.612 -10.292 -2.911 1.00 0.00 H new ATOM 0 HA LEU A 81 -1.539 -9.678 -1.227 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.989 -8.288 -3.478 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -1.878 -7.316 -2.533 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.107 -9.860 -4.019 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -0.012 -8.232 -5.586 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.768 -7.954 -5.510 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.659 -6.882 -4.623 1.00 0.00 H new ATOM 0 HD21 LEU A 81 1.205 -9.136 -3.590 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.604 -7.759 -2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.327 -9.423 -2.070 1.00 0.00 H new ATOM 1262 N PRO A 82 -2.186 -7.816 0.459 1.00 0.00 N ATOM 1263 CA PRO A 82 -2.473 -6.654 1.277 1.00 0.00 C ATOM 1264 C PRO A 82 -2.219 -5.384 0.447 1.00 0.00 C ATOM 1265 O PRO A 82 -1.120 -4.821 0.461 1.00 0.00 O ATOM 1266 CB PRO A 82 -1.577 -6.779 2.512 1.00 0.00 C ATOM 1267 CG PRO A 82 -0.364 -7.542 1.990 1.00 0.00 C ATOM 1268 CD PRO A 82 -0.926 -8.419 0.869 1.00 0.00 C ATOM 0 HA PRO A 82 -3.511 -6.591 1.602 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.298 -5.802 2.907 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -2.075 -7.318 3.318 1.00 0.00 H new ATOM 0 HG2 PRO A 82 0.403 -6.863 1.618 1.00 0.00 H new ATOM 0 HG3 PRO A 82 0.096 -8.144 2.774 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.230 -8.470 0.031 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.081 -9.440 1.217 1.00 0.00 H new ATOM 1276 N VAL A 83 -3.235 -4.936 -0.297 1.00 0.00 N ATOM 1277 CA VAL A 83 -3.252 -3.572 -0.808 1.00 0.00 C ATOM 1278 C VAL A 83 -3.637 -2.625 0.332 1.00 0.00 C ATOM 1279 O VAL A 83 -4.517 -2.968 1.133 1.00 0.00 O ATOM 1280 CB VAL A 83 -4.128 -3.400 -2.062 1.00 0.00 C ATOM 1281 CG1 VAL A 83 -3.991 -4.538 -3.086 1.00 0.00 C ATOM 1282 CG2 VAL A 83 -5.611 -3.322 -1.712 1.00 0.00 C ATOM 0 H VAL A 83 -4.047 -5.496 -0.554 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.251 -3.317 -1.155 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.764 -2.471 -2.500 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.641 -4.340 -3.939 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -2.957 -4.600 -3.424 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.278 -5.482 -2.622 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -6.194 -3.201 -2.625 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -5.914 -4.239 -1.207 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -5.785 -2.471 -1.054 1.00 0.00 H new ATOM 1292 N LEU A 84 -3.022 -1.447 0.424 1.00 0.00 N ATOM 1293 CA LEU A 84 -3.189 -0.543 1.560 1.00 0.00 C ATOM 1294 C LEU A 84 -3.338 0.881 1.039 1.00 0.00 C ATOM 1295 O LEU A 84 -2.440 1.379 0.357 1.00 0.00 O ATOM 1296 CB LEU A 84 -1.994 -0.719 2.510 1.00 0.00 C ATOM 1297 CG LEU A 84 -2.015 0.200 3.748 1.00 0.00 C ATOM 1298 CD1 LEU A 84 -3.302 0.035 4.561 1.00 0.00 C ATOM 1299 CD2 LEU A 84 -0.809 -0.106 4.643 1.00 0.00 C ATOM 0 H LEU A 84 -2.390 -1.091 -0.293 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.090 -0.772 2.129 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.963 -1.756 2.844 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.075 -0.536 1.954 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.969 1.229 3.392 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -3.275 0.701 5.424 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.161 0.284 3.937 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.388 -0.997 4.901 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.829 0.546 5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.850 -1.146 4.966 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.111 0.064 4.084 1.00 0.00 H new ATOM 1311 N MET A 85 -4.484 1.508 1.316 1.00 0.00 N ATOM 1312 CA MET A 85 -4.728 2.888 0.891 1.00 0.00 C ATOM 1313 C MET A 85 -3.975 3.800 1.865 1.00 0.00 C ATOM 1314 O MET A 85 -4.180 3.659 3.073 1.00 0.00 O ATOM 1315 CB MET A 85 -6.235 3.218 0.899 1.00 0.00 C ATOM 1316 CG MET A 85 -7.182 2.176 0.276 1.00 0.00 C ATOM 1317 SD MET A 85 -7.253 2.112 -1.533 1.00 0.00 S ATOM 1318 CE MET A 85 -5.869 1.010 -1.906 1.00 0.00 C ATOM 0 H MET A 85 -5.255 1.083 1.831 1.00 0.00 H new ATOM 0 HA MET A 85 -4.378 3.034 -0.131 1.00 0.00 H new ATOM 0 HB2 MET A 85 -6.541 3.379 1.933 1.00 0.00 H new ATOM 0 HB3 MET A 85 -6.378 4.162 0.374 1.00 0.00 H new ATOM 0 HG2 MET A 85 -6.889 1.191 0.639 1.00 0.00 H new ATOM 0 HG3 MET A 85 -8.188 2.366 0.649 1.00 0.00 H new ATOM 0 HE1 MET A 85 -5.984 0.609 -2.913 1.00 0.00 H new ATOM 0 HE2 MET A 85 -4.934 1.566 -1.842 1.00 0.00 H new ATOM 0 HE3 MET A 85 -5.853 0.190 -1.188 1.00 0.00 H new ATOM 1328 N VAL A 86 -3.132 4.715 1.383 1.00 0.00 N ATOM 1329 CA VAL A 86 -2.369 5.665 2.200 1.00 0.00 C ATOM 1330 C VAL A 86 -2.462 7.017 1.499 1.00 0.00 C ATOM 1331 O VAL A 86 -1.959 7.148 0.390 1.00 0.00 O ATOM 1332 CB VAL A 86 -0.903 5.196 2.357 1.00 0.00 C ATOM 1333 CG1 VAL A 86 -0.089 6.154 3.236 1.00 0.00 C ATOM 1334 CG2 VAL A 86 -0.809 3.799 2.984 1.00 0.00 C ATOM 0 H VAL A 86 -2.955 4.820 0.384 1.00 0.00 H new ATOM 0 HA VAL A 86 -2.773 5.736 3.210 1.00 0.00 H new ATOM 0 HB VAL A 86 -0.495 5.176 1.347 1.00 0.00 H new ATOM 0 HG11 VAL A 86 0.934 5.789 3.321 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -0.084 7.146 2.785 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -0.538 6.209 4.228 1.00 0.00 H new ATOM 0 HG21 VAL A 86 0.238 3.511 3.075 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.269 3.812 3.972 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.329 3.080 2.351 1.00 0.00 H new ATOM 1344 N THR A 87 -3.176 7.991 2.067 1.00 0.00 N ATOM 1345 CA THR A 87 -3.511 9.211 1.336 1.00 0.00 C ATOM 1346 C THR A 87 -3.777 10.379 2.296 1.00 0.00 C ATOM 1347 O THR A 87 -3.874 10.196 3.512 1.00 0.00 O ATOM 1348 CB THR A 87 -4.703 8.883 0.404 1.00 0.00 C ATOM 1349 OG1 THR A 87 -5.111 9.995 -0.370 1.00 0.00 O ATOM 1350 CG2 THR A 87 -5.930 8.339 1.148 1.00 0.00 C ATOM 0 H THR A 87 -3.530 7.958 3.023 1.00 0.00 H new ATOM 0 HA THR A 87 -2.675 9.546 0.723 1.00 0.00 H new ATOM 0 HB THR A 87 -4.317 8.102 -0.251 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.984 9.796 -1.321 1.00 0.00 H new ATOM 0 HG21 THR A 87 -6.726 8.131 0.433 1.00 0.00 H new ATOM 0 HG22 THR A 87 -5.662 7.420 1.670 1.00 0.00 H new ATOM 0 HG23 THR A 87 -6.275 9.079 1.870 1.00 0.00 H new ATOM 1358 N ALA A 88 -3.937 11.592 1.764 1.00 0.00 N ATOM 1359 CA ALA A 88 -4.604 12.683 2.464 1.00 0.00 C ATOM 1360 C ALA A 88 -6.113 12.462 2.538 1.00 0.00 C ATOM 1361 O ALA A 88 -6.756 13.001 3.436 1.00 0.00 O ATOM 1362 CB ALA A 88 -4.373 13.998 1.716 1.00 0.00 C ATOM 0 H ALA A 88 -3.605 11.843 0.833 1.00 0.00 H new ATOM 0 HA ALA A 88 -4.188 12.720 3.471 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -4.874 14.810 2.244 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.304 14.204 1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.777 13.918 0.707 1.00 0.00 H new ATOM 1368 N GLU A 89 -6.693 11.747 1.571 1.00 0.00 N ATOM 1369 CA GLU A 89 -8.126 11.709 1.314 1.00 0.00 C ATOM 1370 C GLU A 89 -8.866 10.953 2.414 1.00 0.00 C ATOM 1371 O GLU A 89 -9.055 9.739 2.327 1.00 0.00 O ATOM 1372 CB GLU A 89 -8.389 11.066 -0.055 1.00 0.00 C ATOM 1373 CG GLU A 89 -7.980 11.984 -1.210 1.00 0.00 C ATOM 1374 CD GLU A 89 -9.190 12.708 -1.796 1.00 0.00 C ATOM 1375 OE1 GLU A 89 -9.795 13.570 -1.104 1.00 0.00 O ATOM 1376 OE2 GLU A 89 -9.537 12.417 -2.961 1.00 0.00 O ATOM 0 H GLU A 89 -6.158 11.163 0.929 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.503 12.732 1.308 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -7.839 10.128 -0.126 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -9.448 10.822 -0.143 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.252 12.714 -0.857 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -7.492 11.398 -1.988 1.00 0.00 H new ATOM 1383 N ALA A 90 -9.355 11.673 3.424 1.00 0.00 N ATOM 1384 CA ALA A 90 -10.256 11.117 4.427 1.00 0.00 C ATOM 1385 C ALA A 90 -11.678 10.889 3.895 1.00 0.00 C ATOM 1386 O ALA A 90 -12.555 10.571 4.696 1.00 0.00 O ATOM 1387 CB ALA A 90 -10.347 12.048 5.633 1.00 0.00 C ATOM 0 H ALA A 90 -9.136 12.659 3.568 1.00 0.00 H new ATOM 0 HA ALA A 90 -9.834 10.152 4.707 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -11.023 11.620 6.373 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.358 12.171 6.073 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.726 13.019 5.315 1.00 0.00 H new ATOM 1393 N LYS A 91 -11.928 11.119 2.594 1.00 0.00 N ATOM 1394 CA LYS A 91 -13.233 11.027 1.940 1.00 0.00 C ATOM 1395 C LYS A 91 -13.916 9.749 2.402 1.00 0.00 C ATOM 1396 O LYS A 91 -13.533 8.664 1.969 1.00 0.00 O ATOM 1397 CB LYS A 91 -13.057 11.085 0.404 1.00 0.00 C ATOM 1398 CG LYS A 91 -14.370 11.197 -0.406 1.00 0.00 C ATOM 1399 CD LYS A 91 -14.596 12.613 -0.966 1.00 0.00 C ATOM 1400 CE LYS A 91 -15.943 12.816 -1.686 1.00 0.00 C ATOM 1401 NZ LYS A 91 -16.043 12.187 -3.021 1.00 0.00 N ATOM 0 H LYS A 91 -11.188 11.386 1.945 1.00 0.00 H new ATOM 0 HA LYS A 91 -13.867 11.870 2.215 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -12.424 11.938 0.159 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -12.525 10.190 0.081 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -14.348 10.483 -1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -15.211 10.923 0.231 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -14.527 13.328 -0.146 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -13.790 12.846 -1.661 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -16.738 12.420 -1.054 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.123 13.886 -1.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -16.562 12.819 -3.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -15.088 12.017 -3.397 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -16.550 11.282 -2.941 1.00 0.00 H new ATOM 1415 N LYS A 92 -14.915 9.864 3.280 1.00 0.00 N ATOM 1416 CA LYS A 92 -15.629 8.707 3.810 1.00 0.00 C ATOM 1417 C LYS A 92 -16.089 7.808 2.674 1.00 0.00 C ATOM 1418 O LYS A 92 -15.882 6.608 2.728 1.00 0.00 O ATOM 1419 CB LYS A 92 -16.791 9.181 4.683 1.00 0.00 C ATOM 1420 CG LYS A 92 -16.340 9.385 6.137 1.00 0.00 C ATOM 1421 CD LYS A 92 -17.264 10.345 6.893 1.00 0.00 C ATOM 1422 CE LYS A 92 -18.731 9.924 6.794 1.00 0.00 C ATOM 1423 NZ LYS A 92 -19.611 10.927 7.411 1.00 0.00 N ATOM 0 H LYS A 92 -15.248 10.758 3.640 1.00 0.00 H new ATOM 0 HA LYS A 92 -14.963 8.113 4.436 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -17.190 10.115 4.288 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -17.599 8.450 4.648 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -16.319 8.423 6.649 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -15.322 9.775 6.150 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -16.968 10.383 7.941 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -17.148 11.352 6.492 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.004 9.790 5.747 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -18.870 8.961 7.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -20.601 10.617 7.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -19.363 11.036 8.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -19.493 11.839 6.925 1.00 0.00 H new ATOM 1437 N GLU A 93 -16.615 8.387 1.604 1.00 0.00 N ATOM 1438 CA GLU A 93 -16.990 7.689 0.385 1.00 0.00 C ATOM 1439 C GLU A 93 -15.883 6.762 -0.152 1.00 0.00 C ATOM 1440 O GLU A 93 -16.171 5.632 -0.549 1.00 0.00 O ATOM 1441 CB GLU A 93 -17.306 8.782 -0.635 1.00 0.00 C ATOM 1442 CG GLU A 93 -18.178 8.328 -1.798 1.00 0.00 C ATOM 1443 CD GLU A 93 -18.353 9.521 -2.730 1.00 0.00 C ATOM 1444 OE1 GLU A 93 -17.384 9.851 -3.447 1.00 0.00 O ATOM 1445 OE2 GLU A 93 -19.402 10.206 -2.660 1.00 0.00 O ATOM 0 H GLU A 93 -16.798 9.389 1.560 1.00 0.00 H new ATOM 0 HA GLU A 93 -17.839 7.034 0.581 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -17.805 9.605 -0.124 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -16.369 9.173 -1.031 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -17.712 7.495 -2.324 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -19.145 7.977 -1.438 1.00 0.00 H new ATOM 1452 N ASN A 94 -14.625 7.221 -0.150 1.00 0.00 N ATOM 1453 CA ASN A 94 -13.459 6.436 -0.554 1.00 0.00 C ATOM 1454 C ASN A 94 -13.191 5.343 0.474 1.00 0.00 C ATOM 1455 O ASN A 94 -12.885 4.218 0.089 1.00 0.00 O ATOM 1456 CB ASN A 94 -12.179 7.282 -0.679 1.00 0.00 C ATOM 1457 CG ASN A 94 -12.152 8.277 -1.828 1.00 0.00 C ATOM 1458 OD1 ASN A 94 -13.109 8.431 -2.589 1.00 0.00 O ATOM 1459 ND2 ASN A 94 -11.057 9.005 -1.963 1.00 0.00 N ATOM 0 H ASN A 94 -14.388 8.170 0.140 1.00 0.00 H new ATOM 0 HA ASN A 94 -13.696 6.020 -1.533 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -12.035 7.828 0.253 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -11.330 6.607 -0.788 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -10.997 9.704 -2.704 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -10.272 8.868 -1.327 1.00 0.00 H new ATOM 1466 N ILE A 95 -13.316 5.641 1.774 1.00 0.00 N ATOM 1467 CA ILE A 95 -13.243 4.617 2.814 1.00 0.00 C ATOM 1468 C ILE A 95 -14.276 3.505 2.523 1.00 0.00 C ATOM 1469 O ILE A 95 -13.911 2.326 2.600 1.00 0.00 O ATOM 1470 CB ILE A 95 -13.348 5.228 4.243 1.00 0.00 C ATOM 1471 CG1 ILE A 95 -12.019 5.850 4.748 1.00 0.00 C ATOM 1472 CG2 ILE A 95 -13.792 4.146 5.243 1.00 0.00 C ATOM 1473 CD1 ILE A 95 -11.751 7.298 4.311 1.00 0.00 C ATOM 0 H ILE A 95 -13.468 6.586 2.127 1.00 0.00 H new ATOM 0 HA ILE A 95 -12.259 4.149 2.792 1.00 0.00 H new ATOM 0 HB ILE A 95 -14.082 6.031 4.176 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -12.013 5.812 5.837 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -11.194 5.227 4.402 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -13.863 4.580 6.240 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -14.765 3.754 4.947 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -13.062 3.336 5.251 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -10.797 7.631 4.720 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -11.717 7.349 3.223 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -12.549 7.943 4.680 1.00 0.00 H new ATOM 1485 N ILE A 96 -15.534 3.848 2.189 1.00 0.00 N ATOM 1486 CA ILE A 96 -16.554 2.869 1.800 1.00 0.00 C ATOM 1487 C ILE A 96 -16.012 2.084 0.612 1.00 0.00 C ATOM 1488 O ILE A 96 -15.956 0.863 0.695 1.00 0.00 O ATOM 1489 CB ILE A 96 -17.947 3.495 1.495 1.00 0.00 C ATOM 1490 CG1 ILE A 96 -18.751 3.828 2.769 1.00 0.00 C ATOM 1491 CG2 ILE A 96 -18.850 2.536 0.691 1.00 0.00 C ATOM 1492 CD1 ILE A 96 -18.390 5.168 3.387 1.00 0.00 C ATOM 0 H ILE A 96 -15.867 4.812 2.183 1.00 0.00 H new ATOM 0 HA ILE A 96 -16.741 2.208 2.647 1.00 0.00 H new ATOM 0 HB ILE A 96 -17.710 4.399 0.934 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -19.814 3.824 2.528 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.588 3.042 3.507 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.811 3.014 0.501 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -18.371 2.295 -0.258 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.007 1.620 1.261 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -18.996 5.333 4.278 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -17.335 5.170 3.660 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -18.580 5.964 2.667 1.00 0.00 H new ATOM 1504 N ALA A 97 -15.622 2.754 -0.477 1.00 0.00 N ATOM 1505 CA ALA A 97 -15.201 2.092 -1.704 1.00 0.00 C ATOM 1506 C ALA A 97 -14.054 1.115 -1.443 1.00 0.00 C ATOM 1507 O ALA A 97 -14.087 -0.008 -1.942 1.00 0.00 O ATOM 1508 CB ALA A 97 -14.827 3.132 -2.759 1.00 0.00 C ATOM 0 H ALA A 97 -15.591 3.772 -0.527 1.00 0.00 H new ATOM 0 HA ALA A 97 -16.036 1.505 -2.086 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -14.514 2.627 -3.673 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.691 3.762 -2.971 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.010 3.750 -2.387 1.00 0.00 H new ATOM 1514 N ALA A 98 -13.069 1.503 -0.630 1.00 0.00 N ATOM 1515 CA ALA A 98 -11.957 0.647 -0.251 1.00 0.00 C ATOM 1516 C ALA A 98 -12.462 -0.602 0.458 1.00 0.00 C ATOM 1517 O ALA A 98 -12.088 -1.715 0.092 1.00 0.00 O ATOM 1518 CB ALA A 98 -11.007 1.396 0.684 1.00 0.00 C ATOM 0 H ALA A 98 -13.026 2.433 -0.214 1.00 0.00 H new ATOM 0 HA ALA A 98 -11.428 0.360 -1.160 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -10.179 0.743 0.960 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -10.619 2.280 0.177 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -11.545 1.700 1.582 1.00 0.00 H new ATOM 1524 N ALA A 99 -13.283 -0.422 1.497 1.00 0.00 N ATOM 1525 CA ALA A 99 -13.823 -1.521 2.280 1.00 0.00 C ATOM 1526 C ALA A 99 -14.662 -2.444 1.383 1.00 0.00 C ATOM 1527 O ALA A 99 -14.516 -3.663 1.446 1.00 0.00 O ATOM 1528 CB ALA A 99 -14.627 -0.944 3.456 1.00 0.00 C ATOM 0 H ALA A 99 -13.589 0.498 1.815 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.020 -2.132 2.692 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.037 -1.760 4.051 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -13.973 -0.334 4.079 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.441 -0.329 3.073 1.00 0.00 H new ATOM 1534 N GLN A 100 -15.478 -1.862 0.504 1.00 0.00 N ATOM 1535 CA GLN A 100 -16.314 -2.528 -0.481 1.00 0.00 C ATOM 1536 C GLN A 100 -15.487 -3.394 -1.422 1.00 0.00 C ATOM 1537 O GLN A 100 -15.778 -4.586 -1.544 1.00 0.00 O ATOM 1538 CB GLN A 100 -17.116 -1.475 -1.260 1.00 0.00 C ATOM 1539 CG GLN A 100 -18.314 -0.961 -0.457 1.00 0.00 C ATOM 1540 CD GLN A 100 -19.453 -1.964 -0.526 1.00 0.00 C ATOM 1541 OE1 GLN A 100 -20.186 -1.997 -1.513 1.00 0.00 O ATOM 1542 NE2 GLN A 100 -19.584 -2.841 0.450 1.00 0.00 N ATOM 0 H GLN A 100 -15.575 -0.847 0.463 1.00 0.00 H new ATOM 0 HA GLN A 100 -17.004 -3.194 0.037 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -16.465 -0.639 -1.516 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -17.466 -1.906 -2.198 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -18.024 -0.798 0.581 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -18.641 0.001 -0.851 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.967 -2.798 1.261 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -20.303 -3.563 0.394 1.00 0.00 H new ATOM 1551 N ALA A 101 -14.462 -2.820 -2.061 1.00 0.00 N ATOM 1552 CA ALA A 101 -13.543 -3.557 -2.907 1.00 0.00 C ATOM 1553 C ALA A 101 -12.859 -4.665 -2.106 1.00 0.00 C ATOM 1554 O ALA A 101 -12.675 -5.762 -2.628 1.00 0.00 O ATOM 1555 CB ALA A 101 -12.511 -2.592 -3.491 1.00 0.00 C ATOM 0 H ALA A 101 -14.253 -1.824 -1.999 1.00 0.00 H new ATOM 0 HA ALA A 101 -14.093 -4.024 -3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.818 -3.142 -4.128 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -13.019 -1.830 -4.081 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -11.959 -2.116 -2.681 1.00 0.00 H new ATOM 1561 N GLY A 102 -12.519 -4.394 -0.845 1.00 0.00 N ATOM 1562 CA GLY A 102 -11.937 -5.352 0.079 1.00 0.00 C ATOM 1563 C GLY A 102 -10.488 -5.021 0.419 1.00 0.00 C ATOM 1564 O GLY A 102 -9.717 -5.945 0.686 1.00 0.00 O ATOM 0 H GLY A 102 -12.648 -3.471 -0.431 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -12.527 -5.374 0.995 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -11.987 -6.350 -0.356 1.00 0.00 H new ATOM 1568 N ALA A 103 -10.103 -3.737 0.413 1.00 0.00 N ATOM 1569 CA ALA A 103 -8.733 -3.306 0.679 1.00 0.00 C ATOM 1570 C ALA A 103 -8.300 -3.791 2.060 1.00 0.00 C ATOM 1571 O ALA A 103 -9.126 -3.879 2.980 1.00 0.00 O ATOM 1572 CB ALA A 103 -8.620 -1.778 0.626 1.00 0.00 C ATOM 0 H ALA A 103 -10.743 -2.966 0.221 1.00 0.00 H new ATOM 0 HA ALA A 103 -8.086 -3.734 -0.087 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.590 -1.482 0.827 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -8.912 -1.426 -0.363 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.277 -1.338 1.376 1.00 0.00 H new ATOM 1578 N SER A 104 -7.005 -4.046 2.243 1.00 0.00 N ATOM 1579 CA SER A 104 -6.523 -4.582 3.506 1.00 0.00 C ATOM 1580 C SER A 104 -6.543 -3.530 4.620 1.00 0.00 C ATOM 1581 O SER A 104 -6.584 -3.884 5.801 1.00 0.00 O ATOM 1582 CB SER A 104 -5.169 -5.255 3.291 1.00 0.00 C ATOM 1583 OG SER A 104 -4.082 -4.357 3.273 1.00 0.00 O ATOM 0 H SER A 104 -6.282 -3.891 1.540 1.00 0.00 H new ATOM 0 HA SER A 104 -7.205 -5.355 3.861 1.00 0.00 H new ATOM 0 HB2 SER A 104 -5.009 -5.988 4.081 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.192 -5.802 2.348 1.00 0.00 H new ATOM 0 HG SER A 104 -3.993 -3.969 2.378 1.00 0.00 H new ATOM 1589 N GLY A 105 -6.608 -2.244 4.263 1.00 0.00 N ATOM 1590 CA GLY A 105 -6.742 -1.158 5.210 1.00 0.00 C ATOM 1591 C GLY A 105 -6.767 0.180 4.490 1.00 0.00 C ATOM 1592 O GLY A 105 -6.499 0.269 3.283 1.00 0.00 O ATOM 0 H GLY A 105 -6.568 -1.935 3.292 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -7.658 -1.283 5.788 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -5.913 -1.181 5.917 1.00 0.00 H new ATOM 1596 N TYR A 106 -7.051 1.221 5.269 1.00 0.00 N ATOM 1597 CA TYR A 106 -7.034 2.610 4.853 1.00 0.00 C ATOM 1598 C TYR A 106 -6.265 3.378 5.921 1.00 0.00 C ATOM 1599 O TYR A 106 -6.423 3.116 7.119 1.00 0.00 O ATOM 1600 CB TYR A 106 -8.476 3.127 4.700 1.00 0.00 C ATOM 1601 CG TYR A 106 -8.662 4.271 3.717 1.00 0.00 C ATOM 1602 CD1 TYR A 106 -8.146 5.554 3.978 1.00 0.00 C ATOM 1603 CD2 TYR A 106 -9.395 4.053 2.534 1.00 0.00 C ATOM 1604 CE1 TYR A 106 -8.357 6.602 3.063 1.00 0.00 C ATOM 1605 CE2 TYR A 106 -9.623 5.098 1.623 1.00 0.00 C ATOM 1606 CZ TYR A 106 -9.111 6.385 1.888 1.00 0.00 C ATOM 1607 OH TYR A 106 -9.361 7.413 1.033 1.00 0.00 O ATOM 0 H TYR A 106 -7.310 1.108 6.249 1.00 0.00 H new ATOM 0 HA TYR A 106 -6.550 2.739 3.885 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -9.110 2.297 4.388 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -8.833 3.450 5.678 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.586 5.735 4.884 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -9.787 3.069 2.324 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -7.940 7.579 3.260 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.189 4.916 0.722 1.00 0.00 H new ATOM 0 HH TYR A 106 -9.128 8.261 1.465 1.00 0.00 H new ATOM 1617 N VAL A 107 -5.437 4.318 5.493 1.00 0.00 N ATOM 1618 CA VAL A 107 -4.616 5.191 6.307 1.00 0.00 C ATOM 1619 C VAL A 107 -4.823 6.588 5.736 1.00 0.00 C ATOM 1620 O VAL A 107 -4.843 6.759 4.514 1.00 0.00 O ATOM 1621 CB VAL A 107 -3.148 4.730 6.206 1.00 0.00 C ATOM 1622 CG1 VAL A 107 -2.190 5.699 6.890 1.00 0.00 C ATOM 1623 CG2 VAL A 107 -2.937 3.349 6.838 1.00 0.00 C ATOM 0 H VAL A 107 -5.315 4.501 4.497 1.00 0.00 H new ATOM 0 HA VAL A 107 -4.879 5.175 7.365 1.00 0.00 H new ATOM 0 HB VAL A 107 -2.933 4.691 5.138 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.169 5.331 6.792 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -2.269 6.680 6.422 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.447 5.780 7.946 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -1.889 3.063 6.745 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.211 3.386 7.892 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.560 2.616 6.326 1.00 0.00 H new ATOM 1633 N VAL A 108 -4.976 7.578 6.609 1.00 0.00 N ATOM 1634 CA VAL A 108 -5.114 8.969 6.210 1.00 0.00 C ATOM 1635 C VAL A 108 -3.983 9.755 6.872 1.00 0.00 C ATOM 1636 O VAL A 108 -3.506 9.371 7.943 1.00 0.00 O ATOM 1637 CB VAL A 108 -6.501 9.523 6.593 1.00 0.00 C ATOM 1638 CG1 VAL A 108 -6.809 10.754 5.739 1.00 0.00 C ATOM 1639 CG2 VAL A 108 -7.656 8.527 6.381 1.00 0.00 C ATOM 0 H VAL A 108 -5.008 7.434 7.618 1.00 0.00 H new ATOM 0 HA VAL A 108 -5.041 9.063 5.127 1.00 0.00 H new ATOM 0 HB VAL A 108 -6.442 9.750 7.658 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.789 11.147 6.008 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.051 11.517 5.914 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.807 10.476 4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -8.597 8.993 6.674 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -7.703 8.243 5.330 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -7.487 7.639 6.989 1.00 0.00 H new ATOM 1649 N LYS A 109 -3.548 10.868 6.284 1.00 0.00 N ATOM 1650 CA LYS A 109 -2.718 11.815 7.022 1.00 0.00 C ATOM 1651 C LYS A 109 -3.518 12.366 8.219 1.00 0.00 C ATOM 1652 O LYS A 109 -4.741 12.526 8.105 1.00 0.00 O ATOM 1653 CB LYS A 109 -2.235 12.945 6.100 1.00 0.00 C ATOM 1654 CG LYS A 109 -1.246 12.446 5.028 1.00 0.00 C ATOM 1655 CD LYS A 109 0.050 13.265 4.950 1.00 0.00 C ATOM 1656 CE LYS A 109 0.919 13.084 6.205 1.00 0.00 C ATOM 1657 NZ LYS A 109 2.217 13.777 6.080 1.00 0.00 N ATOM 0 H LYS A 109 -3.751 11.132 5.320 1.00 0.00 H new ATOM 0 HA LYS A 109 -1.831 11.306 7.400 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -3.094 13.404 5.612 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.757 13.720 6.699 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.995 11.406 5.235 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.738 12.468 4.055 1.00 0.00 H new ATOM 0 HD2 LYS A 109 0.617 12.964 4.069 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -0.194 14.320 4.827 1.00 0.00 H new ATOM 0 HE2 LYS A 109 0.385 13.467 7.075 1.00 0.00 H new ATOM 0 HE3 LYS A 109 1.090 12.022 6.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 2.773 13.631 6.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 2.738 13.394 5.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 2.055 14.795 5.940 1.00 0.00 H new ATOM 1671 N PRO A 110 -2.861 12.727 9.334 1.00 0.00 N ATOM 1672 CA PRO A 110 -1.490 12.383 9.682 1.00 0.00 C ATOM 1673 C PRO A 110 -1.420 10.910 10.091 1.00 0.00 C ATOM 1674 O PRO A 110 -2.136 10.477 10.996 1.00 0.00 O ATOM 1675 CB PRO A 110 -1.138 13.293 10.859 1.00 0.00 C ATOM 1676 CG PRO A 110 -2.471 13.519 11.563 1.00 0.00 C ATOM 1677 CD PRO A 110 -3.496 13.432 10.435 1.00 0.00 C ATOM 0 HA PRO A 110 -0.797 12.519 8.852 1.00 0.00 H new ATOM 0 HB2 PRO A 110 -0.411 12.824 11.522 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.701 14.233 10.520 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -2.653 12.764 12.328 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -2.503 14.489 12.059 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -4.390 12.903 10.767 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -3.812 14.428 10.124 1.00 0.00 H new ATOM 1685 N PHE A 111 -0.518 10.146 9.481 1.00 0.00 N ATOM 1686 CA PHE A 111 -0.245 8.776 9.883 1.00 0.00 C ATOM 1687 C PHE A 111 1.201 8.678 10.338 1.00 0.00 C ATOM 1688 O PHE A 111 2.049 9.474 9.933 1.00 0.00 O ATOM 1689 CB PHE A 111 -0.560 7.806 8.748 1.00 0.00 C ATOM 1690 CG PHE A 111 0.225 8.012 7.469 1.00 0.00 C ATOM 1691 CD1 PHE A 111 1.486 7.410 7.326 1.00 0.00 C ATOM 1692 CD2 PHE A 111 -0.320 8.757 6.406 1.00 0.00 C ATOM 1693 CE1 PHE A 111 2.200 7.558 6.128 1.00 0.00 C ATOM 1694 CE2 PHE A 111 0.394 8.899 5.206 1.00 0.00 C ATOM 1695 CZ PHE A 111 1.655 8.297 5.070 1.00 0.00 C ATOM 0 H PHE A 111 0.044 10.464 8.692 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.890 8.496 10.716 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -0.381 6.791 9.102 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.622 7.880 8.516 1.00 0.00 H new ATOM 0 HD1 PHE A 111 1.905 6.834 8.138 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -1.290 9.220 6.514 1.00 0.00 H new ATOM 0 HE1 PHE A 111 3.173 7.101 6.021 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -0.025 9.469 4.390 1.00 0.00 H new ATOM 0 HZ PHE A 111 2.206 8.404 4.147 1.00 0.00 H new ATOM 1705 N THR A 112 1.474 7.681 11.168 1.00 0.00 N ATOM 1706 CA THR A 112 2.772 7.423 11.761 1.00 0.00 C ATOM 1707 C THR A 112 2.954 5.918 11.913 1.00 0.00 C ATOM 1708 O THR A 112 2.060 5.136 11.562 1.00 0.00 O ATOM 1709 CB THR A 112 2.887 8.165 13.105 1.00 0.00 C ATOM 1710 OG1 THR A 112 1.686 8.126 13.858 1.00 0.00 O ATOM 1711 CG2 THR A 112 3.309 9.610 12.896 1.00 0.00 C ATOM 0 H THR A 112 0.767 7.005 11.456 1.00 0.00 H new ATOM 0 HA THR A 112 3.570 7.796 11.119 1.00 0.00 H new ATOM 0 HB THR A 112 3.653 7.640 13.675 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.813 8.609 14.701 1.00 0.00 H new ATOM 0 HG21 THR A 112 3.383 10.111 13.861 1.00 0.00 H new ATOM 0 HG22 THR A 112 4.278 9.638 12.398 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.569 10.119 12.278 1.00 0.00 H new ATOM 1719 N ALA A 113 4.113 5.499 12.423 1.00 0.00 N ATOM 1720 CA ALA A 113 4.435 4.096 12.573 1.00 0.00 C ATOM 1721 C ALA A 113 3.476 3.465 13.581 1.00 0.00 C ATOM 1722 O ALA A 113 3.159 2.294 13.423 1.00 0.00 O ATOM 1723 CB ALA A 113 5.913 3.896 12.920 1.00 0.00 C ATOM 0 H ALA A 113 4.849 6.130 12.741 1.00 0.00 H new ATOM 0 HA ALA A 113 4.296 3.579 11.623 1.00 0.00 H new ATOM 0 HB1 ALA A 113 6.121 2.831 13.026 1.00 0.00 H new ATOM 0 HB2 ALA A 113 6.533 4.310 12.124 1.00 0.00 H new ATOM 0 HB3 ALA A 113 6.139 4.404 13.857 1.00 0.00 H new ATOM 1729 N ALA A 114 2.913 4.255 14.506 1.00 0.00 N ATOM 1730 CA ALA A 114 1.839 3.836 15.396 1.00 0.00 C ATOM 1731 C ALA A 114 0.635 3.251 14.635 1.00 0.00 C ATOM 1732 O ALA A 114 0.051 2.274 15.100 1.00 0.00 O ATOM 1733 CB ALA A 114 1.409 5.025 16.263 1.00 0.00 C ATOM 0 H ALA A 114 3.203 5.222 14.654 1.00 0.00 H new ATOM 0 HA ALA A 114 2.220 3.035 16.029 1.00 0.00 H new ATOM 0 HB1 ALA A 114 0.605 4.716 16.931 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.258 5.371 16.853 1.00 0.00 H new ATOM 0 HB3 ALA A 114 1.058 5.834 15.623 1.00 0.00 H new ATOM 1739 N THR A 115 0.247 3.802 13.476 1.00 0.00 N ATOM 1740 CA THR A 115 -0.799 3.177 12.665 1.00 0.00 C ATOM 1741 C THR A 115 -0.176 2.129 11.736 1.00 0.00 C ATOM 1742 O THR A 115 -0.823 1.131 11.449 1.00 0.00 O ATOM 1743 CB THR A 115 -1.669 4.230 11.940 1.00 0.00 C ATOM 1744 OG1 THR A 115 -3.032 3.857 11.981 1.00 0.00 O ATOM 1745 CG2 THR A 115 -1.359 4.423 10.450 1.00 0.00 C ATOM 0 H THR A 115 0.635 4.662 13.088 1.00 0.00 H new ATOM 0 HA THR A 115 -1.496 2.648 13.315 1.00 0.00 H new ATOM 0 HB THR A 115 -1.444 5.153 12.474 1.00 0.00 H new ATOM 0 HG1 THR A 115 -3.585 4.602 11.665 1.00 0.00 H new ATOM 0 HG21 THR A 115 -2.023 5.182 10.035 1.00 0.00 H new ATOM 0 HG22 THR A 115 -0.324 4.743 10.332 1.00 0.00 H new ATOM 0 HG23 THR A 115 -1.510 3.481 9.922 1.00 0.00 H new ATOM 1753 N LEU A 116 1.066 2.311 11.268 1.00 0.00 N ATOM 1754 CA LEU A 116 1.720 1.347 10.381 1.00 0.00 C ATOM 1755 C LEU A 116 1.734 -0.035 11.051 1.00 0.00 C ATOM 1756 O LEU A 116 1.290 -1.008 10.446 1.00 0.00 O ATOM 1757 CB LEU A 116 3.122 1.866 10.001 1.00 0.00 C ATOM 1758 CG LEU A 116 3.794 1.281 8.743 1.00 0.00 C ATOM 1759 CD1 LEU A 116 4.108 -0.203 8.880 1.00 0.00 C ATOM 1760 CD2 LEU A 116 2.992 1.535 7.459 1.00 0.00 C ATOM 0 H LEU A 116 1.639 3.124 11.493 1.00 0.00 H new ATOM 0 HA LEU A 116 1.167 1.236 9.448 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.054 2.946 9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 116 3.785 1.687 10.847 1.00 0.00 H new ATOM 0 HG LEU A 116 4.738 1.820 8.656 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.580 -0.561 7.965 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.785 -0.356 9.721 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.185 -0.756 9.052 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.518 1.099 6.609 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.006 1.078 7.549 1.00 0.00 H new ATOM 0 HD23 LEU A 116 2.882 2.608 7.305 1.00 0.00 H new ATOM 1772 N GLU A 117 2.158 -0.110 12.317 1.00 0.00 N ATOM 1773 CA GLU A 117 2.146 -1.344 13.095 1.00 0.00 C ATOM 1774 C GLU A 117 0.728 -1.875 13.288 1.00 0.00 C ATOM 1775 O GLU A 117 0.533 -3.081 13.250 1.00 0.00 O ATOM 1776 CB GLU A 117 2.854 -1.169 14.449 1.00 0.00 C ATOM 1777 CG GLU A 117 2.150 -0.246 15.447 1.00 0.00 C ATOM 1778 CD GLU A 117 2.851 -0.248 16.798 1.00 0.00 C ATOM 1779 OE1 GLU A 117 3.777 0.564 17.017 1.00 0.00 O ATOM 1780 OE2 GLU A 117 2.473 -1.073 17.662 1.00 0.00 O ATOM 0 H GLU A 117 2.521 0.693 12.831 1.00 0.00 H new ATOM 0 HA GLU A 117 2.703 -2.085 12.522 1.00 0.00 H new ATOM 0 HB2 GLU A 117 2.970 -2.151 14.908 1.00 0.00 H new ATOM 0 HB3 GLU A 117 3.857 -0.782 14.268 1.00 0.00 H new ATOM 0 HG2 GLU A 117 2.125 0.769 15.050 1.00 0.00 H new ATOM 0 HG3 GLU A 117 1.115 -0.565 15.572 1.00 0.00 H new ATOM 1787 N GLU A 118 -0.269 -1.002 13.456 1.00 0.00 N ATOM 1788 CA GLU A 118 -1.650 -1.417 13.652 1.00 0.00 C ATOM 1789 C GLU A 118 -2.160 -2.085 12.375 1.00 0.00 C ATOM 1790 O GLU A 118 -2.784 -3.141 12.422 1.00 0.00 O ATOM 1791 CB GLU A 118 -2.517 -0.200 14.005 1.00 0.00 C ATOM 1792 CG GLU A 118 -3.925 -0.614 14.442 1.00 0.00 C ATOM 1793 CD GLU A 118 -4.943 0.495 14.187 1.00 0.00 C ATOM 1794 OE1 GLU A 118 -5.455 0.597 13.049 1.00 0.00 O ATOM 1795 OE2 GLU A 118 -5.258 1.263 15.125 1.00 0.00 O ATOM 0 H GLU A 118 -0.136 0.009 13.459 1.00 0.00 H new ATOM 0 HA GLU A 118 -1.706 -2.130 14.475 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -2.040 0.367 14.805 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -2.584 0.462 13.141 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -4.224 -1.513 13.903 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -3.918 -0.865 15.503 1.00 0.00 H new ATOM 1802 N LYS A 119 -1.919 -1.464 11.221 1.00 0.00 N ATOM 1803 CA LYS A 119 -2.358 -1.961 9.925 1.00 0.00 C ATOM 1804 C LYS A 119 -1.651 -3.283 9.641 1.00 0.00 C ATOM 1805 O LYS A 119 -2.329 -4.233 9.250 1.00 0.00 O ATOM 1806 CB LYS A 119 -2.114 -0.886 8.850 1.00 0.00 C ATOM 1807 CG LYS A 119 -3.247 0.157 8.725 1.00 0.00 C ATOM 1808 CD LYS A 119 -3.733 0.813 10.027 1.00 0.00 C ATOM 1809 CE LYS A 119 -4.923 1.740 9.788 1.00 0.00 C ATOM 1810 NZ LYS A 119 -5.313 2.438 11.030 1.00 0.00 N ATOM 0 H LYS A 119 -1.404 -0.586 11.164 1.00 0.00 H new ATOM 0 HA LYS A 119 -3.429 -2.162 9.918 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -1.182 -0.368 9.076 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -1.980 -1.377 7.886 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -2.910 0.946 8.053 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -4.101 -0.325 8.248 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -4.014 0.039 10.741 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -2.916 1.379 10.475 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -4.669 2.471 9.021 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -5.767 1.163 9.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.134 3.048 10.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -5.561 1.738 11.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -4.519 3.020 11.365 1.00 0.00 H new ATOM 1824 N LEU A 120 -0.337 -3.365 9.886 1.00 0.00 N ATOM 1825 CA LEU A 120 0.424 -4.610 9.818 1.00 0.00 C ATOM 1826 C LEU A 120 -0.208 -5.663 10.722 1.00 0.00 C ATOM 1827 O LEU A 120 -0.523 -6.749 10.254 1.00 0.00 O ATOM 1828 CB LEU A 120 1.899 -4.405 10.210 1.00 0.00 C ATOM 1829 CG LEU A 120 2.796 -3.784 9.127 1.00 0.00 C ATOM 1830 CD1 LEU A 120 4.218 -3.619 9.679 1.00 0.00 C ATOM 1831 CD2 LEU A 120 2.849 -4.625 7.847 1.00 0.00 C ATOM 0 H LEU A 120 0.230 -2.556 10.140 1.00 0.00 H new ATOM 0 HA LEU A 120 0.398 -4.951 8.783 1.00 0.00 H new ATOM 0 HB2 LEU A 120 1.936 -3.769 11.095 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.318 -5.370 10.493 1.00 0.00 H new ATOM 0 HG LEU A 120 2.364 -2.818 8.865 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.857 -3.179 8.913 1.00 0.00 H new ATOM 0 HD12 LEU A 120 4.196 -2.967 10.552 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.613 -4.594 9.964 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.497 -4.138 7.118 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.243 -5.615 8.078 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.845 -4.721 7.433 1.00 0.00 H new ATOM 1843 N ASN A 121 -0.424 -5.354 11.999 1.00 0.00 N ATOM 1844 CA ASN A 121 -1.001 -6.278 12.964 1.00 0.00 C ATOM 1845 C ASN A 121 -2.365 -6.779 12.494 1.00 0.00 C ATOM 1846 O ASN A 121 -2.598 -7.986 12.502 1.00 0.00 O ATOM 1847 CB ASN A 121 -1.093 -5.629 14.348 1.00 0.00 C ATOM 1848 CG ASN A 121 -1.713 -6.590 15.350 1.00 0.00 C ATOM 1849 OD1 ASN A 121 -1.349 -7.760 15.409 1.00 0.00 O ATOM 1850 ND2 ASN A 121 -2.654 -6.121 16.145 1.00 0.00 N ATOM 0 H ASN A 121 -0.199 -4.441 12.395 1.00 0.00 H new ATOM 0 HA ASN A 121 -0.342 -7.143 13.043 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -0.099 -5.336 14.685 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -1.691 -4.720 14.290 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -3.097 -6.735 16.829 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -2.939 -5.144 16.077 1.00 0.00 H new ATOM 1857 N LYS A 122 -3.245 -5.888 12.015 1.00 0.00 N ATOM 1858 CA LYS A 122 -4.519 -6.304 11.436 1.00 0.00 C ATOM 1859 C LYS A 122 -4.280 -7.335 10.352 1.00 0.00 C ATOM 1860 O LYS A 122 -4.901 -8.383 10.414 1.00 0.00 O ATOM 1861 CB LYS A 122 -5.355 -5.144 10.863 1.00 0.00 C ATOM 1862 CG LYS A 122 -6.465 -4.656 11.811 1.00 0.00 C ATOM 1863 CD LYS A 122 -6.025 -3.480 12.685 1.00 0.00 C ATOM 1864 CE LYS A 122 -5.890 -2.197 11.854 1.00 0.00 C ATOM 1865 NZ LYS A 122 -7.196 -1.562 11.600 1.00 0.00 N ATOM 0 H LYS A 122 -3.094 -4.879 12.019 1.00 0.00 H new ATOM 0 HA LYS A 122 -5.098 -6.728 12.256 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -4.693 -4.309 10.633 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.806 -5.462 9.923 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -7.334 -4.361 11.223 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -6.778 -5.481 12.451 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.750 -3.325 13.484 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -5.072 -3.712 13.160 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.241 -1.494 12.376 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.409 -2.430 10.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.370 -1.525 10.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.947 -2.116 12.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.193 -0.596 11.986 1.00 0.00 H new ATOM 1879 N ILE A 123 -3.473 -7.052 9.333 1.00 0.00 N ATOM 1880 CA ILE A 123 -3.402 -7.935 8.168 1.00 0.00 C ATOM 1881 C ILE A 123 -2.600 -9.214 8.446 1.00 0.00 C ATOM 1882 O ILE A 123 -2.920 -10.264 7.879 1.00 0.00 O ATOM 1883 CB ILE A 123 -2.960 -7.149 6.916 1.00 0.00 C ATOM 1884 CG1 ILE A 123 -1.563 -6.508 7.061 1.00 0.00 C ATOM 1885 CG2 ILE A 123 -4.087 -6.141 6.611 1.00 0.00 C ATOM 1886 CD1 ILE A 123 -1.316 -5.234 6.250 1.00 0.00 C ATOM 0 H ILE A 123 -2.867 -6.233 9.287 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.404 -8.303 7.950 1.00 0.00 H new ATOM 0 HB ILE A 123 -2.825 -7.820 6.067 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -1.398 -6.281 8.114 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.815 -7.247 6.774 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -3.823 -5.556 5.730 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.016 -6.680 6.425 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -4.219 -5.474 7.463 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.303 -4.877 6.433 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -1.439 -5.449 5.188 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.030 -4.467 6.550 1.00 0.00 H new ATOM 1898 N PHE A 124 -1.642 -9.169 9.371 1.00 0.00 N ATOM 1899 CA PHE A 124 -1.016 -10.351 9.939 1.00 0.00 C ATOM 1900 C PHE A 124 -2.103 -11.259 10.500 1.00 0.00 C ATOM 1901 O PHE A 124 -2.262 -12.390 10.046 1.00 0.00 O ATOM 1902 CB PHE A 124 -0.033 -9.959 11.048 1.00 0.00 C ATOM 1903 CG PHE A 124 1.249 -9.223 10.672 1.00 0.00 C ATOM 1904 CD1 PHE A 124 1.822 -9.302 9.387 1.00 0.00 C ATOM 1905 CD2 PHE A 124 1.901 -8.456 11.658 1.00 0.00 C ATOM 1906 CE1 PHE A 124 3.001 -8.595 9.088 1.00 0.00 C ATOM 1907 CE2 PHE A 124 3.089 -7.768 11.370 1.00 0.00 C ATOM 1908 CZ PHE A 124 3.636 -7.826 10.078 1.00 0.00 C ATOM 0 H PHE A 124 -1.277 -8.295 9.749 1.00 0.00 H new ATOM 0 HA PHE A 124 -0.459 -10.875 9.163 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.573 -9.337 11.762 1.00 0.00 H new ATOM 0 HB3 PHE A 124 0.253 -10.871 11.572 1.00 0.00 H new ATOM 0 HD1 PHE A 124 1.353 -9.909 8.627 1.00 0.00 H new ATOM 0 HD2 PHE A 124 1.480 -8.397 12.651 1.00 0.00 H new ATOM 0 HE1 PHE A 124 3.420 -8.643 8.094 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.582 -7.195 12.141 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.540 -7.282 9.846 1.00 0.00 H new ATOM 1918 N GLU A 125 -2.874 -10.762 11.466 1.00 0.00 N ATOM 1919 CA GLU A 125 -3.842 -11.570 12.189 1.00 0.00 C ATOM 1920 C GLU A 125 -4.964 -12.004 11.241 1.00 0.00 C ATOM 1921 O GLU A 125 -5.328 -13.177 11.160 1.00 0.00 O ATOM 1922 CB GLU A 125 -4.427 -10.748 13.358 1.00 0.00 C ATOM 1923 CG GLU A 125 -3.430 -10.250 14.421 1.00 0.00 C ATOM 1924 CD GLU A 125 -3.249 -11.203 15.599 1.00 0.00 C ATOM 1925 OE1 GLU A 125 -4.095 -11.196 16.520 1.00 0.00 O ATOM 1926 OE2 GLU A 125 -2.239 -11.944 15.627 1.00 0.00 O ATOM 0 H GLU A 125 -2.842 -9.788 11.766 1.00 0.00 H new ATOM 0 HA GLU A 125 -3.350 -12.458 12.586 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -4.941 -9.882 12.941 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.181 -11.356 13.857 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -2.462 -10.086 13.948 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -3.768 -9.284 14.797 1.00 0.00 H new ATOM 1933 N LYS A 126 -5.559 -11.031 10.553 1.00 0.00 N ATOM 1934 CA LYS A 126 -6.831 -11.150 9.858 1.00 0.00 C ATOM 1935 C LYS A 126 -6.671 -11.917 8.561 1.00 0.00 C ATOM 1936 O LYS A 126 -7.339 -12.932 8.379 1.00 0.00 O ATOM 1937 CB LYS A 126 -7.388 -9.744 9.629 1.00 0.00 C ATOM 1938 CG LYS A 126 -8.828 -9.760 9.129 1.00 0.00 C ATOM 1939 CD LYS A 126 -9.351 -8.325 9.062 1.00 0.00 C ATOM 1940 CE LYS A 126 -8.993 -7.608 7.750 1.00 0.00 C ATOM 1941 NZ LYS A 126 -10.189 -7.125 7.029 1.00 0.00 N ATOM 0 H LYS A 126 -5.148 -10.102 10.463 1.00 0.00 H new ATOM 0 HA LYS A 126 -7.538 -11.718 10.463 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -7.337 -9.180 10.561 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -6.762 -9.222 8.906 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -8.879 -10.225 8.144 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -9.451 -10.356 9.796 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -10.435 -8.335 9.179 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -8.945 -7.758 9.900 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -8.337 -6.765 7.967 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -8.435 -8.289 7.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -9.897 -6.649 6.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -10.804 -7.931 6.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -10.709 -6.454 7.630 1.00 0.00 H new ATOM 1955 N LEU A 127 -5.845 -11.411 7.641 1.00 0.00 N ATOM 1956 CA LEU A 127 -5.619 -12.085 6.372 1.00 0.00 C ATOM 1957 C LEU A 127 -4.842 -13.373 6.612 1.00 0.00 C ATOM 1958 O LEU A 127 -5.029 -14.335 5.863 1.00 0.00 O ATOM 1959 CB LEU A 127 -4.814 -11.223 5.385 1.00 0.00 C ATOM 1960 CG LEU A 127 -5.198 -9.740 5.254 1.00 0.00 C ATOM 1961 CD1 LEU A 127 -4.477 -9.154 4.039 1.00 0.00 C ATOM 1962 CD2 LEU A 127 -6.705 -9.499 5.151 1.00 0.00 C ATOM 0 H LEU A 127 -5.326 -10.540 7.756 1.00 0.00 H new ATOM 0 HA LEU A 127 -6.599 -12.284 5.939 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -3.764 -11.273 5.674 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -4.895 -11.679 4.398 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.886 -9.240 6.171 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -4.740 -8.101 3.933 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -3.400 -9.247 4.175 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -4.777 -9.695 3.142 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.897 -8.430 5.061 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.096 -10.013 4.273 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -7.197 -9.882 6.045 1.00 0.00 H new ATOM 1974 N GLY A 128 -3.971 -13.386 7.623 1.00 0.00 N ATOM 1975 CA GLY A 128 -2.915 -14.370 7.749 1.00 0.00 C ATOM 1976 C GLY A 128 -1.701 -13.896 6.957 1.00 0.00 C ATOM 1977 O GLY A 128 -1.161 -14.684 6.181 1.00 0.00 O ATOM 0 H GLY A 128 -3.986 -12.703 8.381 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.651 -14.507 8.798 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -3.254 -15.337 7.377 1.00 0.00 H new ATOM 1981 N MET A 129 -1.315 -12.614 7.058 1.00 0.00 N ATOM 1982 CA MET A 129 -0.025 -12.177 6.503 1.00 0.00 C ATOM 1983 C MET A 129 1.108 -12.564 7.449 1.00 0.00 C ATOM 1984 O MET A 129 2.280 -12.531 7.018 1.00 0.00 O ATOM 1985 CB MET A 129 0.005 -10.671 6.199 1.00 0.00 C ATOM 1986 CG MET A 129 -0.854 -10.247 5.009 1.00 0.00 C ATOM 1987 SD MET A 129 -0.475 -11.052 3.426 1.00 0.00 S ATOM 1988 CE MET A 129 -1.871 -12.203 3.310 1.00 0.00 C ATOM 1989 OXT MET A 129 0.842 -12.911 8.618 1.00 0.00 O ATOM 0 H MET A 129 -1.862 -11.879 7.507 1.00 0.00 H new ATOM 0 HA MET A 129 0.112 -12.689 5.550 1.00 0.00 H new ATOM 0 HB2 MET A 129 -0.329 -10.128 7.083 1.00 0.00 H new ATOM 0 HB3 MET A 129 1.036 -10.372 6.011 1.00 0.00 H new ATOM 0 HG2 MET A 129 -1.898 -10.442 5.252 1.00 0.00 H new ATOM 0 HG3 MET A 129 -0.753 -9.169 4.879 1.00 0.00 H new ATOM 0 HE1 MET A 129 -1.791 -12.780 2.389 1.00 0.00 H new ATOM 0 HE2 MET A 129 -1.856 -12.880 4.164 1.00 0.00 H new ATOM 0 HE3 MET A 129 -2.806 -11.642 3.307 1.00 0.00 H new TER 1999 MET A 129