USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 938 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 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 17 SER OG : rot 180:sc= 0 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 2 LYS NZ :NH3+ 154:sc= 0.0155 (180deg=-0.0871) USER MOD Single : A 7 SER OG : rot 135:sc= 0.857 USER MOD Single : A 8 SER OG : rot 167:sc= 0.00779 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.103 USER MOD Single : A 25 TYR OH : rot 33:sc= 0.0159 USER MOD Single : A 27 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 31 MET CE :methyl 141:sc= -2.28 (180deg=-6.2!) USER MOD Single : A 35 ASN : amide:sc= -0.284 K(o=-0.28,f=-3.2!) USER MOD Single : A 38 SER OG : rot -150:sc= -0.555 USER MOD Single : A 39 SER OG : rot 42:sc= 0.211 USER MOD Single : A 44 ASN :FLIP amide:sc= -0.809 F(o=-1.6,f=-0.81) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 ASN :FLIP amide:sc= 1.22 F(o=-0.0019,f=1.2) USER MOD Single : A 64 ASN : amide:sc= -0.397 X(o=-0.4,f=-0.11) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 170:sc= -0.571 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.11 K(o=-0.11,f=-2.4!) USER MOD Single : A 83 ASN : amide:sc= -0.707 K(o=-0.71,f=-2.2!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.052 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 74:sc= 0.0892 USER MOD Single : A 100 ASN : amide:sc= -1.87 K(o=-1.9,f=-6.3!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot -109:sc= 0.0639 USER MOD Single : A 108 ASN : amide:sc= -0.0447 K(o=-0.045,f=-1.1) USER MOD Single : A 114 SER OG : rot 180:sc= -0.713 USER MOD Single : A 117 SER OG : rot -32:sc= 0.381 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.067 3.926 -3.764 1.00 0.00 N ATOM 2 CA MET A 1 7.775 2.585 -4.344 1.00 0.00 C ATOM 3 C MET A 1 6.665 1.910 -3.535 1.00 0.00 C ATOM 4 O MET A 1 6.922 1.201 -2.582 1.00 0.00 O ATOM 5 CB MET A 1 9.038 1.723 -4.297 1.00 0.00 C ATOM 6 CG MET A 1 8.685 0.279 -4.654 1.00 0.00 C ATOM 7 SD MET A 1 10.158 -0.760 -4.493 1.00 0.00 S ATOM 8 CE MET A 1 9.441 -2.002 -3.391 1.00 0.00 C ATOM 0 H1 MET A 1 8.821 4.385 -4.313 1.00 0.00 H new ATOM 0 H2 MET A 1 7.209 4.513 -3.797 1.00 0.00 H new ATOM 0 H3 MET A 1 8.375 3.818 -2.777 1.00 0.00 H new ATOM 0 HA MET A 1 7.452 2.699 -5.379 1.00 0.00 H new ATOM 0 HB2 MET A 1 9.781 2.110 -4.995 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.482 1.764 -3.303 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.896 -0.087 -3.997 1.00 0.00 H new ATOM 0 HG3 MET A 1 8.301 0.229 -5.673 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.191 -2.757 -3.157 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.108 -1.523 -2.470 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.590 -2.476 -3.881 1.00 0.00 H new ATOM 20 N LYS A 2 5.432 2.124 -3.906 1.00 0.00 N ATOM 21 CA LYS A 2 4.309 1.494 -3.156 1.00 0.00 C ATOM 22 C LYS A 2 3.348 0.825 -4.141 1.00 0.00 C ATOM 23 O LYS A 2 3.280 1.185 -5.300 1.00 0.00 O ATOM 24 CB LYS A 2 3.561 2.566 -2.360 1.00 0.00 C ATOM 25 CG LYS A 2 4.532 3.270 -1.412 1.00 0.00 C ATOM 26 CD LYS A 2 4.462 4.781 -1.638 1.00 0.00 C ATOM 27 CE LYS A 2 5.632 5.462 -0.926 1.00 0.00 C ATOM 28 NZ LYS A 2 5.168 6.009 0.380 1.00 0.00 N ATOM 0 H LYS A 2 5.154 2.707 -4.695 1.00 0.00 H new ATOM 0 HA LYS A 2 4.706 0.745 -2.471 1.00 0.00 H new ATOM 0 HB2 LYS A 2 3.111 3.290 -3.039 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.748 2.112 -1.793 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.282 3.035 -0.378 1.00 0.00 H new ATOM 0 HG3 LYS A 2 5.547 2.913 -1.584 1.00 0.00 H new ATOM 0 HD2 LYS A 2 4.495 5.001 -2.705 1.00 0.00 H new ATOM 0 HD3 LYS A 2 3.517 5.172 -1.261 1.00 0.00 H new ATOM 0 HE2 LYS A 2 6.440 4.748 -0.767 1.00 0.00 H new ATOM 0 HE3 LYS A 2 6.032 6.264 -1.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 5.972 6.067 1.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 4.769 6.959 0.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.439 5.384 0.779 1.00 0.00 H new ATOM 42 N ILE A 3 2.605 -0.149 -3.688 1.00 0.00 N ATOM 43 CA ILE A 3 1.651 -0.845 -4.596 1.00 0.00 C ATOM 44 C ILE A 3 0.218 -0.606 -4.114 1.00 0.00 C ATOM 45 O ILE A 3 -0.211 -1.153 -3.118 1.00 0.00 O ATOM 46 CB ILE A 3 1.944 -2.346 -4.594 1.00 0.00 C ATOM 47 CG1 ILE A 3 3.334 -2.592 -5.185 1.00 0.00 C ATOM 48 CG2 ILE A 3 0.897 -3.077 -5.437 1.00 0.00 C ATOM 49 CD1 ILE A 3 4.051 -3.673 -4.376 1.00 0.00 C ATOM 0 H ILE A 3 2.618 -0.492 -2.728 1.00 0.00 H new ATOM 0 HA ILE A 3 1.765 -0.454 -5.607 1.00 0.00 H new ATOM 0 HB ILE A 3 1.909 -2.720 -3.571 1.00 0.00 H new ATOM 0 HG12 ILE A 3 3.248 -2.900 -6.227 1.00 0.00 H new ATOM 0 HG13 ILE A 3 3.914 -1.669 -5.173 1.00 0.00 H new ATOM 0 HG21 ILE A 3 1.109 -4.146 -5.433 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -0.094 -2.902 -5.018 1.00 0.00 H new ATOM 0 HG23 ILE A 3 0.929 -2.704 -6.461 1.00 0.00 H new ATOM 0 HD11 ILE A 3 5.041 -3.847 -4.798 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.150 -3.347 -3.341 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.474 -4.597 -4.412 1.00 0.00 H new ATOM 61 N ALA A 4 -0.526 0.201 -4.818 1.00 0.00 N ATOM 62 CA ALA A 4 -1.931 0.469 -4.407 1.00 0.00 C ATOM 63 C ALA A 4 -2.869 -0.436 -5.208 1.00 0.00 C ATOM 64 O ALA A 4 -2.457 -1.100 -6.138 1.00 0.00 O ATOM 65 CB ALA A 4 -2.273 1.934 -4.682 1.00 0.00 C ATOM 0 H ALA A 4 -0.221 0.687 -5.661 1.00 0.00 H new ATOM 0 HA ALA A 4 -2.048 0.267 -3.342 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -3.302 2.130 -4.381 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -1.600 2.577 -4.115 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -2.161 2.140 -5.746 1.00 0.00 H new ATOM 71 N ILE A 5 -4.124 -0.473 -4.856 1.00 0.00 N ATOM 72 CA ILE A 5 -5.074 -1.343 -5.602 1.00 0.00 C ATOM 73 C ILE A 5 -6.466 -0.707 -5.610 1.00 0.00 C ATOM 74 O ILE A 5 -7.064 -0.485 -4.576 1.00 0.00 O ATOM 75 CB ILE A 5 -5.149 -2.712 -4.924 1.00 0.00 C ATOM 76 CG1 ILE A 5 -3.780 -3.392 -4.993 1.00 0.00 C ATOM 77 CG2 ILE A 5 -6.185 -3.580 -5.641 1.00 0.00 C ATOM 78 CD1 ILE A 5 -3.795 -4.657 -4.133 1.00 0.00 C ATOM 0 H ILE A 5 -4.531 0.059 -4.087 1.00 0.00 H new ATOM 0 HA ILE A 5 -4.724 -1.458 -6.628 1.00 0.00 H new ATOM 0 HB ILE A 5 -5.440 -2.585 -3.881 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -3.539 -3.644 -6.026 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -3.005 -2.710 -4.642 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -6.239 -4.556 -5.158 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -7.161 -3.097 -5.592 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -5.894 -3.707 -6.684 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -2.820 -5.142 -4.182 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -4.017 -4.392 -3.099 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -4.559 -5.340 -4.504 1.00 0.00 H new ATOM 90 N ALA A 6 -6.990 -0.420 -6.770 1.00 0.00 N ATOM 91 CA ALA A 6 -8.347 0.192 -6.845 1.00 0.00 C ATOM 92 C ALA A 6 -9.395 -0.923 -6.857 1.00 0.00 C ATOM 93 O ALA A 6 -9.185 -1.975 -7.429 1.00 0.00 O ATOM 94 CB ALA A 6 -8.466 1.020 -8.126 1.00 0.00 C ATOM 0 H ALA A 6 -6.537 -0.583 -7.669 1.00 0.00 H new ATOM 0 HA ALA A 6 -8.507 0.840 -5.983 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -9.459 1.467 -8.179 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -7.713 1.808 -8.121 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.311 0.376 -8.991 1.00 0.00 H new ATOM 100 N SER A 7 -10.520 -0.710 -6.231 1.00 0.00 N ATOM 101 CA SER A 7 -11.566 -1.771 -6.212 1.00 0.00 C ATOM 102 C SER A 7 -11.009 -3.012 -5.510 1.00 0.00 C ATOM 103 O SER A 7 -10.560 -3.948 -6.142 1.00 0.00 O ATOM 104 CB SER A 7 -11.956 -2.130 -7.645 1.00 0.00 C ATOM 105 OG SER A 7 -13.075 -1.345 -8.037 1.00 0.00 O ATOM 0 H SER A 7 -10.759 0.148 -5.734 1.00 0.00 H new ATOM 0 HA SER A 7 -12.445 -1.409 -5.678 1.00 0.00 H new ATOM 0 HB2 SER A 7 -11.118 -1.951 -8.318 1.00 0.00 H new ATOM 0 HB3 SER A 7 -12.199 -3.190 -7.713 1.00 0.00 H new ATOM 0 HG SER A 7 -12.928 -0.993 -8.940 1.00 0.00 H new ATOM 111 N SER A 8 -11.030 -3.023 -4.206 1.00 0.00 N ATOM 112 CA SER A 8 -10.499 -4.198 -3.460 1.00 0.00 C ATOM 113 C SER A 8 -11.459 -4.550 -2.320 1.00 0.00 C ATOM 114 O SER A 8 -11.681 -5.705 -2.016 1.00 0.00 O ATOM 115 CB SER A 8 -9.116 -3.856 -2.892 1.00 0.00 C ATOM 116 OG SER A 8 -9.130 -3.995 -1.476 1.00 0.00 O ATOM 0 H SER A 8 -11.393 -2.268 -3.624 1.00 0.00 H new ATOM 0 HA SER A 8 -10.410 -5.052 -4.131 1.00 0.00 H new ATOM 0 HB2 SER A 8 -8.362 -4.514 -3.324 1.00 0.00 H new ATOM 0 HB3 SER A 8 -8.843 -2.837 -3.164 1.00 0.00 H new ATOM 0 HG SER A 8 -8.211 -3.977 -1.136 1.00 0.00 H new ATOM 122 N GLY A 9 -12.030 -3.562 -1.688 1.00 0.00 N ATOM 123 CA GLY A 9 -12.975 -3.838 -0.568 1.00 0.00 C ATOM 124 C GLY A 9 -12.237 -3.712 0.765 1.00 0.00 C ATOM 125 O GLY A 9 -11.099 -3.287 0.820 1.00 0.00 O ATOM 0 H GLY A 9 -11.883 -2.575 -1.898 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.810 -3.138 -0.601 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -13.395 -4.839 -0.670 1.00 0.00 H new ATOM 129 N THR A 10 -12.874 -4.078 1.843 1.00 0.00 N ATOM 130 CA THR A 10 -12.208 -3.978 3.172 1.00 0.00 C ATOM 131 C THR A 10 -11.390 -5.246 3.429 1.00 0.00 C ATOM 132 O THR A 10 -10.904 -5.473 4.519 1.00 0.00 O ATOM 133 CB THR A 10 -13.269 -3.825 4.265 1.00 0.00 C ATOM 134 OG1 THR A 10 -14.559 -4.011 3.699 1.00 0.00 O ATOM 135 CG2 THR A 10 -13.176 -2.426 4.876 1.00 0.00 C ATOM 0 H THR A 10 -13.827 -4.442 1.861 1.00 0.00 H new ATOM 0 HA THR A 10 -11.548 -3.111 3.183 1.00 0.00 H new ATOM 0 HB THR A 10 -13.101 -4.571 5.042 1.00 0.00 H new ATOM 0 HG1 THR A 10 -15.240 -3.915 4.398 1.00 0.00 H new ATOM 0 HG21 THR A 10 -13.932 -2.318 5.654 1.00 0.00 H new ATOM 0 HG22 THR A 10 -12.186 -2.283 5.309 1.00 0.00 H new ATOM 0 HG23 THR A 10 -13.344 -1.678 4.101 1.00 0.00 H new ATOM 143 N ASP A 11 -11.234 -6.074 2.432 1.00 0.00 N ATOM 144 CA ASP A 11 -10.449 -7.326 2.616 1.00 0.00 C ATOM 145 C ASP A 11 -10.215 -7.986 1.256 1.00 0.00 C ATOM 146 O ASP A 11 -10.552 -7.439 0.224 1.00 0.00 O ATOM 147 CB ASP A 11 -11.224 -8.285 3.521 1.00 0.00 C ATOM 148 CG ASP A 11 -12.483 -8.763 2.795 1.00 0.00 C ATOM 149 OD1 ASP A 11 -12.765 -8.237 1.732 1.00 0.00 O ATOM 150 OD2 ASP A 11 -13.145 -9.645 3.316 1.00 0.00 O ATOM 0 H ASP A 11 -11.617 -5.936 1.497 1.00 0.00 H new ATOM 0 HA ASP A 11 -9.489 -7.089 3.075 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -10.598 -9.137 3.787 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -11.495 -7.786 4.451 1.00 0.00 H new ATOM 155 N LEU A 12 -9.642 -9.158 1.244 1.00 0.00 N ATOM 156 CA LEU A 12 -9.389 -9.851 -0.050 1.00 0.00 C ATOM 157 C LEU A 12 -10.702 -10.427 -0.585 1.00 0.00 C ATOM 158 O LEU A 12 -10.838 -10.700 -1.761 1.00 0.00 O ATOM 159 CB LEU A 12 -8.385 -10.985 0.167 1.00 0.00 C ATOM 160 CG LEU A 12 -9.001 -12.049 1.077 1.00 0.00 C ATOM 161 CD1 LEU A 12 -8.595 -13.439 0.584 1.00 0.00 C ATOM 162 CD2 LEU A 12 -8.495 -11.851 2.508 1.00 0.00 C ATOM 0 H LEU A 12 -9.338 -9.666 2.075 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.984 -9.140 -0.770 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.108 -11.427 -0.790 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -7.471 -10.594 0.614 1.00 0.00 H new ATOM 0 HG LEU A 12 -10.087 -11.958 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.034 -14.197 1.232 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.953 -13.582 -0.436 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -7.509 -13.529 0.604 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -8.934 -12.609 3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.409 -11.942 2.526 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -8.782 -10.861 2.862 1.00 0.00 H new ATOM 174 N GLY A 13 -11.668 -10.617 0.272 1.00 0.00 N ATOM 175 CA GLY A 13 -12.972 -11.178 -0.184 1.00 0.00 C ATOM 176 C GLY A 13 -13.427 -10.456 -1.454 1.00 0.00 C ATOM 177 O GLY A 13 -13.853 -11.074 -2.410 1.00 0.00 O ATOM 0 H GLY A 13 -11.611 -10.408 1.269 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -12.872 -12.246 -0.377 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -13.722 -11.065 0.599 1.00 0.00 H new ATOM 181 N SER A 14 -13.340 -9.155 -1.473 1.00 0.00 N ATOM 182 CA SER A 14 -13.769 -8.399 -2.684 1.00 0.00 C ATOM 183 C SER A 14 -12.701 -8.532 -3.772 1.00 0.00 C ATOM 184 O SER A 14 -11.878 -7.658 -3.957 1.00 0.00 O ATOM 185 CB SER A 14 -13.953 -6.924 -2.326 1.00 0.00 C ATOM 186 OG SER A 14 -15.338 -6.603 -2.358 1.00 0.00 O ATOM 0 H SER A 14 -12.991 -8.583 -0.704 1.00 0.00 H new ATOM 0 HA SER A 14 -14.713 -8.803 -3.050 1.00 0.00 H new ATOM 0 HB2 SER A 14 -13.544 -6.724 -1.335 1.00 0.00 H new ATOM 0 HB3 SER A 14 -13.406 -6.296 -3.029 1.00 0.00 H new ATOM 0 HG SER A 14 -15.460 -5.658 -2.127 1.00 0.00 H new ATOM 192 N GLU A 15 -12.710 -9.619 -4.493 1.00 0.00 N ATOM 193 CA GLU A 15 -11.700 -9.810 -5.570 1.00 0.00 C ATOM 194 C GLU A 15 -12.039 -8.899 -6.750 1.00 0.00 C ATOM 195 O GLU A 15 -12.661 -9.315 -7.707 1.00 0.00 O ATOM 196 CB GLU A 15 -11.713 -11.269 -6.032 1.00 0.00 C ATOM 197 CG GLU A 15 -13.154 -11.704 -6.310 1.00 0.00 C ATOM 198 CD GLU A 15 -13.272 -12.184 -7.758 1.00 0.00 C ATOM 199 OE1 GLU A 15 -12.479 -13.025 -8.150 1.00 0.00 O ATOM 200 OE2 GLU A 15 -14.156 -11.705 -8.450 1.00 0.00 O ATOM 0 H GLU A 15 -13.375 -10.384 -4.382 1.00 0.00 H new ATOM 0 HA GLU A 15 -10.710 -9.560 -5.188 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -11.108 -11.382 -6.932 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -11.270 -11.908 -5.268 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -13.442 -12.503 -5.626 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -13.836 -10.872 -6.135 1.00 0.00 H new ATOM 207 N VAL A 16 -11.637 -7.659 -6.685 1.00 0.00 N ATOM 208 CA VAL A 16 -11.935 -6.714 -7.799 1.00 0.00 C ATOM 209 C VAL A 16 -13.389 -6.250 -7.699 1.00 0.00 C ATOM 210 O VAL A 16 -14.248 -6.711 -8.424 1.00 0.00 O ATOM 211 CB VAL A 16 -11.715 -7.416 -9.140 1.00 0.00 C ATOM 212 CG1 VAL A 16 -11.529 -6.372 -10.240 1.00 0.00 C ATOM 213 CG2 VAL A 16 -10.465 -8.294 -9.055 1.00 0.00 C ATOM 0 H VAL A 16 -11.114 -7.259 -5.906 1.00 0.00 H new ATOM 0 HA VAL A 16 -11.272 -5.852 -7.729 1.00 0.00 H new ATOM 0 HB VAL A 16 -12.581 -8.035 -9.371 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -11.372 -6.874 -11.195 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -12.419 -5.745 -10.301 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -10.663 -5.751 -10.010 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -10.307 -8.795 -10.010 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -9.600 -7.673 -8.823 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -10.597 -9.040 -8.271 1.00 0.00 H new ATOM 223 N SER A 17 -13.673 -5.340 -6.806 1.00 0.00 N ATOM 224 CA SER A 17 -15.072 -4.850 -6.661 1.00 0.00 C ATOM 225 C SER A 17 -15.678 -4.610 -8.046 1.00 0.00 C ATOM 226 O SER A 17 -16.506 -5.367 -8.511 1.00 0.00 O ATOM 227 CB SER A 17 -15.076 -3.540 -5.871 1.00 0.00 C ATOM 228 OG SER A 17 -16.054 -3.616 -4.843 1.00 0.00 O ATOM 0 H SER A 17 -12.996 -4.916 -6.172 1.00 0.00 H new ATOM 0 HA SER A 17 -15.663 -5.597 -6.131 1.00 0.00 H new ATOM 0 HB2 SER A 17 -14.091 -3.359 -5.440 1.00 0.00 H new ATOM 0 HB3 SER A 17 -15.293 -2.702 -6.534 1.00 0.00 H new ATOM 0 HG SER A 17 -16.059 -2.779 -4.333 1.00 0.00 H new ATOM 234 N ARG A 18 -15.273 -3.561 -8.708 1.00 0.00 N ATOM 235 CA ARG A 18 -15.828 -3.274 -10.060 1.00 0.00 C ATOM 236 C ARG A 18 -14.711 -2.769 -10.975 1.00 0.00 C ATOM 237 O ARG A 18 -14.145 -3.514 -11.751 1.00 0.00 O ATOM 238 CB ARG A 18 -16.916 -2.204 -9.945 1.00 0.00 C ATOM 239 CG ARG A 18 -18.099 -2.764 -9.154 1.00 0.00 C ATOM 240 CD ARG A 18 -18.776 -3.872 -9.963 1.00 0.00 C ATOM 241 NE ARG A 18 -20.231 -3.902 -9.643 1.00 0.00 N ATOM 242 CZ ARG A 18 -21.111 -3.918 -10.606 1.00 0.00 C ATOM 243 NH1 ARG A 18 -20.796 -4.419 -11.769 1.00 0.00 N ATOM 244 NH2 ARG A 18 -22.305 -3.433 -10.407 1.00 0.00 N ATOM 0 H ARG A 18 -14.582 -2.891 -8.371 1.00 0.00 H new ATOM 0 HA ARG A 18 -16.255 -4.185 -10.479 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -16.519 -1.318 -9.449 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -17.242 -1.894 -10.938 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -17.757 -3.156 -8.196 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -18.813 -1.970 -8.937 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -18.631 -3.699 -11.029 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -18.322 -4.835 -9.732 1.00 0.00 H new ATOM 0 HE ARG A 18 -20.539 -3.910 -8.671 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -19.862 -4.798 -11.925 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -21.484 -4.432 -12.522 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -22.551 -3.041 -9.498 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -22.993 -3.446 -11.160 1.00 0.00 H new ATOM 258 N PHE A 19 -14.392 -1.506 -10.893 1.00 0.00 N ATOM 259 CA PHE A 19 -13.315 -0.952 -11.758 1.00 0.00 C ATOM 260 C PHE A 19 -12.569 0.148 -10.997 1.00 0.00 C ATOM 261 O PHE A 19 -12.384 0.068 -9.799 1.00 0.00 O ATOM 262 CB PHE A 19 -13.936 -0.368 -13.030 1.00 0.00 C ATOM 263 CG PHE A 19 -14.937 -1.347 -13.595 1.00 0.00 C ATOM 264 CD1 PHE A 19 -14.503 -2.399 -14.412 1.00 0.00 C ATOM 265 CD2 PHE A 19 -16.300 -1.203 -13.303 1.00 0.00 C ATOM 266 CE1 PHE A 19 -15.432 -3.307 -14.937 1.00 0.00 C ATOM 267 CE2 PHE A 19 -17.229 -2.112 -13.828 1.00 0.00 C ATOM 268 CZ PHE A 19 -16.794 -3.164 -14.646 1.00 0.00 C ATOM 0 H PHE A 19 -14.832 -0.834 -10.264 1.00 0.00 H new ATOM 0 HA PHE A 19 -12.616 -1.744 -12.027 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -14.425 0.580 -12.807 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -13.159 -0.161 -13.765 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.453 -2.510 -14.637 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -16.635 -0.392 -12.674 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -15.097 -4.118 -15.567 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -18.279 -2.002 -13.602 1.00 0.00 H new ATOM 0 HZ PHE A 19 -17.509 -3.864 -15.052 1.00 0.00 H new ATOM 278 N PHE A 20 -12.137 1.174 -11.681 1.00 0.00 N ATOM 279 CA PHE A 20 -11.404 2.271 -10.989 1.00 0.00 C ATOM 280 C PHE A 20 -12.142 3.594 -11.205 1.00 0.00 C ATOM 281 O PHE A 20 -11.550 4.655 -11.190 1.00 0.00 O ATOM 282 CB PHE A 20 -9.990 2.375 -11.563 1.00 0.00 C ATOM 283 CG PHE A 20 -9.228 3.458 -10.839 1.00 0.00 C ATOM 284 CD1 PHE A 20 -9.305 3.558 -9.444 1.00 0.00 C ATOM 285 CD2 PHE A 20 -8.442 4.363 -11.565 1.00 0.00 C ATOM 286 CE1 PHE A 20 -8.595 4.563 -8.774 1.00 0.00 C ATOM 287 CE2 PHE A 20 -7.733 5.369 -10.895 1.00 0.00 C ATOM 288 CZ PHE A 20 -7.809 5.469 -9.500 1.00 0.00 C ATOM 0 H PHE A 20 -12.260 1.299 -12.686 1.00 0.00 H new ATOM 0 HA PHE A 20 -11.350 2.057 -9.922 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -9.473 1.421 -11.459 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -10.035 2.598 -12.629 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -9.911 2.861 -8.885 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -8.383 4.285 -12.641 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.653 4.640 -7.698 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -7.128 6.067 -11.454 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.262 6.244 -8.984 1.00 0.00 H new ATOM 298 N GLY A 21 -13.431 3.541 -11.405 1.00 0.00 N ATOM 299 CA GLY A 21 -14.205 4.797 -11.620 1.00 0.00 C ATOM 300 C GLY A 21 -14.545 5.421 -10.266 1.00 0.00 C ATOM 301 O GLY A 21 -13.959 6.405 -9.861 1.00 0.00 O ATOM 0 H GLY A 21 -13.981 2.683 -11.429 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -13.624 5.497 -12.220 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.119 4.584 -12.175 1.00 0.00 H new ATOM 305 N ARG A 22 -15.487 4.856 -9.562 1.00 0.00 N ATOM 306 CA ARG A 22 -15.862 5.417 -8.234 1.00 0.00 C ATOM 307 C ARG A 22 -15.707 4.334 -7.164 1.00 0.00 C ATOM 308 O ARG A 22 -16.382 4.344 -6.154 1.00 0.00 O ATOM 309 CB ARG A 22 -17.314 5.895 -8.273 1.00 0.00 C ATOM 310 CG ARG A 22 -17.447 7.190 -7.467 1.00 0.00 C ATOM 311 CD ARG A 22 -17.981 8.304 -8.369 1.00 0.00 C ATOM 312 NE ARG A 22 -18.763 9.272 -7.550 1.00 0.00 N ATOM 313 CZ ARG A 22 -19.048 10.453 -8.028 1.00 0.00 C ATOM 314 NH1 ARG A 22 -19.030 10.659 -9.316 1.00 0.00 N ATOM 315 NH2 ARG A 22 -19.352 11.428 -7.216 1.00 0.00 N ATOM 0 H ARG A 22 -16.013 4.030 -9.849 1.00 0.00 H new ATOM 0 HA ARG A 22 -15.211 6.259 -7.996 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -17.625 6.062 -9.304 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -17.971 5.129 -7.862 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -18.120 7.037 -6.623 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -16.479 7.475 -7.055 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -17.154 8.814 -8.864 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -18.610 7.882 -9.153 1.00 0.00 H new ATOM 0 HE ARG A 22 -19.076 9.012 -6.615 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -18.793 9.897 -9.951 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -19.253 11.582 -9.688 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -19.367 11.267 -6.209 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -19.575 12.351 -7.588 1.00 0.00 H new ATOM 329 N ALA A 23 -14.821 3.400 -7.380 1.00 0.00 N ATOM 330 CA ALA A 23 -14.618 2.317 -6.377 1.00 0.00 C ATOM 331 C ALA A 23 -14.411 2.941 -4.990 1.00 0.00 C ATOM 332 O ALA A 23 -13.378 3.529 -4.732 1.00 0.00 O ATOM 333 CB ALA A 23 -13.377 1.506 -6.758 1.00 0.00 C ATOM 0 H ALA A 23 -14.229 3.340 -8.208 1.00 0.00 H new ATOM 0 HA ALA A 23 -15.492 1.666 -6.357 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.223 0.712 -6.028 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -13.518 1.068 -7.746 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.505 2.160 -6.772 1.00 0.00 H new ATOM 339 N PRO A 24 -15.397 2.798 -4.138 1.00 0.00 N ATOM 340 CA PRO A 24 -15.348 3.343 -2.768 1.00 0.00 C ATOM 341 C PRO A 24 -14.522 2.438 -1.843 1.00 0.00 C ATOM 342 O PRO A 24 -14.866 2.236 -0.695 1.00 0.00 O ATOM 343 CB PRO A 24 -16.816 3.356 -2.335 1.00 0.00 C ATOM 344 CG PRO A 24 -17.542 2.314 -3.219 1.00 0.00 C ATOM 345 CD PRO A 24 -16.655 2.093 -4.459 1.00 0.00 C ATOM 0 HA PRO A 24 -14.878 4.326 -2.723 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.912 3.103 -1.279 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -17.251 4.347 -2.466 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -17.688 1.380 -2.676 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -18.530 2.673 -3.508 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -16.482 1.032 -4.640 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -17.120 2.498 -5.358 1.00 0.00 H new ATOM 353 N TYR A 25 -13.436 1.895 -2.325 1.00 0.00 N ATOM 354 CA TYR A 25 -12.600 1.013 -1.464 1.00 0.00 C ATOM 355 C TYR A 25 -11.167 1.010 -1.995 1.00 0.00 C ATOM 356 O TYR A 25 -10.676 0.011 -2.484 1.00 0.00 O ATOM 357 CB TYR A 25 -13.163 -0.410 -1.488 1.00 0.00 C ATOM 358 CG TYR A 25 -14.471 -0.450 -0.733 1.00 0.00 C ATOM 359 CD1 TYR A 25 -14.504 -0.121 0.628 1.00 0.00 C ATOM 360 CD2 TYR A 25 -15.651 -0.819 -1.394 1.00 0.00 C ATOM 361 CE1 TYR A 25 -15.717 -0.158 1.330 1.00 0.00 C ATOM 362 CE2 TYR A 25 -16.864 -0.856 -0.692 1.00 0.00 C ATOM 363 CZ TYR A 25 -16.896 -0.526 0.670 1.00 0.00 C ATOM 364 OH TYR A 25 -18.091 -0.563 1.360 1.00 0.00 O ATOM 0 H TYR A 25 -13.093 2.025 -3.277 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.609 1.383 -0.439 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -13.316 -0.734 -2.517 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.451 -1.102 -1.038 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -13.594 0.161 1.137 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -15.626 -1.075 -2.443 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -15.742 0.097 2.379 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -17.774 -1.139 -1.201 1.00 0.00 H new ATOM 0 HH TYR A 25 -18.088 0.127 2.056 1.00 0.00 H new ATOM 374 N PHE A 26 -10.495 2.124 -1.905 1.00 0.00 N ATOM 375 CA PHE A 26 -9.094 2.196 -2.409 1.00 0.00 C ATOM 376 C PHE A 26 -8.140 1.631 -1.355 1.00 0.00 C ATOM 377 O PHE A 26 -8.067 2.120 -0.246 1.00 0.00 O ATOM 378 CB PHE A 26 -8.736 3.656 -2.692 1.00 0.00 C ATOM 379 CG PHE A 26 -7.328 3.737 -3.233 1.00 0.00 C ATOM 380 CD1 PHE A 26 -6.838 2.727 -4.072 1.00 0.00 C ATOM 381 CD2 PHE A 26 -6.512 4.825 -2.896 1.00 0.00 C ATOM 382 CE1 PHE A 26 -5.532 2.805 -4.573 1.00 0.00 C ATOM 383 CE2 PHE A 26 -5.206 4.903 -3.397 1.00 0.00 C ATOM 384 CZ PHE A 26 -4.717 3.893 -4.237 1.00 0.00 C ATOM 0 H PHE A 26 -10.856 2.989 -1.504 1.00 0.00 H new ATOM 0 HA PHE A 26 -9.005 1.612 -3.325 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -9.437 4.080 -3.411 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.820 4.245 -1.779 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.467 1.889 -4.332 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.890 5.604 -2.250 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -5.154 2.026 -5.218 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.576 5.741 -3.136 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.711 3.954 -4.625 1.00 0.00 H new ATOM 394 N MET A 27 -7.409 0.604 -1.692 1.00 0.00 N ATOM 395 CA MET A 27 -6.460 0.008 -0.707 1.00 0.00 C ATOM 396 C MET A 27 -5.032 0.441 -1.045 1.00 0.00 C ATOM 397 O MET A 27 -4.741 0.844 -2.154 1.00 0.00 O ATOM 398 CB MET A 27 -6.559 -1.517 -0.768 1.00 0.00 C ATOM 399 CG MET A 27 -5.899 -2.122 0.473 1.00 0.00 C ATOM 400 SD MET A 27 -5.882 -3.926 0.329 1.00 0.00 S ATOM 401 CE MET A 27 -6.911 -4.278 1.775 1.00 0.00 C ATOM 0 H MET A 27 -7.427 0.151 -2.606 1.00 0.00 H new ATOM 0 HA MET A 27 -6.713 0.351 0.296 1.00 0.00 H new ATOM 0 HB2 MET A 27 -7.604 -1.822 -0.822 1.00 0.00 H new ATOM 0 HB3 MET A 27 -6.071 -1.888 -1.670 1.00 0.00 H new ATOM 0 HG2 MET A 27 -4.881 -1.745 0.577 1.00 0.00 H new ATOM 0 HG3 MET A 27 -6.443 -1.823 1.369 1.00 0.00 H new ATOM 0 HE1 MET A 27 -7.035 -5.356 1.880 1.00 0.00 H new ATOM 0 HE2 MET A 27 -6.431 -3.879 2.669 1.00 0.00 H new ATOM 0 HE3 MET A 27 -7.888 -3.811 1.649 1.00 0.00 H new ATOM 411 N ILE A 28 -4.138 0.359 -0.098 1.00 0.00 N ATOM 412 CA ILE A 28 -2.729 0.765 -0.366 1.00 0.00 C ATOM 413 C ILE A 28 -1.781 -0.082 0.487 1.00 0.00 C ATOM 414 O ILE A 28 -1.990 -0.260 1.671 1.00 0.00 O ATOM 415 CB ILE A 28 -2.547 2.242 -0.011 1.00 0.00 C ATOM 416 CG1 ILE A 28 -1.133 2.685 -0.397 1.00 0.00 C ATOM 417 CG2 ILE A 28 -2.746 2.436 1.494 1.00 0.00 C ATOM 418 CD1 ILE A 28 -1.177 3.422 -1.736 1.00 0.00 C ATOM 0 H ILE A 28 -4.322 0.029 0.849 1.00 0.00 H new ATOM 0 HA ILE A 28 -2.503 0.613 -1.421 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.280 2.839 -0.554 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.721 3.335 0.375 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.476 1.818 -0.468 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.616 3.489 1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.751 2.118 1.772 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.013 1.840 2.038 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -0.171 3.737 -2.011 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -1.572 2.757 -2.504 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.820 4.297 -1.648 1.00 0.00 H new ATOM 430 N VAL A 29 -0.742 -0.606 -0.103 1.00 0.00 N ATOM 431 CA VAL A 29 0.215 -1.439 0.678 1.00 0.00 C ATOM 432 C VAL A 29 1.641 -1.182 0.184 1.00 0.00 C ATOM 433 O VAL A 29 1.938 -1.317 -0.987 1.00 0.00 O ATOM 434 CB VAL A 29 -0.128 -2.919 0.494 1.00 0.00 C ATOM 435 CG1 VAL A 29 0.772 -3.768 1.394 1.00 0.00 C ATOM 436 CG2 VAL A 29 -1.592 -3.150 0.873 1.00 0.00 C ATOM 0 H VAL A 29 -0.515 -0.493 -1.091 1.00 0.00 H new ATOM 0 HA VAL A 29 0.144 -1.177 1.734 1.00 0.00 H new ATOM 0 HB VAL A 29 0.029 -3.203 -0.546 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.527 -4.822 1.263 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.815 -3.601 1.126 1.00 0.00 H new ATOM 0 HG13 VAL A 29 0.615 -3.486 2.435 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.840 -4.204 0.743 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.747 -2.866 1.914 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.234 -2.545 0.232 1.00 0.00 H new ATOM 446 N GLU A 30 2.527 -0.811 1.069 1.00 0.00 N ATOM 447 CA GLU A 30 3.934 -0.547 0.651 1.00 0.00 C ATOM 448 C GLU A 30 4.794 -1.771 0.968 1.00 0.00 C ATOM 449 O GLU A 30 4.355 -2.698 1.619 1.00 0.00 O ATOM 450 CB GLU A 30 4.483 0.667 1.409 1.00 0.00 C ATOM 451 CG GLU A 30 3.335 1.605 1.794 1.00 0.00 C ATOM 452 CD GLU A 30 3.876 3.025 1.970 1.00 0.00 C ATOM 453 OE1 GLU A 30 5.084 3.170 2.071 1.00 0.00 O ATOM 454 OE2 GLU A 30 3.074 3.944 2.000 1.00 0.00 O ATOM 0 H GLU A 30 2.337 -0.679 2.063 1.00 0.00 H new ATOM 0 HA GLU A 30 3.959 -0.345 -0.420 1.00 0.00 H new ATOM 0 HB2 GLU A 30 5.012 0.339 2.304 1.00 0.00 H new ATOM 0 HB3 GLU A 30 5.205 1.198 0.789 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.565 1.590 1.023 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.867 1.265 2.718 1.00 0.00 H new ATOM 461 N MET A 31 6.017 -1.782 0.513 1.00 0.00 N ATOM 462 CA MET A 31 6.903 -2.947 0.791 1.00 0.00 C ATOM 463 C MET A 31 8.314 -2.453 1.110 1.00 0.00 C ATOM 464 O MET A 31 8.821 -1.544 0.481 1.00 0.00 O ATOM 465 CB MET A 31 6.947 -3.857 -0.439 1.00 0.00 C ATOM 466 CG MET A 31 7.010 -5.318 0.009 1.00 0.00 C ATOM 467 SD MET A 31 6.795 -6.398 -1.427 1.00 0.00 S ATOM 468 CE MET A 31 5.005 -6.194 -1.600 1.00 0.00 C ATOM 0 H MET A 31 6.440 -1.036 -0.038 1.00 0.00 H new ATOM 0 HA MET A 31 6.514 -3.504 1.643 1.00 0.00 H new ATOM 0 HB2 MET A 31 6.065 -3.693 -1.058 1.00 0.00 H new ATOM 0 HB3 MET A 31 7.815 -3.616 -1.052 1.00 0.00 H new ATOM 0 HG2 MET A 31 7.967 -5.521 0.490 1.00 0.00 H new ATOM 0 HG3 MET A 31 6.233 -5.517 0.747 1.00 0.00 H new ATOM 0 HE1 MET A 31 4.745 -6.141 -2.657 1.00 0.00 H new ATOM 0 HE2 MET A 31 4.496 -7.043 -1.144 1.00 0.00 H new ATOM 0 HE3 MET A 31 4.694 -5.275 -1.103 1.00 0.00 H new ATOM 478 N LYS A 32 8.955 -3.043 2.081 1.00 0.00 N ATOM 479 CA LYS A 32 10.333 -2.607 2.439 1.00 0.00 C ATOM 480 C LYS A 32 11.353 -3.504 1.733 1.00 0.00 C ATOM 481 O LYS A 32 12.297 -3.031 1.131 1.00 0.00 O ATOM 482 CB LYS A 32 10.524 -2.715 3.954 1.00 0.00 C ATOM 483 CG LYS A 32 11.281 -1.487 4.463 1.00 0.00 C ATOM 484 CD LYS A 32 12.553 -1.934 5.186 1.00 0.00 C ATOM 485 CE LYS A 32 13.744 -1.839 4.232 1.00 0.00 C ATOM 486 NZ LYS A 32 15.001 -1.683 5.019 1.00 0.00 N ATOM 0 H LYS A 32 8.583 -3.809 2.642 1.00 0.00 H new ATOM 0 HA LYS A 32 10.479 -1.573 2.125 1.00 0.00 H new ATOM 0 HB2 LYS A 32 9.556 -2.789 4.449 1.00 0.00 H new ATOM 0 HB3 LYS A 32 11.077 -3.622 4.198 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.535 -0.832 3.630 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.649 -0.912 5.139 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.725 -1.308 6.062 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.440 -2.958 5.543 1.00 0.00 H new ATOM 0 HE2 LYS A 32 13.799 -2.734 3.612 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.617 -0.992 3.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 15.811 -1.618 4.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.947 -0.817 5.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 15.123 -2.505 5.644 1.00 0.00 H new ATOM 500 N LYS A 33 11.171 -4.795 1.800 1.00 0.00 N ATOM 501 CA LYS A 33 12.131 -5.719 1.133 1.00 0.00 C ATOM 502 C LYS A 33 11.416 -7.024 0.772 1.00 0.00 C ATOM 503 O LYS A 33 11.955 -8.101 0.927 1.00 0.00 O ATOM 504 CB LYS A 33 13.294 -6.022 2.081 1.00 0.00 C ATOM 505 CG LYS A 33 14.464 -5.087 1.768 1.00 0.00 C ATOM 506 CD LYS A 33 15.780 -5.758 2.169 1.00 0.00 C ATOM 507 CE LYS A 33 16.914 -4.732 2.111 1.00 0.00 C ATOM 508 NZ LYS A 33 16.983 -3.994 3.405 1.00 0.00 N ATOM 0 H LYS A 33 10.399 -5.249 2.288 1.00 0.00 H new ATOM 0 HA LYS A 33 12.514 -5.250 0.227 1.00 0.00 H new ATOM 0 HB2 LYS A 33 12.977 -5.892 3.116 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.605 -7.061 1.971 1.00 0.00 H new ATOM 0 HG2 LYS A 33 14.476 -4.847 0.705 1.00 0.00 H new ATOM 0 HG3 LYS A 33 14.345 -4.147 2.306 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.699 -6.170 3.175 1.00 0.00 H new ATOM 0 HD3 LYS A 33 15.994 -6.591 1.500 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.862 -5.233 1.915 1.00 0.00 H new ATOM 0 HE3 LYS A 33 16.746 -4.034 1.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 17.753 -3.297 3.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 16.081 -3.505 3.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.163 -4.666 4.179 1.00 0.00 H new ATOM 522 N GLY A 34 10.205 -6.934 0.295 1.00 0.00 N ATOM 523 CA GLY A 34 9.458 -8.170 -0.073 1.00 0.00 C ATOM 524 C GLY A 34 8.447 -8.500 1.027 1.00 0.00 C ATOM 525 O GLY A 34 7.616 -9.373 0.877 1.00 0.00 O ATOM 0 H GLY A 34 9.701 -6.060 0.144 1.00 0.00 H new ATOM 0 HA2 GLY A 34 8.944 -8.028 -1.024 1.00 0.00 H new ATOM 0 HA3 GLY A 34 10.151 -9.001 -0.206 1.00 0.00 H new ATOM 529 N ASN A 35 8.508 -7.806 2.131 1.00 0.00 N ATOM 530 CA ASN A 35 7.548 -8.083 3.236 1.00 0.00 C ATOM 531 C ASN A 35 6.681 -6.845 3.477 1.00 0.00 C ATOM 532 O ASN A 35 7.072 -5.923 4.166 1.00 0.00 O ATOM 533 CB ASN A 35 8.319 -8.428 4.512 1.00 0.00 C ATOM 534 CG ASN A 35 8.411 -9.949 4.652 1.00 0.00 C ATOM 535 OD1 ASN A 35 7.936 -10.678 3.805 1.00 0.00 O ATOM 536 ND2 ASN A 35 9.005 -10.462 5.695 1.00 0.00 N ATOM 0 H ASN A 35 9.180 -7.061 2.315 1.00 0.00 H new ATOM 0 HA ASN A 35 6.912 -8.925 2.963 1.00 0.00 H new ATOM 0 HB2 ASN A 35 9.318 -7.994 4.476 1.00 0.00 H new ATOM 0 HB3 ASN A 35 7.817 -8.001 5.380 1.00 0.00 H new ATOM 0 HD21 ASN A 35 9.070 -11.475 5.798 1.00 0.00 H new ATOM 0 HD22 ASN A 35 9.404 -9.850 6.407 1.00 0.00 H new ATOM 543 N ILE A 36 5.506 -6.821 2.913 1.00 0.00 N ATOM 544 CA ILE A 36 4.607 -5.649 3.103 1.00 0.00 C ATOM 545 C ILE A 36 4.554 -5.278 4.588 1.00 0.00 C ATOM 546 O ILE A 36 4.046 -6.019 5.404 1.00 0.00 O ATOM 547 CB ILE A 36 3.203 -6.008 2.609 1.00 0.00 C ATOM 548 CG1 ILE A 36 2.659 -7.180 3.430 1.00 0.00 C ATOM 549 CG2 ILE A 36 3.275 -6.410 1.134 1.00 0.00 C ATOM 550 CD1 ILE A 36 1.427 -7.770 2.737 1.00 0.00 C ATOM 0 H ILE A 36 5.128 -7.565 2.327 1.00 0.00 H new ATOM 0 HA ILE A 36 4.987 -4.799 2.536 1.00 0.00 H new ATOM 0 HB ILE A 36 2.543 -5.148 2.723 1.00 0.00 H new ATOM 0 HG12 ILE A 36 3.427 -7.946 3.541 1.00 0.00 H new ATOM 0 HG13 ILE A 36 2.397 -6.843 4.433 1.00 0.00 H new ATOM 0 HG21 ILE A 36 2.277 -6.667 0.778 1.00 0.00 H new ATOM 0 HG22 ILE A 36 3.666 -5.578 0.549 1.00 0.00 H new ATOM 0 HG23 ILE A 36 3.933 -7.272 1.024 1.00 0.00 H new ATOM 0 HD11 ILE A 36 1.043 -8.604 3.325 1.00 0.00 H new ATOM 0 HD12 ILE A 36 0.657 -7.003 2.649 1.00 0.00 H new ATOM 0 HD13 ILE A 36 1.703 -8.123 1.743 1.00 0.00 H new ATOM 562 N GLU A 37 5.077 -4.135 4.944 1.00 0.00 N ATOM 563 CA GLU A 37 5.056 -3.722 6.376 1.00 0.00 C ATOM 564 C GLU A 37 4.080 -2.558 6.562 1.00 0.00 C ATOM 565 O GLU A 37 4.140 -1.836 7.538 1.00 0.00 O ATOM 566 CB GLU A 37 6.458 -3.282 6.803 1.00 0.00 C ATOM 567 CG GLU A 37 7.391 -4.495 6.830 1.00 0.00 C ATOM 568 CD GLU A 37 7.462 -5.054 8.251 1.00 0.00 C ATOM 569 OE1 GLU A 37 7.197 -4.304 9.176 1.00 0.00 O ATOM 570 OE2 GLU A 37 7.779 -6.224 8.391 1.00 0.00 O ATOM 0 H GLU A 37 5.517 -3.471 4.306 1.00 0.00 H new ATOM 0 HA GLU A 37 4.736 -4.565 6.988 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.841 -2.531 6.112 1.00 0.00 H new ATOM 0 HB3 GLU A 37 6.420 -2.818 7.788 1.00 0.00 H new ATOM 0 HG2 GLU A 37 7.028 -5.261 6.144 1.00 0.00 H new ATOM 0 HG3 GLU A 37 8.386 -4.209 6.491 1.00 0.00 H new ATOM 577 N SER A 38 3.181 -2.371 5.637 1.00 0.00 N ATOM 578 CA SER A 38 2.200 -1.256 5.762 1.00 0.00 C ATOM 579 C SER A 38 1.035 -1.497 4.801 1.00 0.00 C ATOM 580 O SER A 38 1.216 -1.600 3.604 1.00 0.00 O ATOM 581 CB SER A 38 2.882 0.069 5.415 1.00 0.00 C ATOM 582 OG SER A 38 3.817 -0.143 4.365 1.00 0.00 O ATOM 0 H SER A 38 3.083 -2.943 4.798 1.00 0.00 H new ATOM 0 HA SER A 38 1.827 -1.213 6.785 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.138 0.805 5.111 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.389 0.471 6.292 1.00 0.00 H new ATOM 0 HG SER A 38 4.554 0.497 4.449 1.00 0.00 H new ATOM 588 N SER A 39 -0.161 -1.593 5.314 1.00 0.00 N ATOM 589 CA SER A 39 -1.335 -1.832 4.428 1.00 0.00 C ATOM 590 C SER A 39 -2.576 -1.178 5.036 1.00 0.00 C ATOM 591 O SER A 39 -3.118 -1.645 6.018 1.00 0.00 O ATOM 592 CB SER A 39 -1.569 -3.336 4.289 1.00 0.00 C ATOM 593 OG SER A 39 -1.445 -3.951 5.565 1.00 0.00 O ATOM 0 H SER A 39 -0.376 -1.516 6.308 1.00 0.00 H new ATOM 0 HA SER A 39 -1.142 -1.401 3.446 1.00 0.00 H new ATOM 0 HB2 SER A 39 -2.560 -3.525 3.876 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.847 -3.765 3.594 1.00 0.00 H new ATOM 0 HG SER A 39 -1.880 -3.391 6.242 1.00 0.00 H new ATOM 599 N GLU A 40 -3.034 -0.100 4.460 1.00 0.00 N ATOM 600 CA GLU A 40 -4.243 0.578 5.008 1.00 0.00 C ATOM 601 C GLU A 40 -5.362 0.548 3.966 1.00 0.00 C ATOM 602 O GLU A 40 -5.119 0.434 2.781 1.00 0.00 O ATOM 603 CB GLU A 40 -3.902 2.030 5.350 1.00 0.00 C ATOM 604 CG GLU A 40 -3.930 2.216 6.869 1.00 0.00 C ATOM 605 CD GLU A 40 -3.995 3.709 7.202 1.00 0.00 C ATOM 606 OE1 GLU A 40 -4.799 4.395 6.593 1.00 0.00 O ATOM 607 OE2 GLU A 40 -3.240 4.138 8.058 1.00 0.00 O ATOM 0 H GLU A 40 -2.624 0.340 3.636 1.00 0.00 H new ATOM 0 HA GLU A 40 -4.573 0.060 5.909 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.917 2.285 4.960 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.616 2.704 4.877 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.792 1.701 7.293 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.041 1.772 7.316 1.00 0.00 H new ATOM 614 N VAL A 41 -6.589 0.649 4.399 1.00 0.00 N ATOM 615 CA VAL A 41 -7.725 0.627 3.435 1.00 0.00 C ATOM 616 C VAL A 41 -8.602 1.863 3.654 1.00 0.00 C ATOM 617 O VAL A 41 -8.865 2.257 4.772 1.00 0.00 O ATOM 618 CB VAL A 41 -8.557 -0.640 3.657 1.00 0.00 C ATOM 619 CG1 VAL A 41 -8.820 -0.822 5.153 1.00 0.00 C ATOM 620 CG2 VAL A 41 -9.892 -0.513 2.917 1.00 0.00 C ATOM 0 H VAL A 41 -6.854 0.746 5.379 1.00 0.00 H new ATOM 0 HA VAL A 41 -7.340 0.633 2.415 1.00 0.00 H new ATOM 0 HB VAL A 41 -8.011 -1.503 3.275 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -9.412 -1.723 5.311 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.871 -0.914 5.681 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -9.365 0.042 5.534 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -10.483 -1.415 3.076 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -10.438 0.350 3.297 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -9.706 -0.384 1.851 1.00 0.00 H new ATOM 630 N ILE A 42 -9.053 2.476 2.595 1.00 0.00 N ATOM 631 CA ILE A 42 -9.909 3.687 2.744 1.00 0.00 C ATOM 632 C ILE A 42 -11.095 3.599 1.782 1.00 0.00 C ATOM 633 O ILE A 42 -10.987 3.071 0.692 1.00 0.00 O ATOM 634 CB ILE A 42 -9.087 4.937 2.420 1.00 0.00 C ATOM 635 CG1 ILE A 42 -8.681 4.910 0.945 1.00 0.00 C ATOM 636 CG2 ILE A 42 -7.831 4.968 3.291 1.00 0.00 C ATOM 637 CD1 ILE A 42 -8.080 6.262 0.558 1.00 0.00 C ATOM 0 H ILE A 42 -8.866 2.191 1.633 1.00 0.00 H new ATOM 0 HA ILE A 42 -10.275 3.745 3.769 1.00 0.00 H new ATOM 0 HB ILE A 42 -9.687 5.825 2.619 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -7.957 4.114 0.770 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -9.549 4.694 0.322 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -7.248 5.859 3.058 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -8.118 4.987 4.342 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -7.230 4.080 3.095 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -7.790 6.244 -0.493 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -8.819 7.048 0.717 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -7.202 6.459 1.173 1.00 0.00 H new ATOM 649 N GLU A 43 -12.226 4.118 2.173 1.00 0.00 N ATOM 650 CA GLU A 43 -13.417 4.071 1.280 1.00 0.00 C ATOM 651 C GLU A 43 -13.551 5.410 0.552 1.00 0.00 C ATOM 652 O GLU A 43 -14.572 6.065 0.618 1.00 0.00 O ATOM 653 CB GLU A 43 -14.675 3.814 2.114 1.00 0.00 C ATOM 654 CG GLU A 43 -14.527 2.489 2.865 1.00 0.00 C ATOM 655 CD GLU A 43 -15.818 2.185 3.628 1.00 0.00 C ATOM 656 OE1 GLU A 43 -16.794 1.833 2.986 1.00 0.00 O ATOM 657 OE2 GLU A 43 -15.808 2.309 4.842 1.00 0.00 O ATOM 0 H GLU A 43 -12.377 4.573 3.073 1.00 0.00 H new ATOM 0 HA GLU A 43 -13.298 3.268 0.553 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -14.829 4.630 2.821 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -15.552 3.782 1.468 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -14.309 1.684 2.163 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -13.687 2.544 3.558 1.00 0.00 H new ATOM 664 N ASN A 44 -12.522 5.824 -0.138 1.00 0.00 N ATOM 665 CA ASN A 44 -12.584 7.122 -0.865 1.00 0.00 C ATOM 666 C ASN A 44 -13.088 8.214 0.086 1.00 0.00 C ATOM 667 O ASN A 44 -14.275 8.460 0.171 1.00 0.00 O ATOM 668 CB ASN A 44 -13.538 6.999 -2.055 1.00 0.00 C ATOM 669 CG ASN A 44 -12.934 7.705 -3.269 1.00 0.00 C ATOM 670 OD1 ASN A 44 -12.145 8.729 -3.090 1.00 0.00 O flip ATOM 671 ND2 ASN A 44 -13.181 7.320 -4.395 1.00 0.00 N flip ATOM 0 H ASN A 44 -11.641 5.318 -0.229 1.00 0.00 H new ATOM 0 HA ASN A 44 -11.590 7.384 -1.226 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -13.717 5.948 -2.284 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -14.503 7.440 -1.808 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -13.797 6.520 -4.537 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -12.772 7.797 -5.198 1.00 0.00 H new ATOM 678 N PRO A 45 -12.164 8.836 0.771 1.00 0.00 N ATOM 679 CA PRO A 45 -12.474 9.911 1.731 1.00 0.00 C ATOM 680 C PRO A 45 -12.765 11.220 0.990 1.00 0.00 C ATOM 681 O PRO A 45 -13.192 12.194 1.577 1.00 0.00 O ATOM 682 CB PRO A 45 -11.195 10.027 2.565 1.00 0.00 C ATOM 683 CG PRO A 45 -10.055 9.435 1.701 1.00 0.00 C ATOM 684 CD PRO A 45 -10.724 8.526 0.654 1.00 0.00 C ATOM 0 HA PRO A 45 -13.355 9.704 2.339 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -10.990 11.067 2.819 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -11.293 9.483 3.504 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -9.484 10.227 1.218 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -9.356 8.868 2.317 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -10.352 8.734 -0.349 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -10.526 7.473 0.856 1.00 0.00 H new ATOM 692 N SER A 46 -12.538 11.248 -0.294 1.00 0.00 N ATOM 693 CA SER A 46 -12.803 12.490 -1.072 1.00 0.00 C ATOM 694 C SER A 46 -13.250 12.117 -2.487 1.00 0.00 C ATOM 695 O SER A 46 -12.851 12.730 -3.458 1.00 0.00 O ATOM 696 CB SER A 46 -11.525 13.326 -1.146 1.00 0.00 C ATOM 697 OG SER A 46 -11.792 14.633 -0.655 1.00 0.00 O ATOM 0 H SER A 46 -12.180 10.463 -0.839 1.00 0.00 H new ATOM 0 HA SER A 46 -13.587 13.067 -0.582 1.00 0.00 H new ATOM 0 HB2 SER A 46 -10.736 12.858 -0.558 1.00 0.00 H new ATOM 0 HB3 SER A 46 -11.169 13.377 -2.175 1.00 0.00 H new ATOM 0 HG SER A 46 -10.975 15.172 -0.699 1.00 0.00 H new ATOM 703 N ALA A 47 -14.076 11.114 -2.613 1.00 0.00 N ATOM 704 CA ALA A 47 -14.547 10.701 -3.965 1.00 0.00 C ATOM 705 C ALA A 47 -15.080 11.923 -4.717 1.00 0.00 C ATOM 706 O ALA A 47 -14.883 12.065 -5.908 1.00 0.00 O ATOM 707 CB ALA A 47 -15.664 9.665 -3.822 1.00 0.00 C ATOM 0 H ALA A 47 -14.445 10.563 -1.838 1.00 0.00 H new ATOM 0 HA ALA A 47 -13.716 10.266 -4.521 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -16.009 9.363 -4.811 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -15.286 8.794 -3.288 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -16.494 10.100 -3.266 1.00 0.00 H new ATOM 713 N SER A 48 -15.756 12.805 -4.033 1.00 0.00 N ATOM 714 CA SER A 48 -16.303 14.013 -4.711 1.00 0.00 C ATOM 715 C SER A 48 -15.589 15.261 -4.189 1.00 0.00 C ATOM 716 O SER A 48 -16.061 15.925 -3.287 1.00 0.00 O ATOM 717 CB SER A 48 -17.800 14.124 -4.425 1.00 0.00 C ATOM 718 OG SER A 48 -18.292 15.342 -4.966 1.00 0.00 O ATOM 0 H SER A 48 -15.953 12.741 -3.034 1.00 0.00 H new ATOM 0 HA SER A 48 -16.144 13.928 -5.786 1.00 0.00 H new ATOM 0 HB2 SER A 48 -18.329 13.278 -4.863 1.00 0.00 H new ATOM 0 HB3 SER A 48 -17.980 14.091 -3.351 1.00 0.00 H new ATOM 0 HG SER A 48 -19.252 15.416 -4.786 1.00 0.00 H new ATOM 724 N ALA A 49 -14.457 15.587 -4.749 1.00 0.00 N ATOM 725 CA ALA A 49 -13.716 16.793 -4.286 1.00 0.00 C ATOM 726 C ALA A 49 -13.009 17.445 -5.475 1.00 0.00 C ATOM 727 O ALA A 49 -12.761 16.815 -6.484 1.00 0.00 O ATOM 728 CB ALA A 49 -12.680 16.384 -3.236 1.00 0.00 C ATOM 0 H ALA A 49 -14.013 15.070 -5.508 1.00 0.00 H new ATOM 0 HA ALA A 49 -14.416 17.503 -3.847 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.138 17.267 -2.897 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -13.185 15.920 -2.388 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -11.979 15.673 -3.674 1.00 0.00 H new ATOM 734 N SER A 50 -12.683 18.704 -5.366 1.00 0.00 N ATOM 735 CA SER A 50 -11.995 19.398 -6.493 1.00 0.00 C ATOM 736 C SER A 50 -10.690 18.669 -6.821 1.00 0.00 C ATOM 737 O SER A 50 -10.303 17.735 -6.148 1.00 0.00 O ATOM 738 CB SER A 50 -11.685 20.838 -6.088 1.00 0.00 C ATOM 739 OG SER A 50 -12.653 21.706 -6.664 1.00 0.00 O ATOM 0 H SER A 50 -12.863 19.283 -4.545 1.00 0.00 H new ATOM 0 HA SER A 50 -12.642 19.397 -7.370 1.00 0.00 H new ATOM 0 HB2 SER A 50 -11.695 20.933 -5.002 1.00 0.00 H new ATOM 0 HB3 SER A 50 -10.686 21.115 -6.423 1.00 0.00 H new ATOM 0 HG SER A 50 -12.458 22.631 -6.405 1.00 0.00 H new ATOM 745 N GLY A 51 -10.009 19.088 -7.853 1.00 0.00 N ATOM 746 CA GLY A 51 -8.731 18.419 -8.223 1.00 0.00 C ATOM 747 C GLY A 51 -8.938 16.905 -8.247 1.00 0.00 C ATOM 748 O GLY A 51 -8.076 16.143 -7.856 1.00 0.00 O ATOM 0 H GLY A 51 -10.283 19.864 -8.455 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -8.396 18.767 -9.200 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -7.951 18.679 -7.507 1.00 0.00 H new ATOM 752 N GLY A 52 -10.078 16.461 -8.701 1.00 0.00 N ATOM 753 CA GLY A 52 -10.341 14.995 -8.749 1.00 0.00 C ATOM 754 C GLY A 52 -11.676 14.738 -9.449 1.00 0.00 C ATOM 755 O GLY A 52 -12.639 15.452 -9.252 1.00 0.00 O ATOM 0 H GLY A 52 -10.838 17.050 -9.041 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -9.536 14.488 -9.281 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -10.363 14.586 -7.739 1.00 0.00 H new ATOM 759 N ALA A 53 -11.742 13.722 -10.264 1.00 0.00 N ATOM 760 CA ALA A 53 -13.014 13.418 -10.976 1.00 0.00 C ATOM 761 C ALA A 53 -13.100 11.915 -11.248 1.00 0.00 C ATOM 762 O ALA A 53 -13.657 11.485 -12.238 1.00 0.00 O ATOM 763 CB ALA A 53 -13.052 14.180 -12.302 1.00 0.00 C ATOM 0 H ALA A 53 -10.969 13.089 -10.468 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.858 13.724 -10.358 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.983 13.957 -12.823 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.992 15.251 -12.108 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -12.208 13.875 -12.921 1.00 0.00 H new ATOM 769 N GLY A 54 -12.550 11.114 -10.378 1.00 0.00 N ATOM 770 CA GLY A 54 -12.600 9.639 -10.588 1.00 0.00 C ATOM 771 C GLY A 54 -11.328 9.179 -11.302 1.00 0.00 C ATOM 772 O GLY A 54 -10.334 8.865 -10.680 1.00 0.00 O ATOM 0 H GLY A 54 -12.068 11.416 -9.531 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -12.696 9.128 -9.630 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -13.477 9.375 -11.179 1.00 0.00 H new ATOM 776 N ILE A 55 -11.355 9.133 -12.605 1.00 0.00 N ATOM 777 CA ILE A 55 -10.149 8.689 -13.359 1.00 0.00 C ATOM 778 C ILE A 55 -9.015 9.695 -13.154 1.00 0.00 C ATOM 779 O ILE A 55 -7.854 9.338 -13.124 1.00 0.00 O ATOM 780 CB ILE A 55 -10.486 8.601 -14.849 1.00 0.00 C ATOM 781 CG1 ILE A 55 -11.511 7.487 -15.076 1.00 0.00 C ATOM 782 CG2 ILE A 55 -9.215 8.292 -15.640 1.00 0.00 C ATOM 783 CD1 ILE A 55 -10.895 6.140 -14.694 1.00 0.00 C ATOM 0 H ILE A 55 -12.159 9.383 -13.180 1.00 0.00 H new ATOM 0 HA ILE A 55 -9.835 7.711 -12.995 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.902 9.551 -15.184 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.404 7.673 -14.479 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.823 7.473 -16.120 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.453 8.229 -16.702 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -8.484 9.085 -15.479 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -8.800 7.342 -15.304 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.625 5.347 -14.856 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -10.015 5.954 -15.310 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.605 6.157 -13.643 1.00 0.00 H new ATOM 795 N ARG A 56 -9.340 10.951 -13.014 1.00 0.00 N ATOM 796 CA ARG A 56 -8.279 11.979 -12.815 1.00 0.00 C ATOM 797 C ARG A 56 -7.682 11.840 -11.413 1.00 0.00 C ATOM 798 O ARG A 56 -6.638 12.387 -11.117 1.00 0.00 O ATOM 799 CB ARG A 56 -8.888 13.373 -12.973 1.00 0.00 C ATOM 800 CG ARG A 56 -8.398 14.000 -14.280 1.00 0.00 C ATOM 801 CD ARG A 56 -7.353 15.074 -13.971 1.00 0.00 C ATOM 802 NE ARG A 56 -7.137 15.920 -15.179 1.00 0.00 N ATOM 803 CZ ARG A 56 -6.005 15.854 -15.827 1.00 0.00 C ATOM 804 NH1 ARG A 56 -5.301 14.756 -15.800 1.00 0.00 N ATOM 805 NH2 ARG A 56 -5.578 16.886 -16.502 1.00 0.00 N ATOM 0 H ARG A 56 -10.295 11.310 -13.029 1.00 0.00 H new ATOM 0 HA ARG A 56 -7.493 11.836 -13.557 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -9.976 13.308 -12.974 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -8.607 14.002 -12.128 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -7.967 13.233 -14.924 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -9.236 14.438 -14.822 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.686 15.691 -13.137 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.415 14.608 -13.668 1.00 0.00 H new ATOM 0 HE ARG A 56 -7.873 16.550 -15.499 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -5.635 13.949 -15.273 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.417 14.704 -16.306 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -6.128 17.744 -16.524 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -4.694 16.834 -17.008 1.00 0.00 H new ATOM 819 N THR A 57 -8.335 11.118 -10.544 1.00 0.00 N ATOM 820 CA THR A 57 -7.802 10.952 -9.162 1.00 0.00 C ATOM 821 C THR A 57 -6.510 10.131 -9.201 1.00 0.00 C ATOM 822 O THR A 57 -5.734 10.134 -8.265 1.00 0.00 O ATOM 823 CB THR A 57 -8.840 10.230 -8.299 1.00 0.00 C ATOM 824 OG1 THR A 57 -10.014 11.025 -8.212 1.00 0.00 O ATOM 825 CG2 THR A 57 -8.272 10.000 -6.899 1.00 0.00 C ATOM 0 H THR A 57 -9.214 10.636 -10.731 1.00 0.00 H new ATOM 0 HA THR A 57 -7.592 11.933 -8.736 1.00 0.00 H new ATOM 0 HB THR A 57 -9.084 9.268 -8.751 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.681 10.564 -7.661 1.00 0.00 H new ATOM 0 HG21 THR A 57 -9.012 9.486 -6.286 1.00 0.00 H new ATOM 0 HG22 THR A 57 -7.371 9.390 -6.968 1.00 0.00 H new ATOM 0 HG23 THR A 57 -8.027 10.960 -6.444 1.00 0.00 H new ATOM 833 N ALA A 58 -6.275 9.425 -10.272 1.00 0.00 N ATOM 834 CA ALA A 58 -5.035 8.603 -10.366 1.00 0.00 C ATOM 835 C ALA A 58 -3.806 9.510 -10.254 1.00 0.00 C ATOM 836 O ALA A 58 -2.755 9.093 -9.810 1.00 0.00 O ATOM 837 CB ALA A 58 -5.007 7.872 -11.710 1.00 0.00 C ATOM 0 H ALA A 58 -6.888 9.381 -11.086 1.00 0.00 H new ATOM 0 HA ALA A 58 -5.023 7.875 -9.555 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -4.100 7.271 -11.779 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.879 7.223 -11.790 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -5.022 8.600 -12.521 1.00 0.00 H new ATOM 843 N GLN A 59 -3.929 10.744 -10.657 1.00 0.00 N ATOM 844 CA GLN A 59 -2.766 11.673 -10.576 1.00 0.00 C ATOM 845 C GLN A 59 -2.355 11.858 -9.114 1.00 0.00 C ATOM 846 O GLN A 59 -1.198 11.741 -8.764 1.00 0.00 O ATOM 847 CB GLN A 59 -3.158 13.028 -11.168 1.00 0.00 C ATOM 848 CG GLN A 59 -2.147 13.427 -12.246 1.00 0.00 C ATOM 849 CD GLN A 59 -2.086 14.952 -12.347 1.00 0.00 C ATOM 850 OE1 GLN A 59 -1.108 15.559 -11.962 1.00 0.00 O ATOM 851 NE2 GLN A 59 -3.101 15.599 -12.852 1.00 0.00 N ATOM 0 H GLN A 59 -4.783 11.150 -11.039 1.00 0.00 H new ATOM 0 HA GLN A 59 -1.930 11.255 -11.136 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -4.159 12.974 -11.596 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -3.187 13.785 -10.384 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -1.162 13.028 -12.002 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.435 12.999 -13.206 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -3.922 15.087 -13.175 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -3.073 16.616 -12.924 1.00 0.00 H new ATOM 860 N ILE A 60 -3.295 12.154 -8.259 1.00 0.00 N ATOM 861 CA ILE A 60 -2.962 12.354 -6.821 1.00 0.00 C ATOM 862 C ILE A 60 -2.435 11.048 -6.222 1.00 0.00 C ATOM 863 O ILE A 60 -1.447 11.032 -5.516 1.00 0.00 O ATOM 864 CB ILE A 60 -4.221 12.788 -6.066 1.00 0.00 C ATOM 865 CG1 ILE A 60 -4.878 13.958 -6.803 1.00 0.00 C ATOM 866 CG2 ILE A 60 -3.844 13.227 -4.650 1.00 0.00 C ATOM 867 CD1 ILE A 60 -6.388 13.726 -6.882 1.00 0.00 C ATOM 0 H ILE A 60 -4.281 12.266 -8.495 1.00 0.00 H new ATOM 0 HA ILE A 60 -2.195 13.124 -6.733 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.918 11.952 -6.013 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -4.669 14.893 -6.283 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -4.460 14.051 -7.806 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.741 13.536 -4.114 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -3.375 12.395 -4.124 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -3.147 14.063 -4.702 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -6.857 14.558 -7.407 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -6.586 12.800 -7.421 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -6.798 13.654 -5.875 1.00 0.00 H new ATOM 879 N ILE A 61 -3.090 9.954 -6.493 1.00 0.00 N ATOM 880 CA ILE A 61 -2.629 8.651 -5.932 1.00 0.00 C ATOM 881 C ILE A 61 -1.146 8.441 -6.249 1.00 0.00 C ATOM 882 O ILE A 61 -0.362 8.089 -5.390 1.00 0.00 O ATOM 883 CB ILE A 61 -3.443 7.514 -6.552 1.00 0.00 C ATOM 884 CG1 ILE A 61 -4.908 7.644 -6.126 1.00 0.00 C ATOM 885 CG2 ILE A 61 -2.894 6.171 -6.070 1.00 0.00 C ATOM 886 CD1 ILE A 61 -5.701 6.449 -6.657 1.00 0.00 C ATOM 0 H ILE A 61 -3.924 9.904 -7.078 1.00 0.00 H new ATOM 0 HA ILE A 61 -2.768 8.659 -4.851 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.372 7.569 -7.638 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -4.979 7.688 -5.039 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -5.329 8.573 -6.511 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.474 5.361 -6.512 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -1.851 6.076 -6.370 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -2.965 6.118 -4.984 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -6.744 6.541 -6.354 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -5.640 6.426 -7.745 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -5.285 5.527 -6.251 1.00 0.00 H new ATOM 898 N ALA A 62 -0.755 8.647 -7.477 1.00 0.00 N ATOM 899 CA ALA A 62 0.675 8.448 -7.847 1.00 0.00 C ATOM 900 C ALA A 62 1.547 9.495 -7.149 1.00 0.00 C ATOM 901 O ALA A 62 2.652 9.214 -6.728 1.00 0.00 O ATOM 902 CB ALA A 62 0.830 8.585 -9.362 1.00 0.00 C ATOM 0 H ALA A 62 -1.364 8.944 -8.240 1.00 0.00 H new ATOM 0 HA ALA A 62 0.991 7.453 -7.533 1.00 0.00 H new ATOM 0 HB1 ALA A 62 1.875 8.440 -9.635 1.00 0.00 H new ATOM 0 HB2 ALA A 62 0.217 7.834 -9.860 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.509 9.579 -9.672 1.00 0.00 H new ATOM 908 N ASN A 63 1.065 10.702 -7.025 1.00 0.00 N ATOM 909 CA ASN A 63 1.874 11.762 -6.358 1.00 0.00 C ATOM 910 C ASN A 63 2.058 11.421 -4.878 1.00 0.00 C ATOM 911 O ASN A 63 2.845 12.033 -4.184 1.00 0.00 O ATOM 912 CB ASN A 63 1.156 13.108 -6.485 1.00 0.00 C ATOM 913 CG ASN A 63 1.549 13.774 -7.805 1.00 0.00 C ATOM 914 OD1 ASN A 63 2.556 14.605 -7.828 1.00 0.00 O flip ATOM 915 ND2 ASN A 63 0.935 13.536 -8.826 1.00 0.00 N flip ATOM 0 H ASN A 63 0.147 11.000 -7.356 1.00 0.00 H new ATOM 0 HA ASN A 63 2.851 11.822 -6.837 1.00 0.00 H new ATOM 0 HB2 ASN A 63 0.077 12.961 -6.447 1.00 0.00 H new ATOM 0 HB3 ASN A 63 1.420 13.753 -5.647 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.148 12.887 -8.809 1.00 0.00 H new ATOM 0 HD22 ASN A 63 1.206 13.985 -9.701 1.00 0.00 H new ATOM 922 N ASN A 64 1.339 10.448 -4.386 1.00 0.00 N ATOM 923 CA ASN A 64 1.477 10.074 -2.950 1.00 0.00 C ATOM 924 C ASN A 64 2.579 9.023 -2.798 1.00 0.00 C ATOM 925 O ASN A 64 2.673 8.351 -1.789 1.00 0.00 O ATOM 926 CB ASN A 64 0.151 9.503 -2.443 1.00 0.00 C ATOM 927 CG ASN A 64 -0.718 10.638 -1.901 1.00 0.00 C ATOM 928 OD1 ASN A 64 -1.869 10.768 -2.270 1.00 0.00 O ATOM 929 ND2 ASN A 64 -0.213 11.473 -1.033 1.00 0.00 N ATOM 0 H ASN A 64 0.663 9.897 -4.916 1.00 0.00 H new ATOM 0 HA ASN A 64 1.738 10.958 -2.368 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -0.368 8.987 -3.251 1.00 0.00 H new ATOM 0 HB3 ASN A 64 0.335 8.766 -1.661 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -0.784 12.234 -0.665 1.00 0.00 H new ATOM 0 HD22 ASN A 64 0.753 11.364 -0.723 1.00 0.00 H new ATOM 936 N GLY A 65 3.415 8.874 -3.790 1.00 0.00 N ATOM 937 CA GLY A 65 4.510 7.867 -3.697 1.00 0.00 C ATOM 938 C GLY A 65 4.065 6.565 -4.365 1.00 0.00 C ATOM 939 O GLY A 65 4.876 5.745 -4.746 1.00 0.00 O ATOM 0 H GLY A 65 3.387 9.406 -4.660 1.00 0.00 H new ATOM 0 HA2 GLY A 65 5.410 8.247 -4.181 1.00 0.00 H new ATOM 0 HA3 GLY A 65 4.763 7.684 -2.653 1.00 0.00 H new ATOM 943 N VAL A 66 2.783 6.369 -4.510 1.00 0.00 N ATOM 944 CA VAL A 66 2.284 5.121 -5.153 1.00 0.00 C ATOM 945 C VAL A 66 2.890 4.989 -6.549 1.00 0.00 C ATOM 946 O VAL A 66 2.322 5.428 -7.529 1.00 0.00 O ATOM 947 CB VAL A 66 0.759 5.179 -5.259 1.00 0.00 C ATOM 948 CG1 VAL A 66 0.249 3.944 -6.004 1.00 0.00 C ATOM 949 CG2 VAL A 66 0.153 5.210 -3.854 1.00 0.00 C ATOM 0 H VAL A 66 2.058 7.021 -4.210 1.00 0.00 H new ATOM 0 HA VAL A 66 2.574 4.260 -4.551 1.00 0.00 H new ATOM 0 HB VAL A 66 0.468 6.077 -5.804 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.838 3.987 -6.079 1.00 0.00 H new ATOM 0 HG12 VAL A 66 0.681 3.919 -7.005 1.00 0.00 H new ATOM 0 HG13 VAL A 66 0.540 3.045 -5.460 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.934 5.251 -3.927 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.446 4.311 -3.311 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.514 6.090 -3.321 1.00 0.00 H new ATOM 959 N LYS A 67 4.035 4.374 -6.648 1.00 0.00 N ATOM 960 CA LYS A 67 4.671 4.199 -7.980 1.00 0.00 C ATOM 961 C LYS A 67 4.006 3.020 -8.692 1.00 0.00 C ATOM 962 O LYS A 67 4.239 2.773 -9.858 1.00 0.00 O ATOM 963 CB LYS A 67 6.165 3.917 -7.803 1.00 0.00 C ATOM 964 CG LYS A 67 6.881 5.207 -7.396 1.00 0.00 C ATOM 965 CD LYS A 67 8.247 5.271 -8.082 1.00 0.00 C ATOM 966 CE LYS A 67 8.674 6.732 -8.232 1.00 0.00 C ATOM 967 NZ LYS A 67 10.159 6.827 -8.156 1.00 0.00 N ATOM 0 H LYS A 67 4.557 3.985 -5.863 1.00 0.00 H new ATOM 0 HA LYS A 67 4.548 5.106 -8.572 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.314 3.150 -7.043 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.586 3.532 -8.732 1.00 0.00 H new ATOM 0 HG2 LYS A 67 6.281 6.073 -7.676 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.004 5.241 -6.313 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.986 4.723 -7.497 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.197 4.793 -9.060 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.322 7.129 -9.184 1.00 0.00 H new ATOM 0 HE3 LYS A 67 8.220 7.337 -7.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.449 7.821 -8.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.483 6.464 -7.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.583 6.263 -8.920 1.00 0.00 H new ATOM 981 N ALA A 68 3.172 2.296 -7.994 1.00 0.00 N ATOM 982 CA ALA A 68 2.483 1.136 -8.626 1.00 0.00 C ATOM 983 C ALA A 68 0.979 1.261 -8.385 1.00 0.00 C ATOM 984 O ALA A 68 0.544 1.623 -7.312 1.00 0.00 O ATOM 985 CB ALA A 68 2.995 -0.164 -8.001 1.00 0.00 C ATOM 0 H ALA A 68 2.939 2.458 -7.014 1.00 0.00 H new ATOM 0 HA ALA A 68 2.685 1.124 -9.697 1.00 0.00 H new ATOM 0 HB1 ALA A 68 2.491 -1.013 -8.463 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.070 -0.247 -8.164 1.00 0.00 H new ATOM 0 HB3 ALA A 68 2.789 -0.159 -6.931 1.00 0.00 H new ATOM 991 N VAL A 69 0.178 0.969 -9.374 1.00 0.00 N ATOM 992 CA VAL A 69 -1.296 1.079 -9.192 1.00 0.00 C ATOM 993 C VAL A 69 -1.996 -0.076 -9.914 1.00 0.00 C ATOM 994 O VAL A 69 -1.855 -0.250 -11.108 1.00 0.00 O ATOM 995 CB VAL A 69 -1.786 2.408 -9.773 1.00 0.00 C ATOM 996 CG1 VAL A 69 -3.306 2.497 -9.624 1.00 0.00 C ATOM 997 CG2 VAL A 69 -1.133 3.569 -9.019 1.00 0.00 C ATOM 0 H VAL A 69 0.481 0.660 -10.298 1.00 0.00 H new ATOM 0 HA VAL A 69 -1.528 1.035 -8.128 1.00 0.00 H new ATOM 0 HB VAL A 69 -1.517 2.464 -10.828 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -3.657 3.443 -10.037 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -3.773 1.671 -10.160 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -3.572 2.441 -8.568 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -1.483 4.515 -9.434 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -1.401 3.514 -7.964 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -0.050 3.506 -9.122 1.00 0.00 H new ATOM 1007 N ILE A 70 -2.757 -0.859 -9.199 1.00 0.00 N ATOM 1008 CA ILE A 70 -3.474 -1.996 -9.843 1.00 0.00 C ATOM 1009 C ILE A 70 -4.879 -1.532 -10.241 1.00 0.00 C ATOM 1010 O ILE A 70 -5.500 -0.745 -9.555 1.00 0.00 O ATOM 1011 CB ILE A 70 -3.572 -3.164 -8.854 1.00 0.00 C ATOM 1012 CG1 ILE A 70 -2.229 -3.895 -8.797 1.00 0.00 C ATOM 1013 CG2 ILE A 70 -4.659 -4.143 -9.307 1.00 0.00 C ATOM 1014 CD1 ILE A 70 -1.100 -2.880 -8.614 1.00 0.00 C ATOM 0 H ILE A 70 -2.913 -0.760 -8.196 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.932 -2.326 -10.729 1.00 0.00 H new ATOM 0 HB ILE A 70 -3.825 -2.776 -7.867 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -2.227 -4.609 -7.973 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -2.074 -4.465 -9.713 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -4.722 -4.970 -8.599 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -5.618 -3.627 -9.349 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -4.411 -4.530 -10.295 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.144 -3.402 -8.574 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.098 -2.183 -9.452 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -1.252 -2.330 -7.685 1.00 0.00 H new ATOM 1026 N ALA A 71 -5.386 -2.012 -11.345 1.00 0.00 N ATOM 1027 CA ALA A 71 -6.748 -1.592 -11.779 1.00 0.00 C ATOM 1028 C ALA A 71 -7.142 -2.348 -13.048 1.00 0.00 C ATOM 1029 O ALA A 71 -6.367 -3.102 -13.605 1.00 0.00 O ATOM 1030 CB ALA A 71 -6.749 -0.088 -12.063 1.00 0.00 C ATOM 0 H ALA A 71 -4.917 -2.675 -11.963 1.00 0.00 H new ATOM 0 HA ALA A 71 -7.464 -1.817 -10.988 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -7.745 0.222 -12.381 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -6.472 0.453 -11.158 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -6.031 0.134 -12.852 1.00 0.00 H new ATOM 1036 N SER A 72 -8.345 -2.149 -13.508 1.00 0.00 N ATOM 1037 CA SER A 72 -8.802 -2.848 -14.741 1.00 0.00 C ATOM 1038 C SER A 72 -9.881 -2.009 -15.429 1.00 0.00 C ATOM 1039 O SER A 72 -11.029 -2.398 -15.504 1.00 0.00 O ATOM 1040 CB SER A 72 -9.377 -4.215 -14.368 1.00 0.00 C ATOM 1041 OG SER A 72 -9.720 -4.221 -12.989 1.00 0.00 O ATOM 0 H SER A 72 -9.034 -1.530 -13.081 1.00 0.00 H new ATOM 0 HA SER A 72 -7.959 -2.983 -15.419 1.00 0.00 H new ATOM 0 HB2 SER A 72 -10.257 -4.430 -14.974 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.648 -4.998 -14.576 1.00 0.00 H new ATOM 0 HG SER A 72 -10.233 -5.030 -12.783 1.00 0.00 H new ATOM 1047 N SER A 73 -9.522 -0.858 -15.930 1.00 0.00 N ATOM 1048 CA SER A 73 -10.527 0.007 -16.612 1.00 0.00 C ATOM 1049 C SER A 73 -10.883 -0.596 -17.973 1.00 0.00 C ATOM 1050 O SER A 73 -10.134 -1.383 -18.515 1.00 0.00 O ATOM 1051 CB SER A 73 -9.943 1.407 -16.810 1.00 0.00 C ATOM 1052 OG SER A 73 -10.586 2.314 -15.924 1.00 0.00 O ATOM 0 H SER A 73 -8.576 -0.479 -15.896 1.00 0.00 H new ATOM 0 HA SER A 73 -11.426 0.071 -15.999 1.00 0.00 H new ATOM 0 HB2 SER A 73 -8.870 1.396 -16.621 1.00 0.00 H new ATOM 0 HB3 SER A 73 -10.082 1.729 -17.842 1.00 0.00 H new ATOM 0 HG SER A 73 -10.213 3.212 -16.047 1.00 0.00 H new ATOM 1058 N PRO A 74 -12.026 -0.208 -18.482 1.00 0.00 N ATOM 1059 CA PRO A 74 -12.524 -0.694 -19.782 1.00 0.00 C ATOM 1060 C PRO A 74 -11.825 0.031 -20.937 1.00 0.00 C ATOM 1061 O PRO A 74 -11.506 -0.561 -21.949 1.00 0.00 O ATOM 1062 CB PRO A 74 -14.014 -0.344 -19.746 1.00 0.00 C ATOM 1063 CG PRO A 74 -14.170 0.803 -18.719 1.00 0.00 C ATOM 1064 CD PRO A 74 -12.928 0.749 -17.808 1.00 0.00 C ATOM 0 HA PRO A 74 -12.339 -1.757 -19.938 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -14.364 -0.034 -20.731 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -14.609 -1.209 -19.455 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -14.240 1.767 -19.222 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -15.083 0.681 -18.137 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -12.464 1.730 -17.708 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -13.185 0.414 -16.803 1.00 0.00 H new ATOM 1072 N GLY A 75 -11.589 1.308 -20.800 1.00 0.00 N ATOM 1073 CA GLY A 75 -10.918 2.062 -21.897 1.00 0.00 C ATOM 1074 C GLY A 75 -9.624 2.693 -21.375 1.00 0.00 C ATOM 1075 O GLY A 75 -9.296 2.561 -20.212 1.00 0.00 O ATOM 0 H GLY A 75 -11.831 1.860 -19.978 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -10.698 1.393 -22.729 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.583 2.837 -22.278 1.00 0.00 H new ATOM 1079 N PRO A 76 -8.923 3.360 -22.259 1.00 0.00 N ATOM 1080 CA PRO A 76 -7.653 4.030 -21.931 1.00 0.00 C ATOM 1081 C PRO A 76 -7.911 5.382 -21.251 1.00 0.00 C ATOM 1082 O PRO A 76 -7.240 6.358 -21.523 1.00 0.00 O ATOM 1083 CB PRO A 76 -6.993 4.232 -23.298 1.00 0.00 C ATOM 1084 CG PRO A 76 -8.135 4.202 -24.344 1.00 0.00 C ATOM 1085 CD PRO A 76 -9.332 3.501 -23.672 1.00 0.00 C ATOM 0 HA PRO A 76 -7.036 3.456 -21.239 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.458 5.181 -23.334 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.264 3.447 -23.497 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -8.402 5.212 -24.654 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -7.825 3.665 -25.240 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.243 4.092 -23.766 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.532 2.531 -24.127 1.00 0.00 H new ATOM 1093 N ASN A 77 -8.872 5.449 -20.370 1.00 0.00 N ATOM 1094 CA ASN A 77 -9.160 6.737 -19.682 1.00 0.00 C ATOM 1095 C ASN A 77 -8.096 6.988 -18.612 1.00 0.00 C ATOM 1096 O ASN A 77 -7.295 7.895 -18.721 1.00 0.00 O ATOM 1097 CB ASN A 77 -10.541 6.669 -19.023 1.00 0.00 C ATOM 1098 CG ASN A 77 -11.619 6.978 -20.064 1.00 0.00 C ATOM 1099 OD1 ASN A 77 -11.315 7.256 -21.206 1.00 0.00 O ATOM 1100 ND2 ASN A 77 -12.876 6.942 -19.712 1.00 0.00 N ATOM 0 H ASN A 77 -9.469 4.668 -20.098 1.00 0.00 H new ATOM 0 HA ASN A 77 -9.146 7.549 -20.409 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -10.704 5.679 -18.598 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -10.599 7.383 -18.201 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -13.603 7.148 -20.397 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -13.130 6.708 -18.752 1.00 0.00 H new ATOM 1107 N ALA A 78 -8.078 6.190 -17.581 1.00 0.00 N ATOM 1108 CA ALA A 78 -7.062 6.380 -16.509 1.00 0.00 C ATOM 1109 C ALA A 78 -5.701 5.891 -17.009 1.00 0.00 C ATOM 1110 O ALA A 78 -4.665 6.337 -16.557 1.00 0.00 O ATOM 1111 CB ALA A 78 -7.468 5.577 -15.272 1.00 0.00 C ATOM 0 H ALA A 78 -8.724 5.414 -17.435 1.00 0.00 H new ATOM 0 HA ALA A 78 -6.999 7.437 -16.250 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -6.724 5.716 -14.488 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.439 5.922 -14.917 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -7.531 4.520 -15.529 1.00 0.00 H new ATOM 1117 N PHE A 79 -5.698 4.979 -17.941 1.00 0.00 N ATOM 1118 CA PHE A 79 -4.407 4.458 -18.475 1.00 0.00 C ATOM 1119 C PHE A 79 -3.677 5.577 -19.221 1.00 0.00 C ATOM 1120 O PHE A 79 -2.479 5.527 -19.416 1.00 0.00 O ATOM 1121 CB PHE A 79 -4.684 3.302 -19.438 1.00 0.00 C ATOM 1122 CG PHE A 79 -4.732 2.002 -18.671 1.00 0.00 C ATOM 1123 CD1 PHE A 79 -5.410 1.934 -17.448 1.00 0.00 C ATOM 1124 CD2 PHE A 79 -4.098 0.863 -19.186 1.00 0.00 C ATOM 1125 CE1 PHE A 79 -5.455 0.726 -16.738 1.00 0.00 C ATOM 1126 CE2 PHE A 79 -4.141 -0.344 -18.477 1.00 0.00 C ATOM 1127 CZ PHE A 79 -4.821 -0.413 -17.253 1.00 0.00 C ATOM 0 H PHE A 79 -6.535 4.571 -18.357 1.00 0.00 H new ATOM 0 HA PHE A 79 -3.788 4.105 -17.650 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -5.629 3.465 -19.955 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.907 3.257 -20.201 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -5.898 2.812 -17.052 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -3.576 0.916 -20.130 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -5.978 0.673 -15.795 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -3.651 -1.221 -18.873 1.00 0.00 H new ATOM 0 HZ PHE A 79 -4.856 -1.344 -16.707 1.00 0.00 H new ATOM 1137 N GLU A 80 -4.390 6.585 -19.644 1.00 0.00 N ATOM 1138 CA GLU A 80 -3.736 7.702 -20.382 1.00 0.00 C ATOM 1139 C GLU A 80 -3.004 8.617 -19.397 1.00 0.00 C ATOM 1140 O GLU A 80 -1.868 8.990 -19.609 1.00 0.00 O ATOM 1141 CB GLU A 80 -4.800 8.508 -21.131 1.00 0.00 C ATOM 1142 CG GLU A 80 -4.914 7.993 -22.567 1.00 0.00 C ATOM 1143 CD GLU A 80 -5.595 9.051 -23.438 1.00 0.00 C ATOM 1144 OE1 GLU A 80 -5.807 10.148 -22.946 1.00 0.00 O ATOM 1145 OE2 GLU A 80 -5.890 8.748 -24.581 1.00 0.00 O ATOM 0 H GLU A 80 -5.396 6.683 -19.510 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.018 7.292 -21.093 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.761 8.420 -20.625 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.536 9.566 -21.133 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -3.924 7.764 -22.962 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.487 7.066 -22.587 1.00 0.00 H new ATOM 1152 N VAL A 81 -3.646 8.985 -18.320 1.00 0.00 N ATOM 1153 CA VAL A 81 -2.985 9.879 -17.329 1.00 0.00 C ATOM 1154 C VAL A 81 -1.847 9.129 -16.631 1.00 0.00 C ATOM 1155 O VAL A 81 -0.820 9.697 -16.316 1.00 0.00 O ATOM 1156 CB VAL A 81 -4.008 10.331 -16.285 1.00 0.00 C ATOM 1157 CG1 VAL A 81 -3.514 11.609 -15.605 1.00 0.00 C ATOM 1158 CG2 VAL A 81 -5.348 10.604 -16.972 1.00 0.00 C ATOM 0 H VAL A 81 -4.598 8.705 -18.085 1.00 0.00 H new ATOM 0 HA VAL A 81 -2.581 10.749 -17.847 1.00 0.00 H new ATOM 0 HB VAL A 81 -4.134 9.548 -15.537 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.243 11.931 -14.861 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -2.559 11.415 -15.117 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -3.387 12.393 -16.352 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -6.078 10.926 -16.230 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.221 11.387 -17.720 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -5.701 9.694 -17.457 1.00 0.00 H new ATOM 1168 N LEU A 82 -2.023 7.861 -16.382 1.00 0.00 N ATOM 1169 CA LEU A 82 -0.952 7.081 -15.700 1.00 0.00 C ATOM 1170 C LEU A 82 0.200 6.824 -16.675 1.00 0.00 C ATOM 1171 O LEU A 82 1.331 7.189 -16.423 1.00 0.00 O ATOM 1172 CB LEU A 82 -1.523 5.745 -15.219 1.00 0.00 C ATOM 1173 CG LEU A 82 -2.368 5.974 -13.964 1.00 0.00 C ATOM 1174 CD1 LEU A 82 -3.495 4.941 -13.910 1.00 0.00 C ATOM 1175 CD2 LEU A 82 -1.485 5.827 -12.722 1.00 0.00 C ATOM 0 H LEU A 82 -2.861 7.331 -16.621 1.00 0.00 H new ATOM 0 HA LEU A 82 -0.581 7.647 -14.846 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -2.132 5.294 -16.003 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -0.713 5.048 -15.003 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.795 6.976 -13.993 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -4.096 5.105 -13.016 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -4.124 5.043 -14.794 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.068 3.938 -13.882 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -2.086 5.990 -11.827 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.059 4.824 -12.695 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -0.681 6.562 -12.758 1.00 0.00 H new ATOM 1187 N ASN A 83 -0.077 6.197 -17.787 1.00 0.00 N ATOM 1188 CA ASN A 83 1.006 5.916 -18.772 1.00 0.00 C ATOM 1189 C ASN A 83 1.801 7.196 -19.040 1.00 0.00 C ATOM 1190 O ASN A 83 3.005 7.169 -19.199 1.00 0.00 O ATOM 1191 CB ASN A 83 0.390 5.416 -20.080 1.00 0.00 C ATOM 1192 CG ASN A 83 1.461 5.400 -21.174 1.00 0.00 C ATOM 1193 OD1 ASN A 83 1.846 6.437 -21.677 1.00 0.00 O ATOM 1194 ND2 ASN A 83 1.962 4.260 -21.564 1.00 0.00 N ATOM 0 H ASN A 83 -1.005 5.868 -18.055 1.00 0.00 H new ATOM 0 HA ASN A 83 1.672 5.153 -18.368 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.020 4.415 -19.942 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.437 6.061 -20.375 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.677 4.239 -22.291 1.00 0.00 H new ATOM 0 HD22 ASN A 83 1.639 3.390 -21.142 1.00 0.00 H new ATOM 1201 N GLU A 84 1.137 8.318 -19.092 1.00 0.00 N ATOM 1202 CA GLU A 84 1.856 9.598 -19.351 1.00 0.00 C ATOM 1203 C GLU A 84 2.649 9.996 -18.106 1.00 0.00 C ATOM 1204 O GLU A 84 3.760 10.481 -18.193 1.00 0.00 O ATOM 1205 CB GLU A 84 0.841 10.694 -19.684 1.00 0.00 C ATOM 1206 CG GLU A 84 1.186 11.314 -21.040 1.00 0.00 C ATOM 1207 CD GLU A 84 0.683 10.404 -22.161 1.00 0.00 C ATOM 1208 OE1 GLU A 84 -0.271 9.680 -21.927 1.00 0.00 O ATOM 1209 OE2 GLU A 84 1.259 10.446 -23.236 1.00 0.00 O ATOM 0 H GLU A 84 0.128 8.404 -18.966 1.00 0.00 H new ATOM 0 HA GLU A 84 2.539 9.470 -20.191 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.166 10.277 -19.708 1.00 0.00 H new ATOM 0 HB3 GLU A 84 0.850 11.460 -18.909 1.00 0.00 H new ATOM 0 HG2 GLU A 84 0.731 12.301 -21.127 1.00 0.00 H new ATOM 0 HG3 GLU A 84 2.264 11.451 -21.125 1.00 0.00 H new ATOM 1216 N LEU A 85 2.089 9.796 -16.944 1.00 0.00 N ATOM 1217 CA LEU A 85 2.810 10.164 -15.693 1.00 0.00 C ATOM 1218 C LEU A 85 4.063 9.298 -15.553 1.00 0.00 C ATOM 1219 O LEU A 85 4.930 9.569 -14.745 1.00 0.00 O ATOM 1220 CB LEU A 85 1.893 9.931 -14.490 1.00 0.00 C ATOM 1221 CG LEU A 85 1.962 11.138 -13.554 1.00 0.00 C ATOM 1222 CD1 LEU A 85 0.684 11.208 -12.716 1.00 0.00 C ATOM 1223 CD2 LEU A 85 3.172 10.994 -12.627 1.00 0.00 C ATOM 0 H LEU A 85 1.162 9.393 -16.807 1.00 0.00 H new ATOM 0 HA LEU A 85 3.097 11.215 -15.734 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.868 9.776 -14.826 1.00 0.00 H new ATOM 0 HB3 LEU A 85 2.195 9.028 -13.959 1.00 0.00 H new ATOM 0 HG LEU A 85 2.060 12.050 -14.143 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.733 12.068 -12.049 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -0.178 11.309 -13.375 1.00 0.00 H new ATOM 0 HD13 LEU A 85 0.585 10.297 -12.126 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.223 11.854 -11.959 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.073 10.082 -12.038 1.00 0.00 H new ATOM 0 HD23 LEU A 85 4.083 10.943 -13.223 1.00 0.00 H new ATOM 1235 N GLY A 86 4.166 8.257 -16.332 1.00 0.00 N ATOM 1236 CA GLY A 86 5.362 7.374 -16.241 1.00 0.00 C ATOM 1237 C GLY A 86 5.262 6.506 -14.986 1.00 0.00 C ATOM 1238 O GLY A 86 6.256 6.078 -14.435 1.00 0.00 O ATOM 0 H GLY A 86 3.473 7.980 -17.028 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.430 6.743 -17.128 1.00 0.00 H new ATOM 0 HA3 GLY A 86 6.270 7.976 -16.208 1.00 0.00 H new ATOM 1242 N ILE A 87 4.068 6.244 -14.531 1.00 0.00 N ATOM 1243 CA ILE A 87 3.903 5.404 -13.312 1.00 0.00 C ATOM 1244 C ILE A 87 3.745 3.937 -13.722 1.00 0.00 C ATOM 1245 O ILE A 87 3.421 3.631 -14.852 1.00 0.00 O ATOM 1246 CB ILE A 87 2.659 5.856 -12.545 1.00 0.00 C ATOM 1247 CG1 ILE A 87 2.882 7.269 -12.000 1.00 0.00 C ATOM 1248 CG2 ILE A 87 2.399 4.898 -11.382 1.00 0.00 C ATOM 1249 CD1 ILE A 87 3.903 7.222 -10.863 1.00 0.00 C ATOM 0 H ILE A 87 3.199 6.575 -14.951 1.00 0.00 H new ATOM 0 HA ILE A 87 4.781 5.511 -12.675 1.00 0.00 H new ATOM 0 HB ILE A 87 1.800 5.855 -13.215 1.00 0.00 H new ATOM 0 HG12 ILE A 87 3.237 7.925 -12.795 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.941 7.684 -11.641 1.00 0.00 H new ATOM 0 HG21 ILE A 87 1.513 5.221 -10.836 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.241 3.891 -11.768 1.00 0.00 H new ATOM 0 HG23 ILE A 87 3.258 4.898 -10.711 1.00 0.00 H new ATOM 0 HD11 ILE A 87 4.062 8.228 -10.475 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.530 6.580 -10.065 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.846 6.824 -11.237 1.00 0.00 H new ATOM 1261 N LYS A 88 3.970 3.027 -12.814 1.00 0.00 N ATOM 1262 CA LYS A 88 3.831 1.584 -13.155 1.00 0.00 C ATOM 1263 C LYS A 88 2.359 1.179 -13.051 1.00 0.00 C ATOM 1264 O LYS A 88 1.822 1.026 -11.972 1.00 0.00 O ATOM 1265 CB LYS A 88 4.663 0.746 -12.181 1.00 0.00 C ATOM 1266 CG LYS A 88 6.080 1.318 -12.098 1.00 0.00 C ATOM 1267 CD LYS A 88 6.762 0.816 -10.823 1.00 0.00 C ATOM 1268 CE LYS A 88 7.762 -0.286 -11.177 1.00 0.00 C ATOM 1269 NZ LYS A 88 9.000 -0.114 -10.366 1.00 0.00 N ATOM 0 H LYS A 88 4.244 3.221 -11.851 1.00 0.00 H new ATOM 0 HA LYS A 88 4.185 1.413 -14.172 1.00 0.00 H new ATOM 0 HB2 LYS A 88 4.200 0.749 -11.194 1.00 0.00 H new ATOM 0 HB3 LYS A 88 4.697 -0.291 -12.514 1.00 0.00 H new ATOM 0 HG2 LYS A 88 6.656 1.018 -12.973 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.044 2.407 -12.099 1.00 0.00 H new ATOM 0 HD2 LYS A 88 7.274 1.639 -10.324 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.016 0.434 -10.126 1.00 0.00 H new ATOM 0 HE2 LYS A 88 7.323 -1.265 -10.986 1.00 0.00 H new ATOM 0 HE3 LYS A 88 8.002 -0.246 -12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 9.680 -0.863 -10.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 9.422 0.815 -10.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 8.764 -0.173 -9.355 1.00 0.00 H new ATOM 1283 N ILE A 89 1.700 1.005 -14.165 1.00 0.00 N ATOM 1284 CA ILE A 89 0.263 0.613 -14.127 1.00 0.00 C ATOM 1285 C ILE A 89 0.149 -0.912 -14.140 1.00 0.00 C ATOM 1286 O ILE A 89 1.005 -1.603 -14.655 1.00 0.00 O ATOM 1287 CB ILE A 89 -0.456 1.188 -15.349 1.00 0.00 C ATOM 1288 CG1 ILE A 89 -0.400 2.716 -15.300 1.00 0.00 C ATOM 1289 CG2 ILE A 89 -1.916 0.732 -15.343 1.00 0.00 C ATOM 1290 CD1 ILE A 89 0.290 3.243 -16.560 1.00 0.00 C ATOM 0 H ILE A 89 2.095 1.117 -15.099 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.195 1.004 -13.218 1.00 0.00 H new ATOM 0 HB ILE A 89 0.032 0.834 -16.257 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.408 3.125 -15.226 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.142 3.042 -14.412 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.429 1.141 -16.213 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.957 -0.357 -15.376 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -2.404 1.086 -14.435 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.330 4.332 -16.525 1.00 0.00 H new ATOM 0 HD12 ILE A 89 1.303 2.844 -16.614 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -0.271 2.929 -17.440 1.00 0.00 H new ATOM 1302 N TYR A 90 -0.902 -1.442 -13.577 1.00 0.00 N ATOM 1303 CA TYR A 90 -1.071 -2.923 -13.557 1.00 0.00 C ATOM 1304 C TYR A 90 -2.521 -3.274 -13.899 1.00 0.00 C ATOM 1305 O TYR A 90 -3.446 -2.605 -13.484 1.00 0.00 O ATOM 1306 CB TYR A 90 -0.728 -3.458 -12.167 1.00 0.00 C ATOM 1307 CG TYR A 90 0.612 -4.149 -12.213 1.00 0.00 C ATOM 1308 CD1 TYR A 90 0.707 -5.458 -12.702 1.00 0.00 C ATOM 1309 CD2 TYR A 90 1.760 -3.482 -11.768 1.00 0.00 C ATOM 1310 CE1 TYR A 90 1.952 -6.100 -12.746 1.00 0.00 C ATOM 1311 CE2 TYR A 90 3.005 -4.124 -11.812 1.00 0.00 C ATOM 1312 CZ TYR A 90 3.101 -5.433 -12.302 1.00 0.00 C ATOM 1313 OH TYR A 90 4.327 -6.065 -12.347 1.00 0.00 O ATOM 0 H TYR A 90 -1.651 -0.914 -13.130 1.00 0.00 H new ATOM 0 HA TYR A 90 -0.405 -3.375 -14.292 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -0.703 -2.641 -11.446 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -1.497 -4.154 -11.833 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -0.179 -5.972 -13.045 1.00 0.00 H new ATOM 0 HD2 TYR A 90 1.686 -2.473 -11.391 1.00 0.00 H new ATOM 0 HE1 TYR A 90 2.026 -7.110 -13.122 1.00 0.00 H new ATOM 0 HE2 TYR A 90 3.890 -3.610 -11.468 1.00 0.00 H new ATOM 0 HH TYR A 90 5.019 -5.462 -12.003 1.00 0.00 H new ATOM 1323 N ARG A 91 -2.726 -4.319 -14.652 1.00 0.00 N ATOM 1324 CA ARG A 91 -4.115 -4.712 -15.021 1.00 0.00 C ATOM 1325 C ARG A 91 -4.594 -5.830 -14.093 1.00 0.00 C ATOM 1326 O ARG A 91 -3.816 -6.635 -13.621 1.00 0.00 O ATOM 1327 CB ARG A 91 -4.139 -5.207 -16.468 1.00 0.00 C ATOM 1328 CG ARG A 91 -5.247 -4.485 -17.237 1.00 0.00 C ATOM 1329 CD ARG A 91 -6.323 -5.492 -17.647 1.00 0.00 C ATOM 1330 NE ARG A 91 -5.993 -6.054 -18.988 1.00 0.00 N ATOM 1331 CZ ARG A 91 -6.841 -6.841 -19.592 1.00 0.00 C ATOM 1332 NH1 ARG A 91 -7.654 -7.584 -18.893 1.00 0.00 N ATOM 1333 NH2 ARG A 91 -6.876 -6.882 -20.896 1.00 0.00 N ATOM 0 H ARG A 91 -1.991 -4.918 -15.028 1.00 0.00 H new ATOM 0 HA ARG A 91 -4.774 -3.849 -14.921 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.175 -5.024 -16.942 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -4.307 -6.284 -16.492 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -5.684 -3.702 -16.617 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.834 -3.999 -18.120 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -6.386 -6.293 -16.911 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -7.299 -5.007 -17.674 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.105 -5.823 -19.433 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -7.627 -7.550 -17.874 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -8.317 -8.199 -19.366 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -6.241 -6.299 -21.442 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -7.538 -7.497 -21.369 1.00 0.00 H new ATOM 1347 N ALA A 92 -5.870 -5.885 -13.827 1.00 0.00 N ATOM 1348 CA ALA A 92 -6.400 -6.952 -12.930 1.00 0.00 C ATOM 1349 C ALA A 92 -7.160 -7.986 -13.765 1.00 0.00 C ATOM 1350 O ALA A 92 -7.863 -7.651 -14.697 1.00 0.00 O ATOM 1351 CB ALA A 92 -7.346 -6.331 -11.902 1.00 0.00 C ATOM 0 H ALA A 92 -6.569 -5.238 -14.192 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.572 -7.438 -12.413 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.733 -7.111 -11.246 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.805 -5.594 -11.309 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.175 -5.845 -12.417 1.00 0.00 H new ATOM 1357 N THR A 93 -7.026 -9.243 -13.435 1.00 0.00 N ATOM 1358 CA THR A 93 -7.740 -10.297 -14.210 1.00 0.00 C ATOM 1359 C THR A 93 -9.084 -10.599 -13.545 1.00 0.00 C ATOM 1360 O THR A 93 -9.967 -11.182 -14.143 1.00 0.00 O ATOM 1361 CB THR A 93 -6.890 -11.569 -14.242 1.00 0.00 C ATOM 1362 OG1 THR A 93 -5.746 -11.391 -13.418 1.00 0.00 O ATOM 1363 CG2 THR A 93 -6.449 -11.855 -15.678 1.00 0.00 C ATOM 0 H THR A 93 -6.453 -9.584 -12.663 1.00 0.00 H new ATOM 0 HA THR A 93 -7.910 -9.946 -15.228 1.00 0.00 H new ATOM 0 HB THR A 93 -7.478 -12.409 -13.872 1.00 0.00 H new ATOM 0 HG1 THR A 93 -5.201 -12.205 -13.435 1.00 0.00 H new ATOM 0 HG21 THR A 93 -5.844 -12.761 -15.699 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.328 -11.991 -16.308 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.861 -11.017 -16.052 1.00 0.00 H new ATOM 1371 N GLY A 94 -9.248 -10.209 -12.310 1.00 0.00 N ATOM 1372 CA GLY A 94 -10.535 -10.475 -11.609 1.00 0.00 C ATOM 1373 C GLY A 94 -10.368 -11.668 -10.666 1.00 0.00 C ATOM 1374 O GLY A 94 -11.331 -12.222 -10.174 1.00 0.00 O ATOM 0 H GLY A 94 -8.546 -9.718 -11.757 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -10.843 -9.594 -11.046 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -11.321 -10.680 -12.336 1.00 0.00 H new ATOM 1378 N THR A 95 -9.153 -12.069 -10.410 1.00 0.00 N ATOM 1379 CA THR A 95 -8.926 -13.226 -9.499 1.00 0.00 C ATOM 1380 C THR A 95 -9.008 -12.754 -8.045 1.00 0.00 C ATOM 1381 O THR A 95 -9.773 -13.274 -7.257 1.00 0.00 O ATOM 1382 CB THR A 95 -7.542 -13.821 -9.764 1.00 0.00 C ATOM 1383 OG1 THR A 95 -7.502 -14.355 -11.080 1.00 0.00 O ATOM 1384 CG2 THR A 95 -7.261 -14.931 -8.750 1.00 0.00 C ATOM 0 H THR A 95 -8.308 -11.645 -10.792 1.00 0.00 H new ATOM 0 HA THR A 95 -9.688 -13.984 -9.679 1.00 0.00 H new ATOM 0 HB THR A 95 -6.785 -13.043 -9.666 1.00 0.00 H new ATOM 0 HG1 THR A 95 -6.615 -14.735 -11.252 1.00 0.00 H new ATOM 0 HG21 THR A 95 -6.275 -15.355 -8.939 1.00 0.00 H new ATOM 0 HG22 THR A 95 -7.292 -14.519 -7.741 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.016 -15.711 -8.846 1.00 0.00 H new ATOM 1392 N SER A 96 -8.224 -11.774 -7.684 1.00 0.00 N ATOM 1393 CA SER A 96 -8.259 -11.272 -6.281 1.00 0.00 C ATOM 1394 C SER A 96 -7.139 -10.251 -6.074 1.00 0.00 C ATOM 1395 O SER A 96 -5.995 -10.494 -6.403 1.00 0.00 O ATOM 1396 CB SER A 96 -8.062 -12.443 -5.319 1.00 0.00 C ATOM 1397 OG SER A 96 -9.327 -12.858 -4.822 1.00 0.00 O ATOM 0 H SER A 96 -7.562 -11.300 -8.299 1.00 0.00 H new ATOM 0 HA SER A 96 -9.222 -10.798 -6.089 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.570 -13.270 -5.830 1.00 0.00 H new ATOM 0 HB3 SER A 96 -7.413 -12.147 -4.495 1.00 0.00 H new ATOM 0 HG SER A 96 -9.809 -13.346 -5.522 1.00 0.00 H new ATOM 1403 N VAL A 97 -7.457 -9.108 -5.528 1.00 0.00 N ATOM 1404 CA VAL A 97 -6.409 -8.075 -5.298 1.00 0.00 C ATOM 1405 C VAL A 97 -5.399 -8.596 -4.274 1.00 0.00 C ATOM 1406 O VAL A 97 -4.264 -8.164 -4.233 1.00 0.00 O ATOM 1407 CB VAL A 97 -7.059 -6.794 -4.772 1.00 0.00 C ATOM 1408 CG1 VAL A 97 -8.060 -6.269 -5.802 1.00 0.00 C ATOM 1409 CG2 VAL A 97 -7.788 -7.091 -3.460 1.00 0.00 C ATOM 0 H VAL A 97 -8.397 -8.846 -5.232 1.00 0.00 H new ATOM 0 HA VAL A 97 -5.897 -7.860 -6.236 1.00 0.00 H new ATOM 0 HB VAL A 97 -6.288 -6.043 -4.598 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.523 -5.356 -5.427 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -7.542 -6.055 -6.737 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -8.830 -7.021 -5.977 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.251 -6.178 -3.086 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -8.558 -7.843 -3.634 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.076 -7.464 -2.724 1.00 0.00 H new ATOM 1419 N GLU A 98 -5.800 -9.524 -3.449 1.00 0.00 N ATOM 1420 CA GLU A 98 -4.860 -10.074 -2.434 1.00 0.00 C ATOM 1421 C GLU A 98 -3.735 -10.828 -3.144 1.00 0.00 C ATOM 1422 O GLU A 98 -2.573 -10.492 -3.019 1.00 0.00 O ATOM 1423 CB GLU A 98 -5.611 -11.032 -1.506 1.00 0.00 C ATOM 1424 CG GLU A 98 -4.664 -11.528 -0.411 1.00 0.00 C ATOM 1425 CD GLU A 98 -4.700 -13.056 -0.359 1.00 0.00 C ATOM 1426 OE1 GLU A 98 -4.730 -13.665 -1.415 1.00 0.00 O ATOM 1427 OE2 GLU A 98 -4.696 -13.592 0.737 1.00 0.00 O ATOM 0 H GLU A 98 -6.738 -9.925 -3.435 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.439 -9.258 -1.846 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.467 -10.526 -1.060 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -6.000 -11.876 -2.075 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -3.649 -11.184 -0.610 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -4.957 -11.114 0.554 1.00 0.00 H new ATOM 1434 N GLU A 99 -4.070 -11.842 -3.892 1.00 0.00 N ATOM 1435 CA GLU A 99 -3.022 -12.615 -4.614 1.00 0.00 C ATOM 1436 C GLU A 99 -2.278 -11.685 -5.574 1.00 0.00 C ATOM 1437 O GLU A 99 -1.119 -11.886 -5.876 1.00 0.00 O ATOM 1438 CB GLU A 99 -3.679 -13.749 -5.404 1.00 0.00 C ATOM 1439 CG GLU A 99 -4.515 -14.611 -4.456 1.00 0.00 C ATOM 1440 CD GLU A 99 -3.593 -15.532 -3.656 1.00 0.00 C ATOM 1441 OE1 GLU A 99 -2.388 -15.394 -3.792 1.00 0.00 O ATOM 1442 OE2 GLU A 99 -4.106 -16.358 -2.920 1.00 0.00 O ATOM 0 H GLU A 99 -5.026 -12.169 -4.035 1.00 0.00 H new ATOM 0 HA GLU A 99 -2.318 -13.035 -3.896 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.310 -13.339 -6.193 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.917 -14.358 -5.890 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.088 -13.976 -3.780 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -5.234 -15.202 -5.024 1.00 0.00 H new ATOM 1449 N ASN A 100 -2.936 -10.665 -6.053 1.00 0.00 N ATOM 1450 CA ASN A 100 -2.267 -9.719 -6.990 1.00 0.00 C ATOM 1451 C ASN A 100 -1.212 -8.911 -6.230 1.00 0.00 C ATOM 1452 O ASN A 100 -0.206 -8.512 -6.781 1.00 0.00 O ATOM 1453 CB ASN A 100 -3.309 -8.769 -7.584 1.00 0.00 C ATOM 1454 CG ASN A 100 -4.292 -9.564 -8.445 1.00 0.00 C ATOM 1455 OD1 ASN A 100 -4.421 -10.762 -8.291 1.00 0.00 O ATOM 1456 ND2 ASN A 100 -4.996 -8.943 -9.351 1.00 0.00 N ATOM 0 H ASN A 100 -3.908 -10.446 -5.836 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.787 -10.279 -7.793 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -3.843 -8.253 -6.786 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.818 -8.004 -8.186 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.655 -9.463 -9.930 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -4.888 -7.937 -9.480 1.00 0.00 H new ATOM 1463 N LEU A 101 -1.434 -8.669 -4.966 1.00 0.00 N ATOM 1464 CA LEU A 101 -0.444 -7.888 -4.172 1.00 0.00 C ATOM 1465 C LEU A 101 0.903 -8.615 -4.182 1.00 0.00 C ATOM 1466 O LEU A 101 1.900 -8.088 -4.635 1.00 0.00 O ATOM 1467 CB LEU A 101 -0.941 -7.755 -2.731 1.00 0.00 C ATOM 1468 CG LEU A 101 0.145 -7.102 -1.873 1.00 0.00 C ATOM 1469 CD1 LEU A 101 -0.507 -6.305 -0.742 1.00 0.00 C ATOM 1470 CD2 LEU A 101 1.044 -8.189 -1.278 1.00 0.00 C ATOM 0 H LEU A 101 -2.258 -8.978 -4.450 1.00 0.00 H new ATOM 0 HA LEU A 101 -0.325 -6.897 -4.609 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -1.851 -7.155 -2.703 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -1.194 -8.737 -2.331 1.00 0.00 H new ATOM 0 HG LEU A 101 0.742 -6.432 -2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.267 -5.840 -0.131 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -1.149 -5.532 -1.165 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -1.105 -6.974 -0.123 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.818 -7.726 -0.666 1.00 0.00 H new ATOM 0 HD22 LEU A 101 0.445 -8.858 -0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 101 1.509 -8.758 -2.083 1.00 0.00 H new ATOM 1482 N LYS A 102 0.939 -9.822 -3.687 1.00 0.00 N ATOM 1483 CA LYS A 102 2.220 -10.584 -3.669 1.00 0.00 C ATOM 1484 C LYS A 102 2.665 -10.863 -5.106 1.00 0.00 C ATOM 1485 O LYS A 102 3.841 -10.980 -5.390 1.00 0.00 O ATOM 1486 CB LYS A 102 2.014 -11.909 -2.931 1.00 0.00 C ATOM 1487 CG LYS A 102 3.091 -12.070 -1.856 1.00 0.00 C ATOM 1488 CD LYS A 102 2.461 -12.647 -0.584 1.00 0.00 C ATOM 1489 CE LYS A 102 3.382 -12.379 0.609 1.00 0.00 C ATOM 1490 NZ LYS A 102 2.981 -11.105 1.270 1.00 0.00 N ATOM 0 H LYS A 102 0.136 -10.314 -3.294 1.00 0.00 H new ATOM 0 HA LYS A 102 2.985 -10.000 -3.158 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.024 -11.933 -2.475 1.00 0.00 H new ATOM 0 HB3 LYS A 102 2.061 -12.740 -3.635 1.00 0.00 H new ATOM 0 HG2 LYS A 102 3.882 -12.729 -2.214 1.00 0.00 H new ATOM 0 HG3 LYS A 102 3.552 -11.106 -1.641 1.00 0.00 H new ATOM 0 HD2 LYS A 102 1.484 -12.195 -0.412 1.00 0.00 H new ATOM 0 HD3 LYS A 102 2.300 -13.719 -0.699 1.00 0.00 H new ATOM 0 HE2 LYS A 102 3.324 -13.204 1.319 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.418 -12.318 0.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.607 -10.923 2.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 3.058 -10.322 0.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 1.998 -11.180 1.601 1.00 0.00 H new ATOM 1504 N LEU A 103 1.735 -10.973 -6.015 1.00 0.00 N ATOM 1505 CA LEU A 103 2.105 -11.246 -7.433 1.00 0.00 C ATOM 1506 C LEU A 103 2.883 -10.057 -7.999 1.00 0.00 C ATOM 1507 O LEU A 103 3.730 -10.207 -8.858 1.00 0.00 O ATOM 1508 CB LEU A 103 0.834 -11.461 -8.258 1.00 0.00 C ATOM 1509 CG LEU A 103 0.525 -12.956 -8.338 1.00 0.00 C ATOM 1510 CD1 LEU A 103 -0.985 -13.173 -8.233 1.00 0.00 C ATOM 1511 CD2 LEU A 103 1.027 -13.509 -9.675 1.00 0.00 C ATOM 0 H LEU A 103 0.734 -10.886 -5.837 1.00 0.00 H new ATOM 0 HA LEU A 103 2.727 -12.140 -7.479 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.002 -10.930 -7.803 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.964 -11.052 -9.260 1.00 0.00 H new ATOM 0 HG LEU A 103 1.024 -13.474 -7.518 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -1.204 -14.239 -8.290 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.344 -12.779 -7.282 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.485 -12.655 -9.052 1.00 0.00 H new ATOM 0 HD21 LEU A 103 0.807 -14.575 -9.733 1.00 0.00 H new ATOM 0 HD22 LEU A 103 0.528 -12.990 -10.494 1.00 0.00 H new ATOM 0 HD23 LEU A 103 2.103 -13.356 -9.751 1.00 0.00 H new ATOM 1523 N PHE A 104 2.601 -8.873 -7.527 1.00 0.00 N ATOM 1524 CA PHE A 104 3.322 -7.674 -8.040 1.00 0.00 C ATOM 1525 C PHE A 104 4.824 -7.829 -7.783 1.00 0.00 C ATOM 1526 O PHE A 104 5.644 -7.353 -8.541 1.00 0.00 O ATOM 1527 CB PHE A 104 2.806 -6.427 -7.320 1.00 0.00 C ATOM 1528 CG PHE A 104 3.682 -5.246 -7.663 1.00 0.00 C ATOM 1529 CD1 PHE A 104 4.875 -5.031 -6.959 1.00 0.00 C ATOM 1530 CD2 PHE A 104 3.303 -4.366 -8.685 1.00 0.00 C ATOM 1531 CE1 PHE A 104 5.688 -3.934 -7.278 1.00 0.00 C ATOM 1532 CE2 PHE A 104 4.116 -3.270 -9.003 1.00 0.00 C ATOM 1533 CZ PHE A 104 5.309 -3.054 -8.300 1.00 0.00 C ATOM 0 H PHE A 104 1.902 -8.685 -6.808 1.00 0.00 H new ATOM 0 HA PHE A 104 3.148 -7.575 -9.112 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.776 -6.226 -7.613 1.00 0.00 H new ATOM 0 HB3 PHE A 104 2.805 -6.591 -6.242 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.168 -5.710 -6.172 1.00 0.00 H new ATOM 0 HD2 PHE A 104 2.384 -4.532 -9.228 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.607 -3.767 -6.736 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.823 -2.591 -9.790 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.936 -2.210 -8.546 1.00 0.00 H new ATOM 1543 N THR A 105 5.189 -8.490 -6.717 1.00 0.00 N ATOM 1544 CA THR A 105 6.636 -8.672 -6.412 1.00 0.00 C ATOM 1545 C THR A 105 7.277 -9.576 -7.468 1.00 0.00 C ATOM 1546 O THR A 105 8.380 -9.336 -7.916 1.00 0.00 O ATOM 1547 CB THR A 105 6.786 -9.318 -5.033 1.00 0.00 C ATOM 1548 OG1 THR A 105 6.043 -8.570 -4.079 1.00 0.00 O ATOM 1549 CG2 THR A 105 8.261 -9.337 -4.632 1.00 0.00 C ATOM 0 H THR A 105 4.547 -8.911 -6.045 1.00 0.00 H new ATOM 0 HA THR A 105 7.131 -7.701 -6.419 1.00 0.00 H new ATOM 0 HB THR A 105 6.410 -10.340 -5.068 1.00 0.00 H new ATOM 0 HG1 THR A 105 6.660 -8.092 -3.486 1.00 0.00 H new ATOM 0 HG21 THR A 105 8.365 -9.798 -3.650 1.00 0.00 H new ATOM 0 HG22 THR A 105 8.830 -9.911 -5.364 1.00 0.00 H new ATOM 0 HG23 THR A 105 8.642 -8.316 -4.596 1.00 0.00 H new ATOM 1557 N GLU A 106 6.593 -10.613 -7.870 1.00 0.00 N ATOM 1558 CA GLU A 106 7.167 -11.529 -8.897 1.00 0.00 C ATOM 1559 C GLU A 106 6.989 -10.915 -10.288 1.00 0.00 C ATOM 1560 O GLU A 106 7.301 -11.525 -11.290 1.00 0.00 O ATOM 1561 CB GLU A 106 6.442 -12.876 -8.840 1.00 0.00 C ATOM 1562 CG GLU A 106 7.094 -13.763 -7.777 1.00 0.00 C ATOM 1563 CD GLU A 106 8.127 -14.677 -8.437 1.00 0.00 C ATOM 1564 OE1 GLU A 106 8.441 -14.446 -9.593 1.00 0.00 O ATOM 1565 OE2 GLU A 106 8.587 -15.592 -7.774 1.00 0.00 O ATOM 0 H GLU A 106 5.664 -10.865 -7.533 1.00 0.00 H new ATOM 0 HA GLU A 106 8.229 -11.677 -8.698 1.00 0.00 H new ATOM 0 HB2 GLU A 106 5.388 -12.724 -8.606 1.00 0.00 H new ATOM 0 HB3 GLU A 106 6.485 -13.365 -9.813 1.00 0.00 H new ATOM 0 HG2 GLU A 106 7.572 -13.145 -7.017 1.00 0.00 H new ATOM 0 HG3 GLU A 106 6.335 -14.360 -7.271 1.00 0.00 H new ATOM 1572 N GLY A 107 6.489 -9.710 -10.358 1.00 0.00 N ATOM 1573 CA GLY A 107 6.294 -9.062 -11.685 1.00 0.00 C ATOM 1574 C GLY A 107 5.637 -10.053 -12.645 1.00 0.00 C ATOM 1575 O GLY A 107 5.833 -9.995 -13.843 1.00 0.00 O ATOM 0 H GLY A 107 6.208 -9.148 -9.554 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.671 -8.174 -11.580 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.253 -8.733 -12.085 1.00 0.00 H new ATOM 1579 N ASN A 108 4.858 -10.965 -12.131 1.00 0.00 N ATOM 1580 CA ASN A 108 4.191 -11.959 -13.017 1.00 0.00 C ATOM 1581 C ASN A 108 2.958 -11.320 -13.659 1.00 0.00 C ATOM 1582 O ASN A 108 2.605 -11.622 -14.783 1.00 0.00 O ATOM 1583 CB ASN A 108 3.766 -13.177 -12.192 1.00 0.00 C ATOM 1584 CG ASN A 108 4.928 -14.167 -12.109 1.00 0.00 C ATOM 1585 OD1 ASN A 108 6.072 -13.795 -12.287 1.00 0.00 O ATOM 1586 ND2 ASN A 108 4.686 -15.421 -11.846 1.00 0.00 N ATOM 0 H ASN A 108 4.655 -11.064 -11.136 1.00 0.00 H new ATOM 0 HA ASN A 108 4.885 -12.275 -13.796 1.00 0.00 H new ATOM 0 HB2 ASN A 108 3.468 -12.865 -11.191 1.00 0.00 H new ATOM 0 HB3 ASN A 108 2.899 -13.655 -12.649 1.00 0.00 H new ATOM 0 HD21 ASN A 108 5.456 -16.088 -11.790 1.00 0.00 H new ATOM 0 HD22 ASN A 108 3.727 -15.735 -11.696 1.00 0.00 H new ATOM 1593 N LEU A 109 2.303 -10.437 -12.957 1.00 0.00 N ATOM 1594 CA LEU A 109 1.095 -9.777 -13.529 1.00 0.00 C ATOM 1595 C LEU A 109 1.509 -8.907 -14.718 1.00 0.00 C ATOM 1596 O LEU A 109 2.661 -8.874 -15.103 1.00 0.00 O ATOM 1597 CB LEU A 109 0.437 -8.904 -12.459 1.00 0.00 C ATOM 1598 CG LEU A 109 -0.324 -9.791 -11.472 1.00 0.00 C ATOM 1599 CD1 LEU A 109 -0.897 -8.929 -10.346 1.00 0.00 C ATOM 1600 CD2 LEU A 109 -1.468 -10.499 -12.200 1.00 0.00 C ATOM 0 H LEU A 109 2.552 -10.144 -12.012 1.00 0.00 H new ATOM 0 HA LEU A 109 0.386 -10.535 -13.862 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.194 -8.323 -11.933 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -0.245 -8.192 -12.924 1.00 0.00 H new ATOM 0 HG LEU A 109 0.357 -10.532 -11.053 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.439 -9.562 -9.643 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -0.084 -8.423 -9.826 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -1.577 -8.187 -10.765 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.011 -11.131 -11.497 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.147 -9.757 -12.619 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.063 -11.114 -13.003 1.00 0.00 H new ATOM 1612 N GLU A 110 0.580 -8.204 -15.304 1.00 0.00 N ATOM 1613 CA GLU A 110 0.925 -7.339 -16.468 1.00 0.00 C ATOM 1614 C GLU A 110 0.860 -5.869 -16.051 1.00 0.00 C ATOM 1615 O GLU A 110 0.021 -5.472 -15.268 1.00 0.00 O ATOM 1616 CB GLU A 110 -0.070 -7.589 -17.604 1.00 0.00 C ATOM 1617 CG GLU A 110 -1.445 -7.045 -17.210 1.00 0.00 C ATOM 1618 CD GLU A 110 -2.405 -7.181 -18.392 1.00 0.00 C ATOM 1619 OE1 GLU A 110 -2.808 -8.297 -18.678 1.00 0.00 O ATOM 1620 OE2 GLU A 110 -2.723 -6.168 -18.992 1.00 0.00 O ATOM 0 H GLU A 110 -0.402 -8.191 -15.028 1.00 0.00 H new ATOM 0 HA GLU A 110 1.933 -7.576 -16.808 1.00 0.00 H new ATOM 0 HB2 GLU A 110 0.276 -7.105 -18.517 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -0.137 -8.656 -17.815 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.831 -7.591 -16.349 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -1.363 -5.999 -16.913 1.00 0.00 H new ATOM 1627 N GLU A 111 1.741 -5.057 -16.570 1.00 0.00 N ATOM 1628 CA GLU A 111 1.728 -3.613 -16.206 1.00 0.00 C ATOM 1629 C GLU A 111 1.942 -2.772 -17.466 1.00 0.00 C ATOM 1630 O GLU A 111 1.984 -3.286 -18.566 1.00 0.00 O ATOM 1631 CB GLU A 111 2.848 -3.328 -15.202 1.00 0.00 C ATOM 1632 CG GLU A 111 4.153 -3.951 -15.702 1.00 0.00 C ATOM 1633 CD GLU A 111 5.229 -2.870 -15.804 1.00 0.00 C ATOM 1634 OE1 GLU A 111 5.516 -2.250 -14.793 1.00 0.00 O ATOM 1635 OE2 GLU A 111 5.750 -2.680 -16.891 1.00 0.00 O ATOM 0 H GLU A 111 2.468 -5.332 -17.230 1.00 0.00 H new ATOM 0 HA GLU A 111 0.768 -3.358 -15.757 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.972 -2.253 -15.075 1.00 0.00 H new ATOM 0 HB3 GLU A 111 2.588 -3.737 -14.226 1.00 0.00 H new ATOM 0 HG2 GLU A 111 4.477 -4.738 -15.021 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.997 -4.416 -16.675 1.00 0.00 H new ATOM 1642 N ILE A 112 2.079 -1.483 -17.317 1.00 0.00 N ATOM 1643 CA ILE A 112 2.290 -0.614 -18.510 1.00 0.00 C ATOM 1644 C ILE A 112 3.167 0.579 -18.124 1.00 0.00 C ATOM 1645 O ILE A 112 3.118 1.064 -17.011 1.00 0.00 O ATOM 1646 CB ILE A 112 0.939 -0.110 -19.020 1.00 0.00 C ATOM 1647 CG1 ILE A 112 0.184 -1.264 -19.683 1.00 0.00 C ATOM 1648 CG2 ILE A 112 1.162 1.007 -20.042 1.00 0.00 C ATOM 1649 CD1 ILE A 112 -0.922 -1.754 -18.748 1.00 0.00 C ATOM 0 H ILE A 112 2.054 -0.994 -16.422 1.00 0.00 H new ATOM 0 HA ILE A 112 2.783 -1.188 -19.294 1.00 0.00 H new ATOM 0 HB ILE A 112 0.356 0.275 -18.184 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -0.245 -0.936 -20.630 1.00 0.00 H new ATOM 0 HG13 ILE A 112 0.871 -2.079 -19.910 1.00 0.00 H new ATOM 0 HG21 ILE A 112 0.199 1.366 -20.405 1.00 0.00 H new ATOM 0 HG22 ILE A 112 1.701 1.829 -19.571 1.00 0.00 H new ATOM 0 HG23 ILE A 112 1.745 0.623 -20.879 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -1.460 -2.576 -19.220 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -0.481 -2.099 -17.812 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -1.614 -0.937 -18.544 1.00 0.00 H new ATOM 1661 N ARG A 113 3.969 1.055 -19.037 1.00 0.00 N ATOM 1662 CA ARG A 113 4.849 2.217 -18.726 1.00 0.00 C ATOM 1663 C ARG A 113 5.697 2.556 -19.954 1.00 0.00 C ATOM 1664 O ARG A 113 5.556 3.609 -20.546 1.00 0.00 O ATOM 1665 CB ARG A 113 5.766 1.861 -17.554 1.00 0.00 C ATOM 1666 CG ARG A 113 6.259 3.144 -16.884 1.00 0.00 C ATOM 1667 CD ARG A 113 7.761 3.034 -16.615 1.00 0.00 C ATOM 1668 NE ARG A 113 8.392 4.376 -16.757 1.00 0.00 N ATOM 1669 CZ ARG A 113 9.213 4.812 -15.841 1.00 0.00 C ATOM 1670 NH1 ARG A 113 9.893 3.965 -15.117 1.00 0.00 N ATOM 1671 NH2 ARG A 113 9.354 6.095 -15.650 1.00 0.00 N ATOM 0 H ARG A 113 4.053 0.689 -19.985 1.00 0.00 H new ATOM 0 HA ARG A 113 4.236 3.078 -18.459 1.00 0.00 H new ATOM 0 HB2 ARG A 113 5.229 1.245 -16.833 1.00 0.00 H new ATOM 0 HB3 ARG A 113 6.614 1.274 -17.907 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.055 4.003 -17.524 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.722 3.308 -15.950 1.00 0.00 H new ATOM 0 HD2 ARG A 113 7.934 2.644 -15.612 1.00 0.00 H new ATOM 0 HD3 ARG A 113 8.216 2.331 -17.313 1.00 0.00 H new ATOM 0 HE ARG A 113 8.182 4.954 -17.571 1.00 0.00 H new ATOM 0 HH11 ARG A 113 9.783 2.962 -15.267 1.00 0.00 H new ATOM 0 HH12 ARG A 113 10.535 4.306 -14.401 1.00 0.00 H new ATOM 0 HH21 ARG A 113 8.823 6.756 -16.216 1.00 0.00 H new ATOM 0 HH22 ARG A 113 9.995 6.437 -14.934 1.00 0.00 H new ATOM 1685 N SER A 114 6.577 1.674 -20.342 1.00 0.00 N ATOM 1686 CA SER A 114 7.432 1.945 -21.532 1.00 0.00 C ATOM 1687 C SER A 114 8.111 0.643 -21.974 1.00 0.00 C ATOM 1688 O SER A 114 9.226 0.362 -21.580 1.00 0.00 O ATOM 1689 CB SER A 114 8.498 2.982 -21.173 1.00 0.00 C ATOM 1690 OG SER A 114 8.221 3.510 -19.883 1.00 0.00 O ATOM 0 H SER A 114 6.741 0.777 -19.886 1.00 0.00 H new ATOM 0 HA SER A 114 6.815 2.330 -22.344 1.00 0.00 H new ATOM 0 HB2 SER A 114 9.487 2.524 -21.187 1.00 0.00 H new ATOM 0 HB3 SER A 114 8.507 3.783 -21.912 1.00 0.00 H new ATOM 0 HG SER A 114 8.902 4.174 -19.648 1.00 0.00 H new ATOM 1696 N PRO A 115 7.410 -0.114 -22.778 1.00 0.00 N ATOM 1697 CA PRO A 115 7.905 -1.403 -23.296 1.00 0.00 C ATOM 1698 C PRO A 115 8.869 -1.190 -24.469 1.00 0.00 C ATOM 1699 O PRO A 115 9.205 -2.115 -25.180 1.00 0.00 O ATOM 1700 CB PRO A 115 6.631 -2.108 -23.769 1.00 0.00 C ATOM 1701 CG PRO A 115 5.585 -0.998 -24.027 1.00 0.00 C ATOM 1702 CD PRO A 115 6.054 0.243 -23.243 1.00 0.00 C ATOM 0 HA PRO A 115 8.461 -1.972 -22.551 1.00 0.00 H new ATOM 0 HB2 PRO A 115 6.819 -2.682 -24.676 1.00 0.00 H new ATOM 0 HB3 PRO A 115 6.274 -2.810 -23.016 1.00 0.00 H new ATOM 0 HG2 PRO A 115 5.509 -0.777 -25.092 1.00 0.00 H new ATOM 0 HG3 PRO A 115 4.596 -1.314 -23.696 1.00 0.00 H new ATOM 0 HD2 PRO A 115 6.071 1.131 -23.875 1.00 0.00 H new ATOM 0 HD3 PRO A 115 5.390 0.460 -22.406 1.00 0.00 H new ATOM 1710 N GLY A 116 9.317 0.018 -24.681 1.00 0.00 N ATOM 1711 CA GLY A 116 10.256 0.272 -25.809 1.00 0.00 C ATOM 1712 C GLY A 116 11.258 1.356 -25.411 1.00 0.00 C ATOM 1713 O GLY A 116 11.041 2.105 -24.480 1.00 0.00 O ATOM 0 H GLY A 116 9.074 0.837 -24.124 1.00 0.00 H new ATOM 0 HA2 GLY A 116 10.783 -0.646 -26.070 1.00 0.00 H new ATOM 0 HA3 GLY A 116 9.701 0.583 -26.694 1.00 0.00 H new ATOM 1717 N SER A 117 12.357 1.446 -26.109 1.00 0.00 N ATOM 1718 CA SER A 117 13.372 2.482 -25.771 1.00 0.00 C ATOM 1719 C SER A 117 13.484 3.482 -26.924 1.00 0.00 C ATOM 1720 O SER A 117 14.113 4.514 -26.804 1.00 0.00 O ATOM 1721 CB SER A 117 14.729 1.814 -25.544 1.00 0.00 C ATOM 1722 OG SER A 117 15.682 2.802 -25.176 1.00 0.00 O ATOM 0 H SER A 117 12.595 0.846 -26.899 1.00 0.00 H new ATOM 0 HA SER A 117 13.068 3.004 -24.864 1.00 0.00 H new ATOM 0 HB2 SER A 117 14.650 1.059 -24.762 1.00 0.00 H new ATOM 0 HB3 SER A 117 15.051 1.301 -26.450 1.00 0.00 H new ATOM 0 HG SER A 117 15.460 3.650 -25.614 1.00 0.00 H new ATOM 1728 N GLY A 118 12.878 3.184 -28.041 1.00 0.00 N ATOM 1729 CA GLY A 118 12.950 4.119 -29.199 1.00 0.00 C ATOM 1730 C GLY A 118 12.188 5.402 -28.867 1.00 0.00 C ATOM 1731 O GLY A 118 12.575 6.485 -29.258 1.00 0.00 O ATOM 0 H GLY A 118 12.337 2.334 -28.201 1.00 0.00 H new ATOM 0 HA2 GLY A 118 13.990 4.350 -29.429 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.524 3.650 -30.086 1.00 0.00 H new ATOM 1735 N ARG A 119 11.105 5.289 -28.148 1.00 0.00 N ATOM 1736 CA ARG A 119 10.319 6.502 -27.792 1.00 0.00 C ATOM 1737 C ARG A 119 11.266 7.597 -27.296 1.00 0.00 C ATOM 1738 O ARG A 119 12.383 7.332 -26.898 1.00 0.00 O ATOM 1739 CB ARG A 119 9.317 6.156 -26.687 1.00 0.00 C ATOM 1740 CG ARG A 119 10.048 5.465 -25.534 1.00 0.00 C ATOM 1741 CD ARG A 119 9.916 6.309 -24.266 1.00 0.00 C ATOM 1742 NE ARG A 119 8.630 5.987 -23.586 1.00 0.00 N ATOM 1743 CZ ARG A 119 8.455 6.299 -22.330 1.00 0.00 C ATOM 1744 NH1 ARG A 119 9.360 6.994 -21.696 1.00 0.00 N ATOM 1745 NH2 ARG A 119 7.373 5.916 -21.709 1.00 0.00 N ATOM 0 H ARG A 119 10.731 4.409 -27.792 1.00 0.00 H new ATOM 0 HA ARG A 119 9.782 6.857 -28.672 1.00 0.00 H new ATOM 0 HB2 ARG A 119 8.826 7.061 -26.330 1.00 0.00 H new ATOM 0 HB3 ARG A 119 8.537 5.504 -27.080 1.00 0.00 H new ATOM 0 HG2 ARG A 119 9.630 4.472 -25.368 1.00 0.00 H new ATOM 0 HG3 ARG A 119 11.100 5.330 -25.786 1.00 0.00 H new ATOM 0 HD2 ARG A 119 10.753 6.112 -23.596 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.952 7.369 -24.517 1.00 0.00 H new ATOM 0 HE ARG A 119 7.884 5.521 -24.103 1.00 0.00 H new ATOM 0 HH11 ARG A 119 10.205 7.294 -22.182 1.00 0.00 H new ATOM 0 HH12 ARG A 119 9.222 7.237 -20.715 1.00 0.00 H new ATOM 0 HH21 ARG A 119 6.665 5.374 -22.205 1.00 0.00 H new ATOM 0 HH22 ARG A 119 7.235 6.159 -20.728 1.00 0.00 H new ATOM 1759 N GLY A 120 10.830 8.826 -27.319 1.00 0.00 N ATOM 1760 CA GLY A 120 11.706 9.936 -26.849 1.00 0.00 C ATOM 1761 C GLY A 120 11.234 11.253 -27.465 1.00 0.00 C ATOM 1762 O GLY A 120 11.572 11.583 -28.584 1.00 0.00 O ATOM 0 H GLY A 120 9.905 9.110 -27.643 1.00 0.00 H new ATOM 0 HA2 GLY A 120 11.678 10.000 -25.761 1.00 0.00 H new ATOM 0 HA3 GLY A 120 12.741 9.741 -27.130 1.00 0.00 H new ATOM 1766 N ARG A 121 10.451 12.009 -26.744 1.00 0.00 N ATOM 1767 CA ARG A 121 9.957 13.304 -27.288 1.00 0.00 C ATOM 1768 C ARG A 121 9.070 13.987 -26.246 1.00 0.00 C ATOM 1769 O ARG A 121 7.912 14.267 -26.487 1.00 0.00 O ATOM 1770 CB ARG A 121 9.145 13.046 -28.560 1.00 0.00 C ATOM 1771 CG ARG A 121 10.033 13.262 -29.787 1.00 0.00 C ATOM 1772 CD ARG A 121 9.384 14.296 -30.709 1.00 0.00 C ATOM 1773 NE ARG A 121 8.992 13.644 -31.990 1.00 0.00 N ATOM 1774 CZ ARG A 121 7.929 14.048 -32.631 1.00 0.00 C ATOM 1775 NH1 ARG A 121 6.769 14.053 -32.034 1.00 0.00 N ATOM 1776 NH2 ARG A 121 8.028 14.448 -33.870 1.00 0.00 N ATOM 0 H ARG A 121 10.133 11.785 -25.801 1.00 0.00 H new ATOM 0 HA ARG A 121 10.804 13.948 -27.523 1.00 0.00 H new ATOM 0 HB2 ARG A 121 8.755 12.028 -28.555 1.00 0.00 H new ATOM 0 HB3 ARG A 121 8.286 13.716 -28.598 1.00 0.00 H new ATOM 0 HG2 ARG A 121 11.021 13.603 -29.479 1.00 0.00 H new ATOM 0 HG3 ARG A 121 10.172 12.321 -30.319 1.00 0.00 H new ATOM 0 HD2 ARG A 121 8.508 14.730 -30.227 1.00 0.00 H new ATOM 0 HD3 ARG A 121 10.079 15.113 -30.902 1.00 0.00 H new ATOM 0 HE ARG A 121 9.555 12.881 -32.367 1.00 0.00 H new ATOM 0 HH11 ARG A 121 6.692 13.741 -31.066 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.939 14.369 -32.535 1.00 0.00 H new ATOM 0 HH21 ARG A 121 8.935 14.445 -34.336 1.00 0.00 H new ATOM 0 HH22 ARG A 121 7.198 14.764 -34.372 1.00 0.00 H new ATOM 1790 N ARG A 122 9.605 14.257 -25.086 1.00 0.00 N ATOM 1791 CA ARG A 122 8.793 14.921 -24.026 1.00 0.00 C ATOM 1792 C ARG A 122 8.419 16.332 -24.479 1.00 0.00 C ATOM 1793 O ARG A 122 9.254 17.211 -24.558 1.00 0.00 O ATOM 1794 CB ARG A 122 9.611 14.998 -22.736 1.00 0.00 C ATOM 1795 CG ARG A 122 10.205 13.624 -22.423 1.00 0.00 C ATOM 1796 CD ARG A 122 9.739 13.169 -21.039 1.00 0.00 C ATOM 1797 NE ARG A 122 8.277 12.882 -21.076 1.00 0.00 N ATOM 1798 CZ ARG A 122 7.562 12.996 -19.990 1.00 0.00 C ATOM 1799 NH1 ARG A 122 7.582 12.048 -19.094 1.00 0.00 N ATOM 1800 NH2 ARG A 122 6.827 14.058 -19.800 1.00 0.00 N ATOM 0 H ARG A 122 10.569 14.047 -24.827 1.00 0.00 H new ATOM 0 HA ARG A 122 7.884 14.346 -23.848 1.00 0.00 H new ATOM 0 HB2 ARG A 122 10.408 15.734 -22.842 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.979 15.329 -21.912 1.00 0.00 H new ATOM 0 HG2 ARG A 122 9.895 12.902 -23.178 1.00 0.00 H new ATOM 0 HG3 ARG A 122 11.294 13.671 -22.454 1.00 0.00 H new ATOM 0 HD2 ARG A 122 10.288 12.278 -20.734 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.950 13.942 -20.300 1.00 0.00 H new ATOM 0 HE ARG A 122 7.835 12.597 -21.950 1.00 0.00 H new ATOM 0 HH11 ARG A 122 8.156 11.218 -19.242 1.00 0.00 H new ATOM 0 HH12 ARG A 122 7.023 12.137 -18.245 1.00 0.00 H new ATOM 0 HH21 ARG A 122 6.811 14.799 -20.500 1.00 0.00 H new ATOM 0 HH22 ARG A 122 6.268 14.146 -18.951 1.00 0.00 H new ATOM 1814 N ARG A 123 7.169 16.559 -24.777 1.00 0.00 N ATOM 1815 CA ARG A 123 6.745 17.916 -25.224 1.00 0.00 C ATOM 1816 C ARG A 123 5.218 18.006 -25.214 1.00 0.00 C ATOM 1817 O ARG A 123 4.538 17.257 -25.887 1.00 0.00 O ATOM 1818 CB ARG A 123 7.264 18.169 -26.641 1.00 0.00 C ATOM 1819 CG ARG A 123 8.505 19.061 -26.581 1.00 0.00 C ATOM 1820 CD ARG A 123 8.182 20.428 -27.188 1.00 0.00 C ATOM 1821 NE ARG A 123 6.789 20.815 -26.826 1.00 0.00 N ATOM 1822 CZ ARG A 123 6.010 21.359 -27.720 1.00 0.00 C ATOM 1823 NH1 ARG A 123 5.669 20.686 -28.786 1.00 0.00 N ATOM 1824 NH2 ARG A 123 5.571 22.576 -27.550 1.00 0.00 N ATOM 0 H ARG A 123 6.424 15.864 -24.730 1.00 0.00 H new ATOM 0 HA ARG A 123 7.154 18.666 -24.547 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.507 17.223 -27.125 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.490 18.645 -27.243 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.832 19.178 -25.548 1.00 0.00 H new ATOM 0 HG3 ARG A 123 9.327 18.595 -27.124 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.885 21.176 -26.822 1.00 0.00 H new ATOM 0 HD3 ARG A 123 8.291 20.392 -28.272 1.00 0.00 H new ATOM 0 HE ARG A 123 6.445 20.655 -25.879 1.00 0.00 H new ATOM 0 HH11 ARG A 123 6.012 19.735 -28.920 1.00 0.00 H new ATOM 0 HH12 ARG A 123 5.060 21.112 -29.485 1.00 0.00 H new ATOM 0 HH21 ARG A 123 5.837 23.102 -26.718 1.00 0.00 H new ATOM 0 HH22 ARG A 123 4.962 23.001 -28.249 1.00 0.00 H new ATOM 1838 N ARG A 124 4.672 18.918 -24.455 1.00 0.00 N ATOM 1839 CA ARG A 124 3.190 19.056 -24.403 1.00 0.00 C ATOM 1840 C ARG A 124 2.627 19.052 -25.826 1.00 0.00 C ATOM 1841 O ARG A 124 2.619 20.106 -26.441 1.00 0.00 O ATOM 1842 CB ARG A 124 2.825 20.373 -23.713 1.00 0.00 C ATOM 1843 CG ARG A 124 1.369 20.318 -23.244 1.00 0.00 C ATOM 1844 CD ARG A 124 0.552 21.377 -23.987 1.00 0.00 C ATOM 1845 NE ARG A 124 -0.866 21.322 -23.531 1.00 0.00 N ATOM 1846 CZ ARG A 124 -1.146 21.391 -22.259 1.00 0.00 C ATOM 1847 NH1 ARG A 124 -1.026 22.525 -21.625 1.00 0.00 N ATOM 1848 NH2 ARG A 124 -1.546 20.326 -21.620 1.00 0.00 N ATOM 1849 OXT ARG A 124 2.216 17.996 -26.277 1.00 0.00 O ATOM 0 H ARG A 124 5.189 19.573 -23.869 1.00 0.00 H new ATOM 0 HA ARG A 124 2.766 18.222 -23.843 1.00 0.00 H new ATOM 0 HB2 ARG A 124 3.485 20.546 -22.863 1.00 0.00 H new ATOM 0 HB3 ARG A 124 2.965 21.207 -24.401 1.00 0.00 H new ATOM 0 HG2 ARG A 124 0.954 19.327 -23.429 1.00 0.00 H new ATOM 0 HG3 ARG A 124 1.315 20.490 -22.169 1.00 0.00 H new ATOM 0 HD2 ARG A 124 0.967 22.368 -23.801 1.00 0.00 H new ATOM 0 HD3 ARG A 124 0.606 21.205 -25.062 1.00 0.00 H new ATOM 0 HE ARG A 124 -1.618 21.230 -24.214 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -0.713 23.358 -22.124 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -1.245 22.579 -20.630 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -1.640 19.439 -22.115 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -1.765 20.380 -20.625 1.00 0.00 H new TER 1863 ARG A 124