USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1050 hydrogens (25 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 122 SER OG : rot 17:sc= 0.643 USER MOD Set 1.2: A 125 THR OG1 : rot -100:sc= 0.761 USER MOD Set 2.1: A 99 GLN : amide:sc= -0.766 K(o=-0.74,f=-4.5) USER MOD Set 2.2: A 109 LYS NZ :NH3+ -132:sc= 0.0268 (180deg=-0.181) USER MOD Set 3.1: A 64 TYR OH : rot -30:sc= 0.85 USER MOD Set 3.2: A 71 CYS SG : rot -85:sc= 0.865 USER MOD Set 4.1: A 62 SER OG : rot -40:sc= 0.161 USER MOD Set 4.2: A 66 GLN : amide:sc= -0.673 K(o=-0.51,f=-5.7!) USER MOD Set 5.1: A 3 LYS NZ :NH3+ -170:sc= 0.0108 (180deg=-0.579) USER MOD Set 5.2: A 5 THR OG1 : rot 168:sc= 0.9 USER MOD Single : A 1 MET CE :methyl 176:sc= 0 (180deg=-0.0483) USER MOD Single : A 1 MET N :NH3+ -161:sc= -0.0665 (180deg=-0.683) USER MOD Single : A 4 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0145) USER MOD Single : A 13 SER OG : rot 37:sc= 0.599 USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 ASN : amide:sc=-0.00953 X(o=-0.0095,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 135:sc= -0.0581 (180deg=-0.405) USER MOD Single : A 25 HIS : no HD1:sc= -4.18! C(o=-4.2!,f=-7!) USER MOD Single : A 26 SER OG : rot 93:sc= 0.979 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0319 USER MOD Single : A 29 ASN : amide:sc= -0.441 X(o=-0.44,f=-0.13) USER MOD Single : A 33 ASN : amide:sc= -0.117 X(o=-0.12,f=-0.1) USER MOD Single : A 36 ASN : amide:sc= -0.0296 K(o=-0.03,f=-2) USER MOD Single : A 41 SER OG : rot -43:sc= 0.0718 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.542 X(o=-0.54,f=-0.16) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot -120:sc=-0.00962 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 CYS SG : rot -139:sc= -1.68 USER MOD Single : A 61 SER OG : rot -42:sc= 0.913 USER MOD Single : A 72 LYS NZ :NH3+ -151:sc= -0.0417 (180deg=-0.647) USER MOD Single : A 77 LYS NZ :NH3+ -160:sc= -0.712 (180deg=-2.47) USER MOD Single : A 78 CYS SG : rot 179:sc= -1.51 USER MOD Single : A 84 LYS NZ :NH3+ -176:sc= -0.453 (180deg=-0.468) USER MOD Single : A 87 LYS NZ :NH3+ -173:sc= -0.213 (180deg=-0.346) USER MOD Single : A 93 ASN : amide:sc= -0.0459 X(o=-0.046,f=-0.14) USER MOD Single : A 98 LYS NZ :NH3+ -122:sc= -0.0963 (180deg=-0.615) USER MOD Single : A 100 ASN : amide:sc= 0.0849 K(o=0.085,f=-4!) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 MET CE :methyl -145:sc= -0.0347 (180deg=-0.688) USER MOD Single : A 117 TYR OH : rot -66:sc= -0.488 USER MOD Single : A 121 THR OG1 : rot -69:sc= -0.449! USER MOD Single : A 126 THR OG1 : rot -55:sc= 0.695 USER MOD Single : A 130 MET CE :methyl -165:sc= -6.56! (180deg=-7.27!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 FOP N4 :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 DBI O2' : rot -170:sc= 0.657 USER MOD Single : A 139 DBI O5' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.264 6.678 10.490 1.00 0.00 N ATOM 2 CA MET A 1 -2.244 5.286 10.883 1.00 0.00 C ATOM 3 C MET A 1 -3.711 4.843 10.945 1.00 0.00 C ATOM 4 O MET A 1 -4.047 3.733 10.556 1.00 0.00 O ATOM 5 CB MET A 1 -1.501 5.105 12.220 1.00 0.00 C ATOM 6 CG MET A 1 -1.219 3.636 12.564 1.00 0.00 C ATOM 7 SD MET A 1 -0.417 3.489 14.172 1.00 0.00 S ATOM 8 CE MET A 1 -0.032 1.730 14.139 1.00 0.00 C ATOM 0 H1 MET A 1 -1.330 6.948 10.122 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.982 6.820 9.751 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.495 7.268 11.315 1.00 0.00 H new ATOM 0 HA MET A 1 -1.699 4.665 10.172 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.557 5.649 12.180 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.092 5.551 13.020 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.153 3.074 12.567 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.584 3.195 11.796 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.536 1.465 15.031 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.958 1.155 14.114 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.559 1.504 13.252 1.00 0.00 H new ATOM 20 N GLU A 2 -4.558 5.771 11.455 1.00 0.00 N ATOM 21 CA GLU A 2 -5.993 5.538 11.576 1.00 0.00 C ATOM 22 C GLU A 2 -6.674 6.409 10.497 1.00 0.00 C ATOM 23 O GLU A 2 -7.864 6.690 10.580 1.00 0.00 O ATOM 24 CB GLU A 2 -6.494 5.901 12.992 1.00 0.00 C ATOM 25 CG GLU A 2 -6.182 4.837 14.060 1.00 0.00 C ATOM 26 CD GLU A 2 -4.678 4.690 14.339 1.00 0.00 C ATOM 27 OE1 GLU A 2 -4.080 5.629 14.864 1.00 0.00 O ATOM 28 OE2 GLU A 2 -4.122 3.638 14.032 1.00 0.00 O ATOM 0 H GLU A 2 -4.257 6.687 11.787 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.233 4.485 11.428 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -6.044 6.847 13.294 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -7.572 6.059 12.955 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -6.694 5.099 14.986 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -6.581 3.876 13.735 1.00 0.00 H new ATOM 35 N LYS A 3 -5.874 6.810 9.480 1.00 0.00 N ATOM 36 CA LYS A 3 -6.340 7.637 8.389 1.00 0.00 C ATOM 37 C LYS A 3 -7.149 6.721 7.466 1.00 0.00 C ATOM 38 O LYS A 3 -6.757 5.616 7.116 1.00 0.00 O ATOM 39 CB LYS A 3 -5.136 8.315 7.705 1.00 0.00 C ATOM 40 CG LYS A 3 -5.073 9.840 7.899 1.00 0.00 C ATOM 41 CD LYS A 3 -5.117 10.648 6.590 1.00 0.00 C ATOM 42 CE LYS A 3 -6.518 11.167 6.247 1.00 0.00 C ATOM 43 NZ LYS A 3 -7.515 10.118 6.109 1.00 0.00 N ATOM 0 H LYS A 3 -4.888 6.558 9.412 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.983 8.454 8.716 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.218 7.873 8.091 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.170 8.097 6.637 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.906 10.149 8.531 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.157 10.089 8.435 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.433 11.493 6.669 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.758 10.023 5.772 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.839 11.860 7.025 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.468 11.733 5.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.389 10.520 5.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -7.155 9.379 5.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -7.715 9.704 7.042 1.00 0.00 H new ATOM 56 N LYS A 4 -8.314 7.297 7.114 1.00 0.00 N ATOM 57 CA LYS A 4 -9.312 6.665 6.272 1.00 0.00 C ATOM 58 C LYS A 4 -8.868 6.847 4.828 1.00 0.00 C ATOM 59 O LYS A 4 -9.223 7.819 4.173 1.00 0.00 O ATOM 60 CB LYS A 4 -10.697 7.280 6.564 1.00 0.00 C ATOM 61 CG LYS A 4 -10.761 8.818 6.499 1.00 0.00 C ATOM 62 CD LYS A 4 -12.119 9.356 6.963 1.00 0.00 C ATOM 63 CE LYS A 4 -12.185 10.887 6.930 1.00 0.00 C ATOM 64 NZ LYS A 4 -12.119 11.428 5.578 1.00 0.00 N ATOM 0 H LYS A 4 -8.580 8.233 7.420 1.00 0.00 H new ATOM 0 HA LYS A 4 -9.404 5.598 6.473 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -11.415 6.872 5.852 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -11.016 6.961 7.556 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.972 9.240 7.121 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -10.571 9.146 5.477 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -12.905 8.948 6.327 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -12.317 9.009 7.977 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -13.110 11.216 7.403 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -11.363 11.294 7.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -12.236 12.461 5.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.197 11.197 5.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -12.877 11.012 5.000 1.00 0.00 H new ATOM 77 N THR A 5 -8.072 5.854 4.358 1.00 0.00 N ATOM 78 CA THR A 5 -7.587 5.955 2.993 1.00 0.00 C ATOM 79 C THR A 5 -6.841 4.640 2.691 1.00 0.00 C ATOM 80 O THR A 5 -5.854 4.297 3.332 1.00 0.00 O ATOM 81 CB THR A 5 -6.670 7.221 2.843 1.00 0.00 C ATOM 82 OG1 THR A 5 -6.563 8.158 3.963 1.00 0.00 O ATOM 83 CG2 THR A 5 -6.924 7.919 1.489 1.00 0.00 C ATOM 0 H THR A 5 -7.776 5.029 4.880 1.00 0.00 H new ATOM 0 HA THR A 5 -8.398 6.084 2.276 1.00 0.00 H new ATOM 0 HB THR A 5 -5.666 6.796 2.867 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.825 8.782 3.799 1.00 0.00 H new ATOM 0 HG21 THR A 5 -6.279 8.794 1.404 1.00 0.00 H new ATOM 0 HG22 THR A 5 -6.705 7.227 0.676 1.00 0.00 H new ATOM 0 HG23 THR A 5 -7.967 8.230 1.430 1.00 0.00 H new ATOM 91 N ILE A 6 -7.361 3.943 1.653 1.00 0.00 N ATOM 92 CA ILE A 6 -6.802 2.692 1.198 1.00 0.00 C ATOM 93 C ILE A 6 -6.944 2.707 -0.314 1.00 0.00 C ATOM 94 O ILE A 6 -8.039 2.634 -0.855 1.00 0.00 O ATOM 95 CB ILE A 6 -7.532 1.438 1.769 1.00 0.00 C ATOM 96 CG1 ILE A 6 -8.232 1.579 3.133 1.00 0.00 C ATOM 97 CG2 ILE A 6 -7.001 0.141 1.061 1.00 0.00 C ATOM 98 CD1 ILE A 6 -8.767 0.258 3.700 1.00 0.00 C ATOM 0 H ILE A 6 -8.177 4.249 1.123 1.00 0.00 H new ATOM 0 HA ILE A 6 -5.770 2.614 1.540 1.00 0.00 H new ATOM 0 HB ILE A 6 -8.582 1.230 1.563 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -7.531 2.011 3.847 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.059 2.282 3.034 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -7.516 -0.731 1.465 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -7.189 0.209 -0.011 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -5.930 0.043 1.236 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -9.246 0.442 4.662 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.494 -0.167 3.008 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -7.942 -0.441 3.833 1.00 0.00 H new ATOM 110 N VAL A 7 -5.754 2.774 -0.943 1.00 0.00 N ATOM 111 CA VAL A 7 -5.615 2.763 -2.380 1.00 0.00 C ATOM 112 C VAL A 7 -5.253 1.327 -2.776 1.00 0.00 C ATOM 113 O VAL A 7 -4.190 0.832 -2.422 1.00 0.00 O ATOM 114 CB VAL A 7 -4.604 3.852 -2.862 1.00 0.00 C ATOM 115 CG1 VAL A 7 -3.294 3.816 -2.017 1.00 0.00 C ATOM 116 CG2 VAL A 7 -4.615 4.487 -4.268 1.00 0.00 C ATOM 0 H VAL A 7 -4.865 2.837 -0.447 1.00 0.00 H new ATOM 0 HA VAL A 7 -6.542 3.036 -2.885 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.158 4.773 -2.680 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -2.609 4.585 -2.375 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -3.532 4.001 -0.969 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -2.824 2.837 -2.115 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -3.808 5.215 -4.345 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -4.475 3.710 -5.019 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.570 4.985 -4.435 1.00 0.00 H new ATOM 126 N LEU A 8 -6.207 0.685 -3.503 1.00 0.00 N ATOM 127 CA LEU A 8 -5.998 -0.716 -3.874 1.00 0.00 C ATOM 128 C LEU A 8 -6.129 -0.875 -5.393 1.00 0.00 C ATOM 129 O LEU A 8 -6.803 -0.114 -6.076 1.00 0.00 O ATOM 130 CB LEU A 8 -6.969 -1.620 -3.086 1.00 0.00 C ATOM 131 CG LEU A 8 -8.484 -1.340 -3.356 1.00 0.00 C ATOM 132 CD1 LEU A 8 -9.109 -2.543 -4.125 1.00 0.00 C ATOM 133 CD2 LEU A 8 -9.290 -0.318 -2.517 1.00 0.00 C ATOM 0 H LEU A 8 -7.081 1.100 -3.824 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.989 -1.030 -3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.756 -2.660 -3.331 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.775 -1.498 -2.020 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.623 -0.479 -4.010 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -10.165 -2.346 -4.312 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.591 -2.677 -5.075 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -9.009 -3.449 -3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.319 -0.284 -2.876 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -9.281 -0.619 -1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.839 0.669 -2.614 1.00 0.00 H new ATOM 145 N GLY A 9 -5.424 -1.944 -5.855 1.00 0.00 N ATOM 146 CA GLY A 9 -5.427 -2.308 -7.274 1.00 0.00 C ATOM 147 C GLY A 9 -4.288 -3.281 -7.641 1.00 0.00 C ATOM 148 O GLY A 9 -3.804 -4.034 -6.810 1.00 0.00 O ATOM 0 H GLY A 9 -4.858 -2.553 -5.264 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -6.384 -2.764 -7.526 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.336 -1.404 -7.877 1.00 0.00 H new ATOM 152 N VAL A 10 -3.940 -3.184 -8.949 1.00 0.00 N ATOM 153 CA VAL A 10 -2.915 -3.890 -9.731 1.00 0.00 C ATOM 154 C VAL A 10 -3.370 -5.224 -10.371 1.00 0.00 C ATOM 155 O VAL A 10 -4.302 -5.228 -11.160 1.00 0.00 O ATOM 156 CB VAL A 10 -1.406 -3.730 -9.325 1.00 0.00 C ATOM 157 CG1 VAL A 10 -1.038 -4.281 -7.921 1.00 0.00 C ATOM 158 CG2 VAL A 10 -0.282 -3.501 -10.368 1.00 0.00 C ATOM 0 H VAL A 10 -4.439 -2.525 -9.546 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.844 -3.242 -10.605 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.411 -2.644 -9.231 1.00 0.00 H new ATOM 0 HG11 VAL A 10 0.024 -4.123 -7.735 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.621 -3.760 -7.161 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.259 -5.348 -7.879 1.00 0.00 H new ATOM 0 HG21 VAL A 10 0.677 -3.420 -9.857 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.253 -4.341 -11.062 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.479 -2.581 -10.919 1.00 0.00 H new ATOM 168 N ILE A 11 -2.640 -6.322 -10.055 1.00 0.00 N ATOM 169 CA ILE A 11 -2.824 -7.694 -10.569 1.00 0.00 C ATOM 170 C ILE A 11 -2.487 -7.722 -12.070 1.00 0.00 C ATOM 171 O ILE A 11 -2.678 -6.762 -12.806 1.00 0.00 O ATOM 172 CB ILE A 11 -4.174 -8.439 -10.246 1.00 0.00 C ATOM 173 CG1 ILE A 11 -4.022 -9.928 -9.829 1.00 0.00 C ATOM 174 CG2 ILE A 11 -5.407 -7.750 -10.907 1.00 0.00 C ATOM 175 CD1 ILE A 11 -5.326 -10.728 -9.603 1.00 0.00 C ATOM 0 H ILE A 11 -1.863 -6.266 -9.396 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.121 -8.294 -9.991 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.623 -8.320 -9.260 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -3.440 -10.438 -10.597 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.438 -9.965 -8.910 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -6.312 -8.302 -10.653 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.492 -6.727 -10.541 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -5.280 -7.738 -11.990 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.080 -11.751 -9.317 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.908 -10.259 -8.810 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.910 -10.739 -10.523 1.00 0.00 H new ATOM 187 N GLY A 12 -1.964 -8.917 -12.459 1.00 0.00 N ATOM 188 CA GLY A 12 -1.571 -9.185 -13.833 1.00 0.00 C ATOM 189 C GLY A 12 -2.623 -10.048 -14.541 1.00 0.00 C ATOM 190 O GLY A 12 -3.793 -9.699 -14.645 1.00 0.00 O ATOM 0 H GLY A 12 -1.812 -9.700 -11.823 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -1.444 -8.245 -14.370 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -0.607 -9.693 -13.848 1.00 0.00 H new ATOM 194 N SER A 13 -2.099 -11.200 -15.009 1.00 0.00 N ATOM 195 CA SER A 13 -2.862 -12.194 -15.736 1.00 0.00 C ATOM 196 C SER A 13 -3.340 -13.209 -14.701 1.00 0.00 C ATOM 197 O SER A 13 -2.573 -14.055 -14.258 1.00 0.00 O ATOM 198 CB SER A 13 -1.881 -12.903 -16.714 1.00 0.00 C ATOM 199 OG SER A 13 -0.672 -13.561 -16.151 1.00 0.00 O ATOM 0 H SER A 13 -1.119 -11.454 -14.882 1.00 0.00 H new ATOM 0 HA SER A 13 -3.700 -11.763 -16.284 1.00 0.00 H new ATOM 0 HB2 SER A 13 -2.446 -13.658 -17.261 1.00 0.00 H new ATOM 0 HB3 SER A 13 -1.548 -12.164 -17.443 1.00 0.00 H new ATOM 0 HG SER A 13 -0.894 -13.970 -15.288 1.00 0.00 H new ATOM 205 N ASP A 14 -4.640 -13.093 -14.348 1.00 0.00 N ATOM 206 CA ASP A 14 -5.196 -14.017 -13.385 1.00 0.00 C ATOM 207 C ASP A 14 -6.706 -13.733 -13.359 1.00 0.00 C ATOM 208 O ASP A 14 -7.198 -13.165 -12.392 1.00 0.00 O ATOM 209 CB ASP A 14 -4.528 -13.819 -11.994 1.00 0.00 C ATOM 210 CG ASP A 14 -4.969 -14.830 -10.918 1.00 0.00 C ATOM 211 OD1 ASP A 14 -5.473 -15.899 -11.262 1.00 0.00 O ATOM 212 OD2 ASP A 14 -4.796 -14.530 -9.738 1.00 0.00 O ATOM 0 H ASP A 14 -5.287 -12.392 -14.709 1.00 0.00 H new ATOM 0 HA ASP A 14 -5.012 -15.057 -13.653 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -3.446 -13.884 -12.113 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -4.750 -12.812 -11.640 1.00 0.00 H new ATOM 217 N CYS A 15 -7.407 -14.159 -14.454 1.00 0.00 N ATOM 218 CA CYS A 15 -8.850 -13.971 -14.566 1.00 0.00 C ATOM 219 C CYS A 15 -9.116 -12.471 -14.792 1.00 0.00 C ATOM 220 O CYS A 15 -9.273 -12.039 -15.928 1.00 0.00 O ATOM 221 CB CYS A 15 -9.643 -14.586 -13.391 1.00 0.00 C ATOM 222 SG CYS A 15 -11.436 -14.522 -13.642 1.00 0.00 S ATOM 0 H CYS A 15 -6.981 -14.628 -15.253 1.00 0.00 H new ATOM 0 HA CYS A 15 -9.227 -14.527 -15.425 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.337 -15.623 -13.256 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -9.391 -14.057 -12.472 1.00 0.00 H new ATOM 0 HG CYS A 15 -12.037 -15.056 -12.620 1.00 0.00 H new ATOM 228 N HIS A 16 -9.169 -11.704 -13.671 1.00 0.00 N ATOM 229 CA HIS A 16 -9.442 -10.287 -13.793 1.00 0.00 C ATOM 230 C HIS A 16 -8.816 -9.666 -12.555 1.00 0.00 C ATOM 231 O HIS A 16 -7.867 -8.899 -12.652 1.00 0.00 O ATOM 232 CB HIS A 16 -10.961 -10.040 -13.901 1.00 0.00 C ATOM 233 CG HIS A 16 -11.258 -8.557 -13.924 1.00 0.00 C ATOM 234 ND1 HIS A 16 -11.982 -7.921 -12.978 1.00 0.00 N ATOM 235 CD2 HIS A 16 -10.852 -7.614 -14.882 1.00 0.00 C ATOM 236 CE1 HIS A 16 -12.015 -6.630 -13.350 1.00 0.00 C ATOM 237 NE2 HIS A 16 -11.341 -6.414 -14.495 1.00 0.00 N ATOM 0 H HIS A 16 -9.030 -12.044 -12.720 1.00 0.00 H new ATOM 0 HA HIS A 16 -9.024 -9.841 -14.695 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -11.348 -10.508 -14.806 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -11.472 -10.506 -13.058 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -10.260 -7.810 -15.763 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -12.523 -5.856 -12.795 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -11.223 -5.522 -14.975 1.00 0.00 H new ATOM 245 N ALA A 17 -9.405 -10.041 -11.397 1.00 0.00 N ATOM 246 CA ALA A 17 -8.892 -9.508 -10.154 1.00 0.00 C ATOM 247 C ALA A 17 -9.474 -10.358 -9.030 1.00 0.00 C ATOM 248 O ALA A 17 -10.546 -10.094 -8.499 1.00 0.00 O ATOM 249 CB ALA A 17 -9.232 -8.016 -9.977 1.00 0.00 C ATOM 0 H ALA A 17 -10.196 -10.680 -11.314 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.803 -9.556 -10.146 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -8.826 -7.660 -9.030 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -8.796 -7.444 -10.796 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.314 -7.887 -9.980 1.00 0.00 H new ATOM 255 N VAL A 18 -8.662 -11.389 -8.701 1.00 0.00 N ATOM 256 CA VAL A 18 -8.954 -12.305 -7.604 1.00 0.00 C ATOM 257 C VAL A 18 -8.269 -11.777 -6.306 1.00 0.00 C ATOM 258 O VAL A 18 -8.068 -12.509 -5.345 1.00 0.00 O ATOM 259 CB VAL A 18 -8.484 -13.744 -7.995 1.00 0.00 C ATOM 260 CG1 VAL A 18 -9.218 -14.795 -7.105 1.00 0.00 C ATOM 261 CG2 VAL A 18 -7.930 -14.107 -9.391 1.00 0.00 C ATOM 0 H VAL A 18 -7.793 -11.598 -9.193 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.025 -12.358 -7.410 1.00 0.00 H new ATOM 0 HB VAL A 18 -7.416 -13.775 -7.780 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.889 -15.797 -7.379 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -8.984 -14.611 -6.056 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -10.294 -14.712 -7.257 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -7.672 -15.166 -9.416 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -8.686 -13.900 -10.148 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -7.040 -13.512 -9.595 1.00 0.00 H new ATOM 271 N GLY A 19 -7.930 -10.461 -6.349 1.00 0.00 N ATOM 272 CA GLY A 19 -7.309 -9.704 -5.259 1.00 0.00 C ATOM 273 C GLY A 19 -8.281 -8.609 -4.775 1.00 0.00 C ATOM 274 O GLY A 19 -8.369 -8.261 -3.593 1.00 0.00 O ATOM 0 H GLY A 19 -8.093 -9.890 -7.178 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -7.057 -10.372 -4.435 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.377 -9.253 -5.600 1.00 0.00 H new ATOM 278 N ASN A 20 -9.056 -8.129 -5.794 1.00 0.00 N ATOM 279 CA ASN A 20 -10.104 -7.122 -5.627 1.00 0.00 C ATOM 280 C ASN A 20 -10.912 -7.563 -4.401 1.00 0.00 C ATOM 281 O ASN A 20 -11.268 -6.734 -3.570 1.00 0.00 O ATOM 282 CB ASN A 20 -10.975 -7.027 -6.896 1.00 0.00 C ATOM 283 CG ASN A 20 -12.092 -5.979 -6.752 1.00 0.00 C ATOM 284 OD1 ASN A 20 -11.906 -4.800 -7.029 1.00 0.00 O ATOM 285 ND2 ASN A 20 -13.255 -6.490 -6.304 1.00 0.00 N ATOM 0 H ASN A 20 -8.954 -8.446 -6.758 1.00 0.00 H new ATOM 0 HA ASN A 20 -9.694 -6.123 -5.477 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -10.346 -6.772 -7.749 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -11.417 -8.001 -7.106 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -14.063 -5.881 -6.173 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -13.328 -7.486 -6.096 1.00 0.00 H new ATOM 292 N LYS A 21 -11.079 -8.933 -4.420 1.00 0.00 N ATOM 293 CA LYS A 21 -11.640 -10.035 -3.621 1.00 0.00 C ATOM 294 C LYS A 21 -11.943 -9.507 -2.238 1.00 0.00 C ATOM 295 O LYS A 21 -11.523 -9.970 -1.185 1.00 0.00 O ATOM 296 CB LYS A 21 -10.613 -11.192 -3.631 1.00 0.00 C ATOM 297 CG LYS A 21 -11.188 -12.608 -3.458 1.00 0.00 C ATOM 298 CD LYS A 21 -11.373 -13.069 -2.000 1.00 0.00 C ATOM 299 CE LYS A 21 -12.779 -13.612 -1.729 1.00 0.00 C ATOM 300 NZ LYS A 21 -13.799 -12.578 -1.838 1.00 0.00 N ATOM 0 H LYS A 21 -10.700 -9.380 -5.254 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.575 -10.423 -4.026 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.065 -11.157 -4.573 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.890 -11.016 -2.835 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -12.153 -12.654 -3.962 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.530 -13.314 -3.964 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.639 -13.841 -1.771 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -11.175 -12.232 -1.330 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.999 -14.413 -2.435 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.812 -14.048 -0.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.606 -12.942 -2.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.120 -12.305 -0.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -13.401 -11.747 -2.321 1.00 0.00 H new ATOM 313 N ILE A 22 -12.738 -8.461 -2.397 1.00 0.00 N ATOM 314 CA ILE A 22 -13.275 -7.605 -1.393 1.00 0.00 C ATOM 315 C ILE A 22 -12.185 -7.271 -0.367 1.00 0.00 C ATOM 316 O ILE A 22 -12.435 -7.314 0.832 1.00 0.00 O ATOM 317 CB ILE A 22 -14.665 -8.034 -0.841 1.00 0.00 C ATOM 318 CG1 ILE A 22 -15.791 -6.955 -1.169 1.00 0.00 C ATOM 319 CG2 ILE A 22 -14.739 -9.605 -0.748 1.00 0.00 C ATOM 320 CD1 ILE A 22 -16.061 -6.544 -2.648 1.00 0.00 C ATOM 0 H ILE A 22 -13.043 -8.177 -3.328 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.555 -6.657 -1.852 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.957 -7.941 0.205 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -16.729 -7.329 -0.759 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -15.542 -6.047 -0.619 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -15.714 -9.901 -0.361 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -14.596 -10.035 -1.739 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -13.958 -9.967 -0.079 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -16.859 -5.802 -2.680 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -15.154 -6.121 -3.079 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -16.360 -7.422 -3.221 1.00 0.00 H new ATOM 332 N LEU A 23 -10.944 -6.937 -0.863 1.00 0.00 N ATOM 333 CA LEU A 23 -10.004 -6.431 0.135 1.00 0.00 C ATOM 334 C LEU A 23 -10.608 -5.035 0.538 1.00 0.00 C ATOM 335 O LEU A 23 -10.413 -4.518 1.634 1.00 0.00 O ATOM 336 CB LEU A 23 -8.575 -6.317 -0.432 1.00 0.00 C ATOM 337 CG LEU A 23 -7.412 -6.478 0.585 1.00 0.00 C ATOM 338 CD1 LEU A 23 -6.150 -6.459 -0.359 1.00 0.00 C ATOM 339 CD2 LEU A 23 -7.844 -5.677 1.871 1.00 0.00 C ATOM 0 H LEU A 23 -10.621 -7.004 -1.828 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.896 -7.095 0.993 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.455 -7.071 -1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.475 -5.344 -0.913 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.107 -7.335 1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.246 -6.566 0.240 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.214 -7.283 -1.069 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.116 -5.514 -0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -7.062 -5.753 2.627 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.998 -4.629 1.612 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.771 -6.094 2.265 1.00 0.00 H new ATOM 351 N ASP A 24 -11.409 -4.475 -0.410 1.00 0.00 N ATOM 352 CA ASP A 24 -12.084 -3.226 -0.133 1.00 0.00 C ATOM 353 C ASP A 24 -13.146 -3.491 0.983 1.00 0.00 C ATOM 354 O ASP A 24 -13.609 -2.558 1.620 1.00 0.00 O ATOM 355 CB ASP A 24 -12.650 -2.668 -1.457 1.00 0.00 C ATOM 356 CG ASP A 24 -13.030 -1.178 -1.387 1.00 0.00 C ATOM 357 OD1 ASP A 24 -12.232 -0.384 -0.887 1.00 0.00 O ATOM 358 OD2 ASP A 24 -14.121 -0.824 -1.836 1.00 0.00 O ATOM 0 H ASP A 24 -11.584 -4.870 -1.334 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.418 -2.454 0.252 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -11.911 -2.809 -2.246 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -13.531 -3.246 -1.738 1.00 0.00 H new ATOM 363 N HIS A 25 -13.503 -4.776 1.253 1.00 0.00 N ATOM 364 CA HIS A 25 -14.488 -5.010 2.329 1.00 0.00 C ATOM 365 C HIS A 25 -13.824 -4.681 3.665 1.00 0.00 C ATOM 366 O HIS A 25 -14.480 -4.310 4.630 1.00 0.00 O ATOM 367 CB HIS A 25 -15.238 -6.368 2.377 1.00 0.00 C ATOM 368 CG HIS A 25 -14.462 -7.603 2.818 1.00 0.00 C ATOM 369 ND1 HIS A 25 -14.645 -8.796 2.216 1.00 0.00 N ATOM 370 CD2 HIS A 25 -13.518 -7.795 3.849 1.00 0.00 C ATOM 371 CE1 HIS A 25 -13.849 -9.671 2.848 1.00 0.00 C ATOM 372 NE2 HIS A 25 -13.153 -9.096 3.840 1.00 0.00 N ATOM 0 H HIS A 25 -13.151 -5.607 0.777 1.00 0.00 H new ATOM 0 HA HIS A 25 -15.314 -4.340 2.092 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -16.091 -6.254 3.046 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -15.637 -6.563 1.382 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -13.152 -7.037 4.525 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -13.777 -10.717 2.588 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -12.483 -9.549 4.462 1.00 0.00 H new ATOM 380 N SER A 26 -12.481 -4.823 3.640 1.00 0.00 N ATOM 381 CA SER A 26 -11.666 -4.558 4.812 1.00 0.00 C ATOM 382 C SER A 26 -11.715 -3.052 5.120 1.00 0.00 C ATOM 383 O SER A 26 -11.445 -2.639 6.242 1.00 0.00 O ATOM 384 CB SER A 26 -10.219 -5.107 4.660 1.00 0.00 C ATOM 385 OG SER A 26 -9.080 -4.165 4.550 1.00 0.00 O ATOM 0 H SER A 26 -11.954 -5.119 2.818 1.00 0.00 H new ATOM 0 HA SER A 26 -12.075 -5.096 5.667 1.00 0.00 H new ATOM 0 HB2 SER A 26 -10.025 -5.753 5.516 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.203 -5.741 3.773 1.00 0.00 H new ATOM 0 HG SER A 26 -8.708 -3.996 5.441 1.00 0.00 H new ATOM 391 N PHE A 27 -12.093 -2.261 4.081 1.00 0.00 N ATOM 392 CA PHE A 27 -12.228 -0.808 4.241 1.00 0.00 C ATOM 393 C PHE A 27 -13.257 -0.565 5.340 1.00 0.00 C ATOM 394 O PHE A 27 -13.069 0.243 6.234 1.00 0.00 O ATOM 395 CB PHE A 27 -12.581 -0.012 2.931 1.00 0.00 C ATOM 396 CG PHE A 27 -14.029 0.439 2.703 1.00 0.00 C ATOM 397 CD1 PHE A 27 -14.681 1.300 3.585 1.00 0.00 C ATOM 398 CD2 PHE A 27 -14.749 0.027 1.583 1.00 0.00 C ATOM 399 CE1 PHE A 27 -15.994 1.703 3.380 1.00 0.00 C ATOM 400 CE2 PHE A 27 -16.060 0.432 1.358 1.00 0.00 C ATOM 401 CZ PHE A 27 -16.689 1.268 2.264 1.00 0.00 C ATOM 0 H PHE A 27 -12.304 -2.607 3.145 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.248 -0.414 4.510 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -11.952 0.878 2.907 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -12.291 -0.631 2.082 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.150 1.664 4.452 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -14.274 -0.627 0.867 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -16.474 2.357 4.093 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.587 0.095 0.478 1.00 0.00 H new ATOM 0 HZ PHE A 27 -17.711 1.578 2.102 1.00 0.00 H new ATOM 411 N THR A 28 -14.350 -1.325 5.185 1.00 0.00 N ATOM 412 CA THR A 28 -15.510 -1.239 6.058 1.00 0.00 C ATOM 413 C THR A 28 -15.202 -1.715 7.468 1.00 0.00 C ATOM 414 O THR A 28 -15.781 -1.263 8.449 1.00 0.00 O ATOM 415 CB THR A 28 -16.684 -1.996 5.359 1.00 0.00 C ATOM 416 OG1 THR A 28 -16.622 -2.146 3.902 1.00 0.00 O ATOM 417 CG2 THR A 28 -18.055 -1.481 5.869 1.00 0.00 C ATOM 0 H THR A 28 -14.446 -2.018 4.443 1.00 0.00 H new ATOM 0 HA THR A 28 -15.811 -0.202 6.203 1.00 0.00 H new ATOM 0 HB THR A 28 -16.553 -3.031 5.674 1.00 0.00 H new ATOM 0 HG1 THR A 28 -17.411 -2.636 3.590 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.857 -2.023 5.368 1.00 0.00 H new ATOM 0 HG22 THR A 28 -18.126 -1.641 6.945 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.147 -0.416 5.653 1.00 0.00 H new ATOM 425 N ASN A 29 -14.257 -2.637 7.485 1.00 0.00 N ATOM 426 CA ASN A 29 -13.775 -3.284 8.672 1.00 0.00 C ATOM 427 C ASN A 29 -12.627 -2.452 9.248 1.00 0.00 C ATOM 428 O ASN A 29 -11.943 -2.913 10.154 1.00 0.00 O ATOM 429 CB ASN A 29 -13.370 -4.747 8.412 1.00 0.00 C ATOM 430 CG ASN A 29 -14.587 -5.582 7.977 1.00 0.00 C ATOM 431 OD1 ASN A 29 -15.619 -5.600 8.636 1.00 0.00 O ATOM 432 ND2 ASN A 29 -14.400 -6.268 6.837 1.00 0.00 N ATOM 0 H ASN A 29 -13.793 -2.961 6.637 1.00 0.00 H new ATOM 0 HA ASN A 29 -14.578 -3.337 9.407 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -12.602 -4.785 7.639 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -12.934 -5.174 9.315 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -15.148 -6.854 6.466 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -13.510 -6.203 6.343 1.00 0.00 H new ATOM 439 N ALA A 30 -12.443 -1.219 8.714 1.00 0.00 N ATOM 440 CA ALA A 30 -11.409 -0.353 9.188 1.00 0.00 C ATOM 441 C ALA A 30 -12.013 1.040 9.380 1.00 0.00 C ATOM 442 O ALA A 30 -11.363 1.914 9.940 1.00 0.00 O ATOM 443 CB ALA A 30 -10.268 -0.340 8.166 1.00 0.00 C ATOM 0 H ALA A 30 -13.010 -0.831 7.960 1.00 0.00 H new ATOM 0 HA ALA A 30 -11.002 -0.694 10.140 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.473 0.318 8.517 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -9.877 -1.350 8.045 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.642 0.022 7.208 1.00 0.00 H new ATOM 449 N GLY A 31 -13.272 1.216 8.909 1.00 0.00 N ATOM 450 CA GLY A 31 -13.930 2.514 8.962 1.00 0.00 C ATOM 451 C GLY A 31 -13.119 3.532 8.139 1.00 0.00 C ATOM 452 O GLY A 31 -13.083 4.719 8.441 1.00 0.00 O ATOM 0 H GLY A 31 -13.835 0.473 8.495 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -14.944 2.437 8.569 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -14.014 2.850 9.996 1.00 0.00 H new ATOM 456 N PHE A 32 -12.477 2.969 7.081 1.00 0.00 N ATOM 457 CA PHE A 32 -11.602 3.769 6.227 1.00 0.00 C ATOM 458 C PHE A 32 -12.382 4.152 4.960 1.00 0.00 C ATOM 459 O PHE A 32 -13.574 3.909 4.828 1.00 0.00 O ATOM 460 CB PHE A 32 -10.306 2.966 5.953 1.00 0.00 C ATOM 461 CG PHE A 32 -9.269 3.009 7.057 1.00 0.00 C ATOM 462 CD1 PHE A 32 -9.497 3.579 8.312 1.00 0.00 C ATOM 463 CD2 PHE A 32 -8.007 2.487 6.797 1.00 0.00 C ATOM 464 CE1 PHE A 32 -8.489 3.638 9.263 1.00 0.00 C ATOM 465 CE2 PHE A 32 -6.996 2.549 7.740 1.00 0.00 C ATOM 466 CZ PHE A 32 -7.235 3.126 8.974 1.00 0.00 C ATOM 0 H PHE A 32 -12.555 1.987 6.815 1.00 0.00 H new ATOM 0 HA PHE A 32 -11.294 4.700 6.703 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.575 1.926 5.771 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -9.852 3.343 5.036 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -10.472 3.980 8.545 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -7.812 2.024 5.841 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.682 4.083 10.228 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.020 2.147 7.512 1.00 0.00 H new ATOM 0 HZ PHE A 32 -6.446 3.177 9.710 1.00 0.00 H new ATOM 476 N ASN A 33 -11.609 4.812 4.059 1.00 0.00 N ATOM 477 CA ASN A 33 -12.099 5.315 2.784 1.00 0.00 C ATOM 478 C ASN A 33 -11.489 4.424 1.692 1.00 0.00 C ATOM 479 O ASN A 33 -10.426 3.832 1.842 1.00 0.00 O ATOM 480 CB ASN A 33 -11.652 6.782 2.613 1.00 0.00 C ATOM 481 CG ASN A 33 -12.273 7.446 1.374 1.00 0.00 C ATOM 482 OD1 ASN A 33 -13.481 7.622 1.275 1.00 0.00 O ATOM 483 ND2 ASN A 33 -11.366 7.796 0.442 1.00 0.00 N ATOM 0 H ASN A 33 -10.619 5.003 4.215 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.187 5.288 2.727 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -11.929 7.349 3.502 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.565 6.821 2.536 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.670 8.243 -0.423 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.375 7.614 0.601 1.00 0.00 H new ATOM 490 N VAL A 34 -12.248 4.411 0.573 1.00 0.00 N ATOM 491 CA VAL A 34 -11.905 3.650 -0.620 1.00 0.00 C ATOM 492 C VAL A 34 -11.271 4.593 -1.641 1.00 0.00 C ATOM 493 O VAL A 34 -11.737 5.697 -1.894 1.00 0.00 O ATOM 494 CB VAL A 34 -13.204 3.055 -1.260 1.00 0.00 C ATOM 495 CG1 VAL A 34 -12.887 2.392 -2.641 1.00 0.00 C ATOM 496 CG2 VAL A 34 -14.447 2.588 -0.489 1.00 0.00 C ATOM 0 H VAL A 34 -13.118 4.936 0.486 1.00 0.00 H new ATOM 0 HA VAL A 34 -11.219 2.848 -0.348 1.00 0.00 H new ATOM 0 HB VAL A 34 -13.791 3.971 -1.334 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -13.804 1.985 -3.068 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -12.472 3.140 -3.317 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -12.164 1.589 -2.501 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -15.195 2.221 -1.192 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -14.170 1.788 0.197 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -14.860 3.424 0.076 1.00 0.00 H new ATOM 506 N VAL A 35 -10.174 4.049 -2.197 1.00 0.00 N ATOM 507 CA VAL A 35 -9.420 4.713 -3.242 1.00 0.00 C ATOM 508 C VAL A 35 -9.001 3.631 -4.251 1.00 0.00 C ATOM 509 O VAL A 35 -7.831 3.446 -4.565 1.00 0.00 O ATOM 510 CB VAL A 35 -8.225 5.532 -2.663 1.00 0.00 C ATOM 511 CG1 VAL A 35 -7.571 6.377 -3.784 1.00 0.00 C ATOM 512 CG2 VAL A 35 -7.908 5.891 -1.193 1.00 0.00 C ATOM 0 H VAL A 35 -9.797 3.140 -1.927 1.00 0.00 H new ATOM 0 HA VAL A 35 -10.028 5.460 -3.753 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.756 4.677 -2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.738 6.946 -3.372 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -7.206 5.717 -4.571 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -8.309 7.064 -4.199 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.990 6.477 -1.151 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.729 6.473 -0.775 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.781 4.976 -0.614 1.00 0.00 H new ATOM 522 N ASN A 36 -10.032 2.905 -4.736 1.00 0.00 N ATOM 523 CA ASN A 36 -9.717 1.874 -5.721 1.00 0.00 C ATOM 524 C ASN A 36 -9.399 2.625 -7.033 1.00 0.00 C ATOM 525 O ASN A 36 -10.186 3.435 -7.509 1.00 0.00 O ATOM 526 CB ASN A 36 -10.895 0.898 -5.898 1.00 0.00 C ATOM 527 CG ASN A 36 -10.554 -0.193 -6.930 1.00 0.00 C ATOM 528 OD1 ASN A 36 -9.680 -1.025 -6.720 1.00 0.00 O ATOM 529 ND2 ASN A 36 -11.288 -0.121 -8.055 1.00 0.00 N ATOM 0 H ASN A 36 -11.014 3.007 -4.481 1.00 0.00 H new ATOM 0 HA ASN A 36 -8.871 1.264 -5.405 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -11.137 0.436 -4.941 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -11.781 1.445 -6.221 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -11.133 -0.791 -8.809 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -11.999 0.603 -8.154 1.00 0.00 H new ATOM 536 N ILE A 37 -8.202 2.294 -7.576 1.00 0.00 N ATOM 537 CA ILE A 37 -7.735 2.888 -8.825 1.00 0.00 C ATOM 538 C ILE A 37 -8.271 1.943 -9.906 1.00 0.00 C ATOM 539 O ILE A 37 -9.116 2.309 -10.714 1.00 0.00 O ATOM 540 CB ILE A 37 -6.167 3.031 -8.855 1.00 0.00 C ATOM 541 CG1 ILE A 37 -5.510 3.560 -7.567 1.00 0.00 C ATOM 542 CG2 ILE A 37 -5.666 3.256 -10.325 1.00 0.00 C ATOM 543 CD1 ILE A 37 -4.018 3.940 -7.719 1.00 0.00 C ATOM 0 H ILE A 37 -7.556 1.622 -7.162 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.092 3.908 -8.969 1.00 0.00 H new ATOM 0 HB ILE A 37 -5.594 2.122 -8.669 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -6.062 4.436 -7.225 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -5.602 2.802 -6.789 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -4.580 3.353 -10.329 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -5.956 2.406 -10.942 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.113 4.166 -10.726 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.636 4.302 -6.765 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.449 3.063 -8.028 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -3.917 4.722 -8.471 1.00 0.00 H new ATOM 555 N GLY A 38 -7.722 0.711 -9.859 1.00 0.00 N ATOM 556 CA GLY A 38 -8.120 -0.309 -10.816 1.00 0.00 C ATOM 557 C GLY A 38 -7.080 -1.429 -10.826 1.00 0.00 C ATOM 558 O GLY A 38 -6.866 -2.114 -9.835 1.00 0.00 O ATOM 0 H GLY A 38 -7.020 0.415 -9.181 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.099 -0.709 -10.552 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.212 0.126 -11.811 1.00 0.00 H new ATOM 562 N VAL A 39 -6.452 -1.565 -12.014 1.00 0.00 N ATOM 563 CA VAL A 39 -5.425 -2.581 -12.215 1.00 0.00 C ATOM 564 C VAL A 39 -4.136 -1.929 -12.748 1.00 0.00 C ATOM 565 O VAL A 39 -3.300 -2.580 -13.364 1.00 0.00 O ATOM 566 CB VAL A 39 -5.983 -3.688 -13.172 1.00 0.00 C ATOM 567 CG1 VAL A 39 -7.078 -4.494 -12.400 1.00 0.00 C ATOM 568 CG2 VAL A 39 -5.954 -3.596 -14.718 1.00 0.00 C ATOM 0 H VAL A 39 -6.643 -0.986 -12.832 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.167 -3.058 -11.269 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.147 -4.332 -13.446 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.482 -5.272 -13.048 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.636 -4.952 -11.515 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -7.880 -3.821 -12.098 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.403 -4.493 -15.144 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.517 -2.720 -15.041 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.922 -3.510 -15.058 1.00 0.00 H new ATOM 578 N LEU A 40 -4.028 -0.613 -12.459 1.00 0.00 N ATOM 579 CA LEU A 40 -2.887 0.178 -12.887 1.00 0.00 C ATOM 580 C LEU A 40 -1.953 0.264 -11.679 1.00 0.00 C ATOM 581 O LEU A 40 -2.297 -0.077 -10.553 1.00 0.00 O ATOM 582 CB LEU A 40 -3.362 1.571 -13.342 1.00 0.00 C ATOM 583 CG LEU A 40 -4.282 1.526 -14.603 1.00 0.00 C ATOM 584 CD1 LEU A 40 -4.847 2.954 -14.863 1.00 0.00 C ATOM 585 CD2 LEU A 40 -4.192 0.444 -15.706 1.00 0.00 C ATOM 0 H LEU A 40 -4.726 -0.090 -11.930 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.368 -0.269 -13.735 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.901 2.049 -12.524 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.492 2.192 -13.557 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.091 0.825 -14.398 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.492 2.936 -15.742 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -5.423 3.281 -13.997 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.022 3.646 -15.032 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.943 0.641 -16.471 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.200 0.466 -16.157 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.370 -0.538 -15.268 1.00 0.00 H new ATOM 597 N SER A 41 -0.742 0.749 -12.027 1.00 0.00 N ATOM 598 CA SER A 41 0.344 0.946 -11.082 1.00 0.00 C ATOM 599 C SER A 41 0.704 2.429 -11.228 1.00 0.00 C ATOM 600 O SER A 41 1.782 2.795 -11.681 1.00 0.00 O ATOM 601 CB SER A 41 1.522 -0.011 -11.451 1.00 0.00 C ATOM 602 OG SER A 41 2.879 0.194 -10.885 1.00 0.00 O ATOM 0 H SER A 41 -0.503 1.013 -12.983 1.00 0.00 H new ATOM 0 HA SER A 41 0.089 0.715 -10.048 1.00 0.00 H new ATOM 0 HB2 SER A 41 1.211 -1.020 -11.179 1.00 0.00 H new ATOM 0 HB3 SER A 41 1.622 0.009 -12.536 1.00 0.00 H new ATOM 0 HG SER A 41 3.102 1.148 -10.906 1.00 0.00 H new ATOM 608 N SER A 42 -0.290 3.249 -10.805 1.00 0.00 N ATOM 609 CA SER A 42 -0.185 4.702 -10.839 1.00 0.00 C ATOM 610 C SER A 42 0.693 5.067 -9.635 1.00 0.00 C ATOM 611 O SER A 42 0.246 5.087 -8.494 1.00 0.00 O ATOM 612 CB SER A 42 -1.583 5.338 -10.718 1.00 0.00 C ATOM 613 OG SER A 42 -2.238 5.007 -12.028 1.00 0.00 O ATOM 0 H SER A 42 -1.177 2.909 -10.435 1.00 0.00 H new ATOM 0 HA SER A 42 0.244 5.067 -11.772 1.00 0.00 H new ATOM 0 HB2 SER A 42 -2.139 4.925 -9.876 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.521 6.415 -10.562 1.00 0.00 H new ATOM 0 HG SER A 42 -3.146 5.375 -12.042 1.00 0.00 H new ATOM 619 N GLN A 43 1.962 5.371 -9.979 1.00 0.00 N ATOM 620 CA GLN A 43 2.940 5.710 -8.966 1.00 0.00 C ATOM 621 C GLN A 43 2.848 7.215 -8.729 1.00 0.00 C ATOM 622 O GLN A 43 2.137 7.660 -7.842 1.00 0.00 O ATOM 623 CB GLN A 43 4.332 5.219 -9.401 1.00 0.00 C ATOM 624 CG GLN A 43 5.475 5.581 -8.428 1.00 0.00 C ATOM 625 CD GLN A 43 5.214 5.115 -6.987 1.00 0.00 C ATOM 626 OE1 GLN A 43 5.345 5.873 -6.034 1.00 0.00 O ATOM 627 NE2 GLN A 43 4.839 3.828 -6.896 1.00 0.00 N ATOM 0 H GLN A 43 2.313 5.384 -10.937 1.00 0.00 H new ATOM 0 HA GLN A 43 2.746 5.213 -8.016 1.00 0.00 H new ATOM 0 HB2 GLN A 43 4.301 4.136 -9.517 1.00 0.00 H new ATOM 0 HB3 GLN A 43 4.561 5.638 -10.381 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.403 5.134 -8.785 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.619 6.661 -8.433 1.00 0.00 H new ATOM 0 HE21 GLN A 43 4.753 3.261 -7.740 1.00 0.00 H new ATOM 0 HE22 GLN A 43 4.641 3.418 -5.983 1.00 0.00 H new ATOM 636 N GLU A 44 3.590 7.964 -9.576 1.00 0.00 N ATOM 637 CA GLU A 44 3.686 9.412 -9.485 1.00 0.00 C ATOM 638 C GLU A 44 2.338 10.074 -9.818 1.00 0.00 C ATOM 639 O GLU A 44 2.176 11.267 -9.595 1.00 0.00 O ATOM 640 CB GLU A 44 4.801 9.926 -10.418 1.00 0.00 C ATOM 641 CG GLU A 44 4.542 9.633 -11.907 1.00 0.00 C ATOM 642 CD GLU A 44 5.688 10.180 -12.775 1.00 0.00 C ATOM 643 OE1 GLU A 44 5.608 11.332 -13.201 1.00 0.00 O ATOM 644 OE2 GLU A 44 6.647 9.447 -13.018 1.00 0.00 O ATOM 0 H GLU A 44 4.136 7.565 -10.340 1.00 0.00 H new ATOM 0 HA GLU A 44 3.940 9.681 -8.460 1.00 0.00 H new ATOM 0 HB2 GLU A 44 4.910 11.002 -10.282 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.747 9.470 -10.126 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.444 8.558 -12.060 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.599 10.086 -12.213 1.00 0.00 H new ATOM 651 N ASP A 45 1.386 9.279 -10.354 1.00 0.00 N ATOM 652 CA ASP A 45 0.100 9.845 -10.717 1.00 0.00 C ATOM 653 C ASP A 45 -0.799 9.748 -9.498 1.00 0.00 C ATOM 654 O ASP A 45 -1.464 10.721 -9.164 1.00 0.00 O ATOM 655 CB ASP A 45 -0.483 9.124 -11.950 1.00 0.00 C ATOM 656 CG ASP A 45 0.467 9.262 -13.154 1.00 0.00 C ATOM 657 OD1 ASP A 45 0.417 10.289 -13.831 1.00 0.00 O ATOM 658 OD2 ASP A 45 1.248 8.342 -13.401 1.00 0.00 O ATOM 0 H ASP A 45 1.491 8.281 -10.534 1.00 0.00 H new ATOM 0 HA ASP A 45 0.195 10.892 -11.006 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -0.640 8.070 -11.722 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -1.457 9.545 -12.198 1.00 0.00 H new ATOM 663 N PHE A 46 -0.796 8.563 -8.838 1.00 0.00 N ATOM 664 CA PHE A 46 -1.655 8.457 -7.669 1.00 0.00 C ATOM 665 C PHE A 46 -0.878 8.947 -6.443 1.00 0.00 C ATOM 666 O PHE A 46 -1.405 8.889 -5.341 1.00 0.00 O ATOM 667 CB PHE A 46 -2.314 7.073 -7.501 1.00 0.00 C ATOM 668 CG PHE A 46 -3.811 7.233 -7.409 1.00 0.00 C ATOM 669 CD1 PHE A 46 -4.412 7.550 -6.196 1.00 0.00 C ATOM 670 CD2 PHE A 46 -4.606 7.110 -8.545 1.00 0.00 C ATOM 671 CE1 PHE A 46 -5.780 7.765 -6.127 1.00 0.00 C ATOM 672 CE2 PHE A 46 -5.978 7.306 -8.474 1.00 0.00 C ATOM 673 CZ PHE A 46 -6.567 7.637 -7.263 1.00 0.00 C ATOM 0 H PHE A 46 -0.250 7.737 -9.081 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.519 9.108 -7.805 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.058 6.432 -8.345 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.934 6.585 -6.603 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.810 7.629 -5.303 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -4.150 6.859 -9.492 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -6.235 8.033 -5.185 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.586 7.201 -9.360 1.00 0.00 H new ATOM 0 HZ PHE A 46 -7.634 7.795 -7.204 1.00 0.00 H new ATOM 683 N ILE A 47 0.375 9.431 -6.660 1.00 0.00 N ATOM 684 CA ILE A 47 1.141 9.994 -5.555 1.00 0.00 C ATOM 685 C ILE A 47 0.635 11.445 -5.467 1.00 0.00 C ATOM 686 O ILE A 47 0.611 12.041 -4.397 1.00 0.00 O ATOM 687 CB ILE A 47 2.699 9.853 -5.707 1.00 0.00 C ATOM 688 CG1 ILE A 47 3.371 8.821 -4.767 1.00 0.00 C ATOM 689 CG2 ILE A 47 3.336 11.125 -6.354 1.00 0.00 C ATOM 690 CD1 ILE A 47 2.769 7.397 -4.721 1.00 0.00 C ATOM 0 H ILE A 47 0.848 9.437 -7.564 1.00 0.00 H new ATOM 0 HA ILE A 47 0.981 9.449 -4.624 1.00 0.00 H new ATOM 0 HB ILE A 47 3.104 9.211 -6.489 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.418 8.734 -5.057 1.00 0.00 H new ATOM 0 HG13 ILE A 47 3.353 9.226 -3.755 1.00 0.00 H new ATOM 0 HG21 ILE A 47 4.414 10.988 -6.442 1.00 0.00 H new ATOM 0 HG22 ILE A 47 2.909 11.282 -7.344 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.131 11.993 -5.728 1.00 0.00 H new ATOM 0 HD11 ILE A 47 3.339 6.784 -4.023 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.731 7.451 -4.393 1.00 0.00 H new ATOM 0 HD13 ILE A 47 2.812 6.951 -5.715 1.00 0.00 H new ATOM 702 N ASN A 48 0.206 11.961 -6.659 1.00 0.00 N ATOM 703 CA ASN A 48 -0.335 13.305 -6.719 1.00 0.00 C ATOM 704 C ASN A 48 -1.734 13.242 -6.066 1.00 0.00 C ATOM 705 O ASN A 48 -2.201 14.229 -5.510 1.00 0.00 O ATOM 706 CB ASN A 48 -0.381 13.792 -8.180 1.00 0.00 C ATOM 707 CG ASN A 48 -0.846 15.253 -8.274 1.00 0.00 C ATOM 708 OD1 ASN A 48 -1.967 15.548 -8.671 1.00 0.00 O ATOM 709 ND2 ASN A 48 0.089 16.139 -7.883 1.00 0.00 N ATOM 0 H ASN A 48 0.233 11.465 -7.550 1.00 0.00 H new ATOM 0 HA ASN A 48 0.286 14.024 -6.184 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.608 13.695 -8.628 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -1.055 13.157 -8.755 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -0.114 17.138 -7.905 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.001 15.811 -7.565 1.00 0.00 H new ATOM 716 N ALA A 49 -2.370 12.040 -6.146 1.00 0.00 N ATOM 717 CA ALA A 49 -3.682 11.882 -5.543 1.00 0.00 C ATOM 718 C ALA A 49 -3.493 11.276 -4.135 1.00 0.00 C ATOM 719 O ALA A 49 -4.472 10.979 -3.465 1.00 0.00 O ATOM 720 CB ALA A 49 -4.583 11.028 -6.437 1.00 0.00 C ATOM 0 H ALA A 49 -1.997 11.210 -6.607 1.00 0.00 H new ATOM 0 HA ALA A 49 -4.182 12.845 -5.442 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.562 10.920 -5.970 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.695 11.511 -7.408 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -4.134 10.044 -6.571 1.00 0.00 H new ATOM 726 N ALA A 50 -2.215 11.075 -3.722 1.00 0.00 N ATOM 727 CA ALA A 50 -1.915 10.557 -2.391 1.00 0.00 C ATOM 728 C ALA A 50 -1.765 11.751 -1.457 1.00 0.00 C ATOM 729 O ALA A 50 -1.651 11.575 -0.255 1.00 0.00 O ATOM 730 CB ALA A 50 -0.691 9.641 -2.363 1.00 0.00 C ATOM 0 H ALA A 50 -1.394 11.266 -4.296 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.734 9.919 -2.059 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.522 9.290 -1.345 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.861 8.786 -3.018 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.184 10.193 -2.706 1.00 0.00 H new ATOM 736 N ILE A 51 -1.740 12.960 -2.051 1.00 0.00 N ATOM 737 CA ILE A 51 -1.687 14.179 -1.263 1.00 0.00 C ATOM 738 C ILE A 51 -3.171 14.546 -1.064 1.00 0.00 C ATOM 739 O ILE A 51 -3.592 15.015 -0.014 1.00 0.00 O ATOM 740 CB ILE A 51 -0.930 15.307 -2.033 1.00 0.00 C ATOM 741 CG1 ILE A 51 0.083 14.856 -3.105 1.00 0.00 C ATOM 742 CG2 ILE A 51 -0.918 16.599 -1.154 1.00 0.00 C ATOM 743 CD1 ILE A 51 0.905 15.976 -3.774 1.00 0.00 C ATOM 0 H ILE A 51 -1.756 13.105 -3.061 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.153 14.053 -0.321 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.371 15.768 -2.917 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.775 14.149 -2.648 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -0.457 14.316 -3.882 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.391 17.394 -1.682 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.943 16.913 -0.954 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.412 16.393 -0.211 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.582 15.541 -4.509 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.232 16.675 -4.270 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.483 16.505 -3.016 1.00 0.00 H new ATOM 755 N GLU A 52 -3.918 14.268 -2.159 1.00 0.00 N ATOM 756 CA GLU A 52 -5.338 14.513 -2.284 1.00 0.00 C ATOM 757 C GLU A 52 -6.113 13.690 -1.240 1.00 0.00 C ATOM 758 O GLU A 52 -6.686 14.262 -0.320 1.00 0.00 O ATOM 759 CB GLU A 52 -5.803 14.182 -3.714 1.00 0.00 C ATOM 760 CG GLU A 52 -7.276 14.527 -3.977 1.00 0.00 C ATOM 761 CD GLU A 52 -7.665 14.147 -5.416 1.00 0.00 C ATOM 762 OE1 GLU A 52 -7.890 12.964 -5.672 1.00 0.00 O ATOM 763 OE2 GLU A 52 -7.738 15.036 -6.265 1.00 0.00 O ATOM 0 H GLU A 52 -3.515 13.852 -2.999 1.00 0.00 H new ATOM 0 HA GLU A 52 -5.540 15.567 -2.096 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.179 14.724 -4.425 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.649 13.119 -3.900 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.913 13.997 -3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.441 15.593 -3.818 1.00 0.00 H new ATOM 770 N THR A 53 -6.128 12.338 -1.419 1.00 0.00 N ATOM 771 CA THR A 53 -6.905 11.496 -0.529 1.00 0.00 C ATOM 772 C THR A 53 -6.156 11.308 0.783 1.00 0.00 C ATOM 773 O THR A 53 -6.776 11.188 1.833 1.00 0.00 O ATOM 774 CB THR A 53 -7.469 10.194 -1.182 1.00 0.00 C ATOM 775 OG1 THR A 53 -6.572 9.054 -1.344 1.00 0.00 O ATOM 776 CG2 THR A 53 -8.346 10.543 -2.427 1.00 0.00 C ATOM 0 H THR A 53 -5.621 11.843 -2.153 1.00 0.00 H new ATOM 0 HA THR A 53 -7.831 12.020 -0.293 1.00 0.00 H new ATOM 0 HB THR A 53 -8.116 9.763 -0.418 1.00 0.00 H new ATOM 0 HG1 THR A 53 -6.503 8.825 -2.294 1.00 0.00 H new ATOM 0 HG21 THR A 53 -8.731 9.624 -2.870 1.00 0.00 H new ATOM 0 HG22 THR A 53 -9.179 11.175 -2.119 1.00 0.00 H new ATOM 0 HG23 THR A 53 -7.740 11.074 -3.161 1.00 0.00 H new ATOM 784 N LYS A 54 -4.812 11.297 0.671 1.00 0.00 N ATOM 785 CA LYS A 54 -3.936 11.152 1.831 1.00 0.00 C ATOM 786 C LYS A 54 -3.881 9.658 2.150 1.00 0.00 C ATOM 787 O LYS A 54 -4.255 9.222 3.232 1.00 0.00 O ATOM 788 CB LYS A 54 -4.361 12.033 3.032 1.00 0.00 C ATOM 789 CG LYS A 54 -3.220 12.355 4.012 1.00 0.00 C ATOM 790 CD LYS A 54 -2.124 13.275 3.442 1.00 0.00 C ATOM 791 CE LYS A 54 -2.613 14.693 3.129 1.00 0.00 C ATOM 792 NZ LYS A 54 -1.578 15.512 2.509 1.00 0.00 N ATOM 0 H LYS A 54 -4.318 11.388 -0.217 1.00 0.00 H new ATOM 0 HA LYS A 54 -2.936 11.521 1.604 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -4.775 12.968 2.654 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -5.159 11.527 3.575 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.643 12.824 4.900 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -2.760 11.420 4.333 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -1.302 13.333 4.156 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -1.724 12.829 2.532 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -3.476 14.639 2.466 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -2.948 15.171 4.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.956 16.462 2.316 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -0.764 15.587 3.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -1.275 15.072 1.617 1.00 0.00 H new ATOM 805 N ALA A 55 -3.372 8.915 1.135 1.00 0.00 N ATOM 806 CA ALA A 55 -3.228 7.465 1.166 1.00 0.00 C ATOM 807 C ALA A 55 -2.499 7.091 2.469 1.00 0.00 C ATOM 808 O ALA A 55 -1.365 7.490 2.704 1.00 0.00 O ATOM 809 CB ALA A 55 -2.456 6.991 -0.074 1.00 0.00 C ATOM 0 H ALA A 55 -3.048 9.330 0.261 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.201 6.974 1.146 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.352 5.906 -0.045 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -3.000 7.279 -0.973 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.468 7.450 -0.085 1.00 0.00 H new ATOM 815 N ASP A 56 -3.232 6.306 3.295 1.00 0.00 N ATOM 816 CA ASP A 56 -2.731 5.866 4.586 1.00 0.00 C ATOM 817 C ASP A 56 -1.874 4.637 4.304 1.00 0.00 C ATOM 818 O ASP A 56 -0.741 4.538 4.761 1.00 0.00 O ATOM 819 CB ASP A 56 -3.901 5.539 5.541 1.00 0.00 C ATOM 820 CG ASP A 56 -3.455 5.179 6.979 1.00 0.00 C ATOM 821 OD1 ASP A 56 -2.379 5.598 7.404 1.00 0.00 O ATOM 822 OD2 ASP A 56 -4.193 4.470 7.661 1.00 0.00 O ATOM 0 H ASP A 56 -4.171 5.973 3.075 1.00 0.00 H new ATOM 0 HA ASP A 56 -2.145 6.641 5.080 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.573 6.396 5.583 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.472 4.707 5.129 1.00 0.00 H new ATOM 827 N LEU A 57 -2.487 3.719 3.520 1.00 0.00 N ATOM 828 CA LEU A 57 -1.779 2.500 3.179 1.00 0.00 C ATOM 829 C LEU A 57 -2.151 2.163 1.740 1.00 0.00 C ATOM 830 O LEU A 57 -3.143 2.625 1.188 1.00 0.00 O ATOM 831 CB LEU A 57 -2.109 1.369 4.171 1.00 0.00 C ATOM 832 CG LEU A 57 -3.626 1.011 4.204 1.00 0.00 C ATOM 833 CD1 LEU A 57 -3.905 -0.207 3.277 1.00 0.00 C ATOM 834 CD2 LEU A 57 -4.551 1.488 5.350 1.00 0.00 C ATOM 0 H LEU A 57 -3.428 3.806 3.135 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.699 2.631 3.253 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.537 0.480 3.903 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.789 1.665 5.170 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.260 1.803 3.806 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.967 -0.450 3.306 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.617 0.040 2.255 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.327 -1.065 3.620 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.564 1.127 5.174 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.186 1.096 6.299 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.555 2.577 5.385 1.00 0.00 H new ATOM 846 N ILE A 58 -1.258 1.306 1.193 1.00 0.00 N ATOM 847 CA ILE A 58 -1.362 0.831 -0.179 1.00 0.00 C ATOM 848 C ILE A 58 -1.478 -0.699 -0.071 1.00 0.00 C ATOM 849 O ILE A 58 -0.780 -1.338 0.708 1.00 0.00 O ATOM 850 CB ILE A 58 -0.117 1.356 -0.979 1.00 0.00 C ATOM 851 CG1 ILE A 58 0.983 0.351 -1.423 1.00 0.00 C ATOM 852 CG2 ILE A 58 -0.011 2.905 -0.769 1.00 0.00 C ATOM 853 CD1 ILE A 58 0.681 -0.712 -2.512 1.00 0.00 C ATOM 0 H ILE A 58 -0.454 0.934 1.699 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.227 1.197 -0.731 1.00 0.00 H new ATOM 0 HB ILE A 58 -0.063 1.332 -2.067 1.00 0.00 H new ATOM 0 HG12 ILE A 58 1.833 0.937 -1.772 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.309 -0.185 -0.531 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.849 3.289 -1.318 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.919 3.385 -1.135 1.00 0.00 H new ATOM 0 HG23 ILE A 58 0.110 3.121 0.293 1.00 0.00 H new ATOM 0 HD11 ILE A 58 1.570 -1.319 -2.685 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -0.136 -1.352 -2.179 1.00 0.00 H new ATOM 0 HD13 ILE A 58 0.396 -0.213 -3.438 1.00 0.00 H new ATOM 865 N CYS A 59 -2.409 -1.234 -0.901 1.00 0.00 N ATOM 866 CA CYS A 59 -2.674 -2.667 -0.961 1.00 0.00 C ATOM 867 C CYS A 59 -2.575 -3.043 -2.446 1.00 0.00 C ATOM 868 O CYS A 59 -3.398 -2.659 -3.268 1.00 0.00 O ATOM 869 CB CYS A 59 -4.063 -3.002 -0.390 1.00 0.00 C ATOM 870 SG CYS A 59 -4.214 -2.666 1.379 1.00 0.00 S ATOM 0 H CYS A 59 -2.984 -0.679 -1.535 1.00 0.00 H new ATOM 0 HA CYS A 59 -1.962 -3.231 -0.359 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -4.817 -2.426 -0.927 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -4.278 -4.055 -0.572 1.00 0.00 H new ATOM 0 HG CYS A 59 -4.886 -3.623 1.947 1.00 0.00 H new ATOM 876 N VAL A 60 -1.517 -3.834 -2.727 1.00 0.00 N ATOM 877 CA VAL A 60 -1.249 -4.296 -4.084 1.00 0.00 C ATOM 878 C VAL A 60 -1.755 -5.733 -4.180 1.00 0.00 C ATOM 879 O VAL A 60 -1.654 -6.508 -3.237 1.00 0.00 O ATOM 880 CB VAL A 60 0.273 -4.140 -4.431 1.00 0.00 C ATOM 881 CG1 VAL A 60 0.852 -2.847 -5.111 1.00 0.00 C ATOM 882 CG2 VAL A 60 1.128 -5.361 -3.958 1.00 0.00 C ATOM 0 H VAL A 60 -0.846 -4.158 -2.030 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.771 -3.693 -4.826 1.00 0.00 H new ATOM 0 HB VAL A 60 0.769 -3.622 -5.252 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.926 -2.962 -5.256 1.00 0.00 H new ATOM 0 HG12 VAL A 60 0.370 -2.697 -6.077 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.662 -1.984 -4.473 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.172 -5.199 -4.224 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.042 -5.469 -2.877 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.767 -6.268 -4.443 1.00 0.00 H new ATOM 892 N SER A 61 -2.316 -6.022 -5.371 1.00 0.00 N ATOM 893 CA SER A 61 -2.832 -7.344 -5.646 1.00 0.00 C ATOM 894 C SER A 61 -1.942 -7.880 -6.743 1.00 0.00 C ATOM 895 O SER A 61 -2.396 -8.135 -7.843 1.00 0.00 O ATOM 896 CB SER A 61 -4.332 -7.330 -6.059 1.00 0.00 C ATOM 897 OG SER A 61 -4.799 -6.524 -7.213 1.00 0.00 O ATOM 0 H SER A 61 -2.415 -5.356 -6.137 1.00 0.00 H new ATOM 0 HA SER A 61 -2.812 -7.975 -4.757 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.619 -8.363 -6.254 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.900 -7.000 -5.189 1.00 0.00 H new ATOM 0 HG SER A 61 -4.356 -5.650 -7.202 1.00 0.00 H new ATOM 903 N SER A 62 -0.650 -8.033 -6.383 1.00 0.00 N ATOM 904 CA SER A 62 0.299 -8.550 -7.361 1.00 0.00 C ATOM 905 C SER A 62 1.576 -8.875 -6.592 1.00 0.00 C ATOM 906 O SER A 62 1.934 -8.237 -5.610 1.00 0.00 O ATOM 907 CB SER A 62 0.640 -7.547 -8.510 1.00 0.00 C ATOM 908 OG SER A 62 1.618 -6.456 -8.274 1.00 0.00 O ATOM 0 H SER A 62 -0.264 -7.815 -5.465 1.00 0.00 H new ATOM 0 HA SER A 62 -0.148 -9.417 -7.848 1.00 0.00 H new ATOM 0 HB2 SER A 62 1.004 -8.132 -9.354 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.295 -7.083 -8.824 1.00 0.00 H new ATOM 0 HG SER A 62 1.479 -6.080 -7.380 1.00 0.00 H new ATOM 914 N LEU A 63 2.235 -9.914 -7.141 1.00 0.00 N ATOM 915 CA LEU A 63 3.478 -10.449 -6.658 1.00 0.00 C ATOM 916 C LEU A 63 4.470 -10.173 -7.782 1.00 0.00 C ATOM 917 O LEU A 63 4.938 -11.054 -8.493 1.00 0.00 O ATOM 918 CB LEU A 63 3.353 -11.933 -6.266 1.00 0.00 C ATOM 919 CG LEU A 63 2.670 -12.826 -7.353 1.00 0.00 C ATOM 920 CD1 LEU A 63 3.620 -14.001 -7.733 1.00 0.00 C ATOM 921 CD2 LEU A 63 1.134 -12.840 -7.547 1.00 0.00 C ATOM 0 H LEU A 63 1.885 -10.407 -7.963 1.00 0.00 H new ATOM 0 HA LEU A 63 3.813 -9.984 -5.731 1.00 0.00 H new ATOM 0 HB2 LEU A 63 4.348 -12.328 -6.059 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.782 -12.006 -5.340 1.00 0.00 H new ATOM 0 HG LEU A 63 2.515 -12.278 -8.282 1.00 0.00 H new ATOM 0 HD11 LEU A 63 3.144 -14.623 -8.491 1.00 0.00 H new ATOM 0 HD12 LEU A 63 4.554 -13.601 -8.127 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.827 -14.602 -6.848 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.875 -13.527 -8.353 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.654 -13.165 -6.624 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.790 -11.837 -7.801 1.00 0.00 H new ATOM 933 N TYR A 64 4.734 -8.852 -7.863 1.00 0.00 N ATOM 934 CA TYR A 64 5.629 -8.239 -8.822 1.00 0.00 C ATOM 935 C TYR A 64 4.927 -8.296 -10.183 1.00 0.00 C ATOM 936 O TYR A 64 5.089 -9.202 -10.991 1.00 0.00 O ATOM 937 CB TYR A 64 7.064 -8.821 -8.813 1.00 0.00 C ATOM 938 CG TYR A 64 8.040 -7.808 -8.275 1.00 0.00 C ATOM 939 CD1 TYR A 64 8.308 -7.742 -6.914 1.00 0.00 C ATOM 940 CD2 TYR A 64 8.664 -6.909 -9.132 1.00 0.00 C ATOM 941 CE1 TYR A 64 9.186 -6.792 -6.407 1.00 0.00 C ATOM 942 CE2 TYR A 64 9.545 -5.955 -8.643 1.00 0.00 C ATOM 943 CZ TYR A 64 9.822 -5.890 -7.271 1.00 0.00 C ATOM 944 OH TYR A 64 10.696 -4.926 -6.775 1.00 0.00 O ATOM 0 H TYR A 64 4.306 -8.173 -7.233 1.00 0.00 H new ATOM 0 HA TYR A 64 5.815 -7.200 -8.549 1.00 0.00 H new ATOM 0 HB2 TYR A 64 7.093 -9.723 -8.202 1.00 0.00 H new ATOM 0 HB3 TYR A 64 7.352 -9.111 -9.824 1.00 0.00 H new ATOM 0 HD1 TYR A 64 7.828 -8.438 -6.241 1.00 0.00 H new ATOM 0 HD2 TYR A 64 8.461 -6.954 -10.192 1.00 0.00 H new ATOM 0 HE1 TYR A 64 9.379 -6.748 -5.345 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.018 -5.261 -9.322 1.00 0.00 H new ATOM 0 HH TYR A 64 10.427 -4.678 -5.866 1.00 0.00 H new ATOM 954 N GLY A 65 4.144 -7.217 -10.337 1.00 0.00 N ATOM 955 CA GLY A 65 3.349 -6.895 -11.511 1.00 0.00 C ATOM 956 C GLY A 65 3.088 -5.383 -11.463 1.00 0.00 C ATOM 957 O GLY A 65 2.053 -4.878 -11.878 1.00 0.00 O ATOM 0 H GLY A 65 4.050 -6.515 -9.603 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.878 -7.168 -12.424 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.411 -7.450 -11.508 1.00 0.00 H new ATOM 961 N GLN A 66 4.132 -4.723 -10.917 1.00 0.00 N ATOM 962 CA GLN A 66 4.172 -3.301 -10.651 1.00 0.00 C ATOM 963 C GLN A 66 5.605 -2.800 -10.894 1.00 0.00 C ATOM 964 O GLN A 66 5.835 -1.601 -10.983 1.00 0.00 O ATOM 965 CB GLN A 66 3.747 -3.144 -9.177 1.00 0.00 C ATOM 966 CG GLN A 66 4.651 -3.952 -8.208 1.00 0.00 C ATOM 967 CD GLN A 66 3.979 -4.250 -6.861 1.00 0.00 C ATOM 968 OE1 GLN A 66 2.773 -4.436 -6.767 1.00 0.00 O ATOM 969 NE2 GLN A 66 4.844 -4.301 -5.831 1.00 0.00 N ATOM 0 H GLN A 66 4.993 -5.199 -10.646 1.00 0.00 H new ATOM 0 HA GLN A 66 3.513 -2.719 -11.295 1.00 0.00 H new ATOM 0 HB2 GLN A 66 3.779 -2.089 -8.904 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.714 -3.472 -9.063 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.932 -4.892 -8.682 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.572 -3.396 -8.032 1.00 0.00 H new ATOM 0 HE21 GLN A 66 5.837 -4.134 -5.991 1.00 0.00 H new ATOM 0 HE22 GLN A 66 4.506 -4.507 -4.891 1.00 0.00 H new ATOM 978 N GLY A 67 6.545 -3.764 -10.981 1.00 0.00 N ATOM 979 CA GLY A 67 7.953 -3.468 -11.210 1.00 0.00 C ATOM 980 C GLY A 67 8.636 -2.885 -9.965 1.00 0.00 C ATOM 981 O GLY A 67 8.145 -2.967 -8.844 1.00 0.00 O ATOM 0 H GLY A 67 6.340 -4.759 -10.894 1.00 0.00 H new ATOM 0 HA2 GLY A 67 8.469 -4.379 -11.512 1.00 0.00 H new ATOM 0 HA3 GLY A 67 8.044 -2.762 -12.036 1.00 0.00 H new ATOM 985 N GLU A 68 9.803 -2.275 -10.272 1.00 0.00 N ATOM 986 CA GLU A 68 10.650 -1.633 -9.277 1.00 0.00 C ATOM 987 C GLU A 68 10.089 -0.217 -9.012 1.00 0.00 C ATOM 988 O GLU A 68 10.669 0.547 -8.249 1.00 0.00 O ATOM 989 CB GLU A 68 12.089 -1.521 -9.820 1.00 0.00 C ATOM 990 CG GLU A 68 12.838 -2.861 -9.844 1.00 0.00 C ATOM 991 CD GLU A 68 14.163 -2.728 -10.614 1.00 0.00 C ATOM 992 OE1 GLU A 68 15.141 -2.264 -10.027 1.00 0.00 O ATOM 993 OE2 GLU A 68 14.203 -3.088 -11.790 1.00 0.00 O ATOM 0 H GLU A 68 10.172 -2.221 -11.221 1.00 0.00 H new ATOM 0 HA GLU A 68 10.662 -2.216 -8.356 1.00 0.00 H new ATOM 0 HB2 GLU A 68 12.057 -1.113 -10.830 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.646 -0.813 -9.207 1.00 0.00 H new ATOM 0 HG2 GLU A 68 13.036 -3.191 -8.824 1.00 0.00 H new ATOM 0 HG3 GLU A 68 12.215 -3.624 -10.311 1.00 0.00 H new ATOM 1000 N ILE A 69 8.946 0.095 -9.668 1.00 0.00 N ATOM 1001 CA ILE A 69 8.300 1.387 -9.552 1.00 0.00 C ATOM 1002 C ILE A 69 7.653 1.439 -8.162 1.00 0.00 C ATOM 1003 O ILE A 69 8.000 2.276 -7.341 1.00 0.00 O ATOM 1004 CB ILE A 69 7.264 1.576 -10.712 1.00 0.00 C ATOM 1005 CG1 ILE A 69 7.534 0.850 -12.051 1.00 0.00 C ATOM 1006 CG2 ILE A 69 6.486 2.904 -10.482 1.00 0.00 C ATOM 1007 CD1 ILE A 69 8.793 1.420 -12.712 1.00 0.00 C ATOM 0 H ILE A 69 8.461 -0.554 -10.287 1.00 0.00 H new ATOM 0 HA ILE A 69 9.010 2.208 -9.647 1.00 0.00 H new ATOM 0 HB ILE A 69 6.408 0.904 -10.770 1.00 0.00 H new ATOM 0 HG12 ILE A 69 7.657 -0.219 -11.876 1.00 0.00 H new ATOM 0 HG13 ILE A 69 6.679 0.968 -12.717 1.00 0.00 H new ATOM 0 HG21 ILE A 69 5.762 3.045 -11.284 1.00 0.00 H new ATOM 0 HG22 ILE A 69 5.964 2.859 -9.526 1.00 0.00 H new ATOM 0 HG23 ILE A 69 7.186 3.739 -10.474 1.00 0.00 H new ATOM 0 HD11 ILE A 69 8.975 0.903 -13.654 1.00 0.00 H new ATOM 0 HD12 ILE A 69 8.654 2.484 -12.903 1.00 0.00 H new ATOM 0 HD13 ILE A 69 9.647 1.279 -12.050 1.00 0.00 H new ATOM 1019 N ASP A 70 6.707 0.495 -7.951 1.00 0.00 N ATOM 1020 CA ASP A 70 5.967 0.408 -6.697 1.00 0.00 C ATOM 1021 C ASP A 70 6.932 -0.020 -5.581 1.00 0.00 C ATOM 1022 O ASP A 70 6.693 0.270 -4.415 1.00 0.00 O ATOM 1023 CB ASP A 70 4.806 -0.592 -6.845 1.00 0.00 C ATOM 1024 CG ASP A 70 3.872 -0.644 -5.621 1.00 0.00 C ATOM 1025 OD1 ASP A 70 4.187 -1.351 -4.664 1.00 0.00 O ATOM 1026 OD2 ASP A 70 2.833 0.016 -5.644 1.00 0.00 O ATOM 0 H ASP A 70 6.447 -0.211 -8.640 1.00 0.00 H new ATOM 0 HA ASP A 70 5.541 1.378 -6.441 1.00 0.00 H new ATOM 0 HB2 ASP A 70 4.221 -0.328 -7.726 1.00 0.00 H new ATOM 0 HB3 ASP A 70 5.215 -1.587 -7.021 1.00 0.00 H new ATOM 1031 N CYS A 71 8.028 -0.706 -5.977 1.00 0.00 N ATOM 1032 CA CYS A 71 8.996 -1.176 -5.003 1.00 0.00 C ATOM 1033 C CYS A 71 9.602 0.053 -4.313 1.00 0.00 C ATOM 1034 O CYS A 71 9.292 0.338 -3.164 1.00 0.00 O ATOM 1035 CB CYS A 71 10.033 -2.076 -5.682 1.00 0.00 C ATOM 1036 SG CYS A 71 11.088 -2.966 -4.510 1.00 0.00 S ATOM 0 H CYS A 71 8.248 -0.935 -6.946 1.00 0.00 H new ATOM 0 HA CYS A 71 8.529 -1.795 -4.237 1.00 0.00 H new ATOM 0 HB2 CYS A 71 9.518 -2.797 -6.316 1.00 0.00 H new ATOM 0 HB3 CYS A 71 10.660 -1.468 -6.335 1.00 0.00 H new ATOM 0 HG CYS A 71 12.080 -2.204 -4.154 1.00 0.00 H new ATOM 1042 N LYS A 72 10.450 0.780 -5.077 1.00 0.00 N ATOM 1043 CA LYS A 72 11.114 1.960 -4.539 1.00 0.00 C ATOM 1044 C LYS A 72 10.242 3.196 -4.798 1.00 0.00 C ATOM 1045 O LYS A 72 10.741 4.296 -4.989 1.00 0.00 O ATOM 1046 CB LYS A 72 12.523 2.072 -5.149 1.00 0.00 C ATOM 1047 CG LYS A 72 13.447 0.929 -4.697 1.00 0.00 C ATOM 1048 CD LYS A 72 14.689 0.774 -5.586 1.00 0.00 C ATOM 1049 CE LYS A 72 14.384 0.088 -6.925 1.00 0.00 C ATOM 1050 NZ LYS A 72 13.928 -1.288 -6.766 1.00 0.00 N ATOM 0 H LYS A 72 10.679 0.565 -6.048 1.00 0.00 H new ATOM 0 HA LYS A 72 11.240 1.881 -3.459 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.447 2.067 -6.236 1.00 0.00 H new ATOM 0 HB3 LYS A 72 12.965 3.027 -4.865 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.763 1.109 -3.669 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.887 -0.006 -4.699 1.00 0.00 H new ATOM 0 HD2 LYS A 72 15.118 1.758 -5.777 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.443 0.196 -5.051 1.00 0.00 H new ATOM 0 HE2 LYS A 72 13.622 0.659 -7.455 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.280 0.099 -7.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.197 -1.842 -7.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 14.367 -1.704 -5.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 12.893 -1.301 -6.661 1.00 0.00 H new ATOM 1063 N GLY A 73 8.922 2.959 -4.768 1.00 0.00 N ATOM 1064 CA GLY A 73 7.939 4.008 -4.984 1.00 0.00 C ATOM 1065 C GLY A 73 7.461 4.564 -3.649 1.00 0.00 C ATOM 1066 O GLY A 73 7.402 5.768 -3.431 1.00 0.00 O ATOM 0 H GLY A 73 8.518 2.039 -4.594 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.375 4.807 -5.584 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.093 3.613 -5.546 1.00 0.00 H new ATOM 1070 N LEU A 74 7.136 3.584 -2.779 1.00 0.00 N ATOM 1071 CA LEU A 74 6.645 3.879 -1.449 1.00 0.00 C ATOM 1072 C LEU A 74 7.853 3.975 -0.512 1.00 0.00 C ATOM 1073 O LEU A 74 7.765 4.588 0.543 1.00 0.00 O ATOM 1074 CB LEU A 74 5.615 2.825 -1.026 1.00 0.00 C ATOM 1075 CG LEU A 74 4.438 2.736 -2.048 1.00 0.00 C ATOM 1076 CD1 LEU A 74 3.585 4.036 -2.004 1.00 0.00 C ATOM 1077 CD2 LEU A 74 4.309 1.700 -3.194 1.00 0.00 C ATOM 0 H LEU A 74 7.210 2.589 -2.989 1.00 0.00 H new ATOM 0 HA LEU A 74 6.120 4.833 -1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.101 1.853 -0.942 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.224 3.072 -0.039 1.00 0.00 H new ATOM 0 HG LEU A 74 3.929 1.801 -1.813 1.00 0.00 H new ATOM 0 HD11 LEU A 74 2.768 3.960 -2.722 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.177 4.169 -1.002 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.212 4.891 -2.257 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.386 1.880 -3.745 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.159 1.797 -3.870 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.292 0.694 -2.775 1.00 0.00 H new ATOM 1089 N ARG A 75 8.987 3.368 -0.939 1.00 0.00 N ATOM 1090 CA ARG A 75 10.195 3.444 -0.123 1.00 0.00 C ATOM 1091 C ARG A 75 10.736 4.876 -0.307 1.00 0.00 C ATOM 1092 O ARG A 75 11.322 5.453 0.600 1.00 0.00 O ATOM 1093 CB ARG A 75 11.237 2.398 -0.559 1.00 0.00 C ATOM 1094 CG ARG A 75 10.679 0.969 -0.634 1.00 0.00 C ATOM 1095 CD ARG A 75 10.736 0.168 0.676 1.00 0.00 C ATOM 1096 NE ARG A 75 9.782 -0.943 0.679 1.00 0.00 N ATOM 1097 CZ ARG A 75 9.695 -1.899 -0.282 1.00 0.00 C ATOM 1098 NH1 ARG A 75 10.532 -1.949 -1.312 1.00 0.00 N ATOM 1099 NH2 ARG A 75 8.748 -2.825 -0.198 1.00 0.00 N ATOM 0 H ARG A 75 9.079 2.844 -1.809 1.00 0.00 H new ATOM 0 HA ARG A 75 9.977 3.229 0.923 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.632 2.676 -1.536 1.00 0.00 H new ATOM 0 HB3 ARG A 75 12.073 2.417 0.140 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.641 1.019 -0.964 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.230 0.422 -1.399 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.745 -0.219 0.821 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.525 0.830 1.516 1.00 0.00 H new ATOM 0 HE ARG A 75 9.133 -1.004 1.463 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.273 -1.253 -1.401 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.434 -2.683 -2.014 1.00 0.00 H new ATOM 0 HH21 ARG A 75 8.093 -2.815 0.584 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.675 -3.547 -0.915 1.00 0.00 H new ATOM 1113 N GLU A 76 10.486 5.410 -1.532 1.00 0.00 N ATOM 1114 CA GLU A 76 10.902 6.755 -1.885 1.00 0.00 C ATOM 1115 C GLU A 76 9.908 7.746 -1.246 1.00 0.00 C ATOM 1116 O GLU A 76 10.261 8.893 -1.018 1.00 0.00 O ATOM 1117 CB GLU A 76 10.952 6.894 -3.416 1.00 0.00 C ATOM 1118 CG GLU A 76 11.342 8.299 -3.902 1.00 0.00 C ATOM 1119 CD GLU A 76 11.455 8.325 -5.436 1.00 0.00 C ATOM 1120 OE1 GLU A 76 10.438 8.530 -6.099 1.00 0.00 O ATOM 1121 OE2 GLU A 76 12.557 8.140 -5.951 1.00 0.00 O ATOM 0 H GLU A 76 9.997 4.914 -2.277 1.00 0.00 H new ATOM 0 HA GLU A 76 11.902 6.971 -1.509 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.665 6.172 -3.813 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.976 6.636 -3.826 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.597 9.024 -3.574 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.292 8.594 -3.456 1.00 0.00 H new ATOM 1128 N LYS A 77 8.671 7.263 -0.964 1.00 0.00 N ATOM 1129 CA LYS A 77 7.618 8.066 -0.365 1.00 0.00 C ATOM 1130 C LYS A 77 7.898 8.224 1.151 1.00 0.00 C ATOM 1131 O LYS A 77 7.314 9.068 1.818 1.00 0.00 O ATOM 1132 CB LYS A 77 6.276 7.351 -0.603 1.00 0.00 C ATOM 1133 CG LYS A 77 5.030 8.191 -0.320 1.00 0.00 C ATOM 1134 CD LYS A 77 3.757 7.348 -0.447 1.00 0.00 C ATOM 1135 CE LYS A 77 2.487 8.165 -0.220 1.00 0.00 C ATOM 1136 NZ LYS A 77 2.194 9.032 -1.351 1.00 0.00 N ATOM 0 H LYS A 77 8.393 6.300 -1.153 1.00 0.00 H new ATOM 0 HA LYS A 77 7.582 9.060 -0.812 1.00 0.00 H new ATOM 0 HB2 LYS A 77 6.240 7.016 -1.640 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.242 6.459 0.022 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.092 8.613 0.683 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.986 9.029 -1.016 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.722 6.897 -1.439 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.793 6.531 0.274 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.647 7.492 -0.051 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.599 8.768 0.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.555 9.795 -1.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 3.079 9.444 -1.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.738 8.478 -2.104 1.00 0.00 H new ATOM 1149 N CYS A 78 8.796 7.357 1.661 1.00 0.00 N ATOM 1150 CA CYS A 78 9.179 7.335 3.068 1.00 0.00 C ATOM 1151 C CYS A 78 10.360 8.260 3.224 1.00 0.00 C ATOM 1152 O CYS A 78 10.469 9.082 4.126 1.00 0.00 O ATOM 1153 CB CYS A 78 9.401 5.895 3.549 1.00 0.00 C ATOM 1154 SG CYS A 78 7.880 4.931 3.388 1.00 0.00 S ATOM 0 H CYS A 78 9.272 6.653 1.097 1.00 0.00 H new ATOM 0 HA CYS A 78 8.387 7.704 3.720 1.00 0.00 H new ATOM 0 HB2 CYS A 78 10.197 5.430 2.967 1.00 0.00 H new ATOM 0 HB3 CYS A 78 9.727 5.899 4.589 1.00 0.00 H new ATOM 0 HG CYS A 78 8.098 3.709 3.773 1.00 0.00 H new ATOM 1160 N ASP A 79 11.202 8.050 2.216 1.00 0.00 N ATOM 1161 CA ASP A 79 12.428 8.766 1.994 1.00 0.00 C ATOM 1162 C ASP A 79 12.090 10.162 1.441 1.00 0.00 C ATOM 1163 O ASP A 79 12.965 10.988 1.213 1.00 0.00 O ATOM 1164 CB ASP A 79 13.410 7.938 1.143 1.00 0.00 C ATOM 1165 CG ASP A 79 14.815 8.565 1.101 1.00 0.00 C ATOM 1166 OD1 ASP A 79 15.523 8.492 2.105 1.00 0.00 O ATOM 1167 OD2 ASP A 79 15.186 9.118 0.065 1.00 0.00 O ATOM 0 H ASP A 79 11.028 7.340 1.505 1.00 0.00 H new ATOM 0 HA ASP A 79 12.966 8.925 2.929 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.477 6.928 1.548 1.00 0.00 H new ATOM 0 HB3 ASP A 79 13.023 7.850 0.128 1.00 0.00 H new ATOM 1172 N GLU A 80 10.775 10.373 1.267 1.00 0.00 N ATOM 1173 CA GLU A 80 10.214 11.624 0.811 1.00 0.00 C ATOM 1174 C GLU A 80 10.175 12.494 2.060 1.00 0.00 C ATOM 1175 O GLU A 80 10.677 13.611 2.099 1.00 0.00 O ATOM 1176 CB GLU A 80 8.813 11.481 0.181 1.00 0.00 C ATOM 1177 CG GLU A 80 8.177 12.809 -0.261 1.00 0.00 C ATOM 1178 CD GLU A 80 9.009 13.502 -1.352 1.00 0.00 C ATOM 1179 OE1 GLU A 80 8.886 13.123 -2.517 1.00 0.00 O ATOM 1180 OE2 GLU A 80 9.770 14.413 -1.027 1.00 0.00 O ATOM 0 H GLU A 80 10.072 9.656 1.447 1.00 0.00 H new ATOM 0 HA GLU A 80 10.816 12.051 0.009 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.882 10.820 -0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 80 8.152 10.997 0.900 1.00 0.00 H new ATOM 0 HG2 GLU A 80 7.170 12.624 -0.634 1.00 0.00 H new ATOM 0 HG3 GLU A 80 8.082 13.471 0.600 1.00 0.00 H new ATOM 1187 N ALA A 81 9.527 11.867 3.068 1.00 0.00 N ATOM 1188 CA ALA A 81 9.333 12.449 4.390 1.00 0.00 C ATOM 1189 C ALA A 81 8.495 13.724 4.204 1.00 0.00 C ATOM 1190 O ALA A 81 8.815 14.795 4.705 1.00 0.00 O ATOM 1191 CB ALA A 81 10.674 12.700 5.104 1.00 0.00 C ATOM 0 H ALA A 81 9.125 10.934 2.973 1.00 0.00 H new ATOM 0 HA ALA A 81 8.800 11.760 5.045 1.00 0.00 H new ATOM 0 HB1 ALA A 81 10.488 13.134 6.086 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.207 11.756 5.220 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.278 13.387 4.512 1.00 0.00 H new ATOM 1197 N GLY A 82 7.408 13.513 3.437 1.00 0.00 N ATOM 1198 CA GLY A 82 6.457 14.564 3.109 1.00 0.00 C ATOM 1199 C GLY A 82 5.115 13.912 2.775 1.00 0.00 C ATOM 1200 O GLY A 82 4.060 14.310 3.255 1.00 0.00 O ATOM 0 H GLY A 82 7.175 12.606 3.033 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.347 15.251 3.948 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.816 15.149 2.262 1.00 0.00 H new ATOM 1204 N LEU A 83 5.250 12.873 1.922 1.00 0.00 N ATOM 1205 CA LEU A 83 4.115 12.081 1.489 1.00 0.00 C ATOM 1206 C LEU A 83 4.036 10.954 2.524 1.00 0.00 C ATOM 1207 O LEU A 83 4.996 10.231 2.757 1.00 0.00 O ATOM 1208 CB LEU A 83 4.367 11.539 0.077 1.00 0.00 C ATOM 1209 CG LEU A 83 4.344 12.633 -1.036 1.00 0.00 C ATOM 1210 CD1 LEU A 83 4.706 11.957 -2.392 1.00 0.00 C ATOM 1211 CD2 LEU A 83 3.545 13.954 -0.938 1.00 0.00 C ATOM 0 H LEU A 83 6.143 12.576 1.528 1.00 0.00 H new ATOM 0 HA LEU A 83 3.184 12.645 1.434 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.334 11.037 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.613 10.786 -0.152 1.00 0.00 H new ATOM 0 HG LEU A 83 5.077 13.398 -0.780 1.00 0.00 H new ATOM 0 HD11 LEU A 83 4.696 12.704 -3.185 1.00 0.00 H new ATOM 0 HD12 LEU A 83 5.699 11.514 -2.324 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.976 11.179 -2.617 1.00 0.00 H new ATOM 0 HD21 LEU A 83 3.698 14.540 -1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.484 13.730 -0.826 1.00 0.00 H new ATOM 0 HD23 LEU A 83 3.889 14.524 -0.075 1.00 0.00 H new ATOM 1223 N LYS A 84 2.833 10.863 3.130 1.00 0.00 N ATOM 1224 CA LYS A 84 2.585 9.869 4.161 1.00 0.00 C ATOM 1225 C LYS A 84 2.113 8.594 3.448 1.00 0.00 C ATOM 1226 O LYS A 84 1.157 8.594 2.682 1.00 0.00 O ATOM 1227 CB LYS A 84 1.577 10.425 5.186 1.00 0.00 C ATOM 1228 CG LYS A 84 0.149 10.645 4.647 1.00 0.00 C ATOM 1229 CD LYS A 84 -0.812 9.521 5.055 1.00 0.00 C ATOM 1230 CE LYS A 84 -1.296 9.689 6.498 1.00 0.00 C ATOM 1231 NZ LYS A 84 -2.043 8.534 6.962 1.00 0.00 N ATOM 0 H LYS A 84 2.036 11.464 2.917 1.00 0.00 H new ATOM 0 HA LYS A 84 3.479 9.627 4.736 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.528 9.740 6.032 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.955 11.374 5.566 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.233 11.597 5.016 1.00 0.00 H new ATOM 0 HG3 LYS A 84 0.181 10.715 3.560 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.669 9.512 4.382 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.313 8.558 4.948 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.438 9.852 7.151 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -1.923 10.578 6.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.409 8.718 7.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -2.838 8.352 6.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -1.418 7.703 6.985 1.00 0.00 H new ATOM 1244 N GLY A 85 2.862 7.515 3.755 1.00 0.00 N ATOM 1245 CA GLY A 85 2.577 6.206 3.182 1.00 0.00 C ATOM 1246 C GLY A 85 3.745 5.260 3.474 1.00 0.00 C ATOM 1247 O GLY A 85 4.453 4.806 2.583 1.00 0.00 O ATOM 0 H GLY A 85 3.659 7.535 4.391 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.655 5.805 3.603 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.425 6.293 2.106 1.00 0.00 H new ATOM 1251 N ILE A 86 3.878 5.009 4.796 1.00 0.00 N ATOM 1252 CA ILE A 86 4.918 4.147 5.340 1.00 0.00 C ATOM 1253 C ILE A 86 4.269 2.818 5.755 1.00 0.00 C ATOM 1254 O ILE A 86 4.899 2.010 6.425 1.00 0.00 O ATOM 1255 CB ILE A 86 5.625 4.827 6.557 1.00 0.00 C ATOM 1256 CG1 ILE A 86 7.071 4.361 6.868 1.00 0.00 C ATOM 1257 CG2 ILE A 86 4.586 5.595 7.436 1.00 0.00 C ATOM 1258 CD1 ILE A 86 7.761 5.005 8.090 1.00 0.00 C ATOM 0 H ILE A 86 3.260 5.405 5.505 1.00 0.00 H new ATOM 0 HA ILE A 86 5.683 3.966 4.585 1.00 0.00 H new ATOM 0 HB ILE A 86 6.282 5.695 6.612 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.056 3.281 7.016 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.687 4.554 5.989 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.096 6.062 8.278 1.00 0.00 H new ATOM 0 HG22 ILE A 86 4.099 6.363 6.836 1.00 0.00 H new ATOM 0 HG23 ILE A 86 3.837 4.896 7.808 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.765 4.595 8.199 1.00 0.00 H new ATOM 0 HD12 ILE A 86 7.823 6.084 7.946 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.183 4.792 8.989 1.00 0.00 H new ATOM 1270 N LYS A 87 2.999 2.620 5.335 1.00 0.00 N ATOM 1271 CA LYS A 87 2.276 1.398 5.646 1.00 0.00 C ATOM 1272 C LYS A 87 1.894 0.853 4.275 1.00 0.00 C ATOM 1273 O LYS A 87 1.121 1.460 3.551 1.00 0.00 O ATOM 1274 CB LYS A 87 1.019 1.689 6.478 1.00 0.00 C ATOM 1275 CG LYS A 87 1.267 2.512 7.753 1.00 0.00 C ATOM 1276 CD LYS A 87 2.149 1.791 8.780 1.00 0.00 C ATOM 1277 CE LYS A 87 2.275 2.548 10.105 1.00 0.00 C ATOM 1278 NZ LYS A 87 3.030 3.788 9.983 1.00 0.00 N ATOM 0 H LYS A 87 2.469 3.295 4.784 1.00 0.00 H new ATOM 0 HA LYS A 87 2.869 0.701 6.238 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.301 2.221 5.853 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.558 0.742 6.758 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.737 3.457 7.481 1.00 0.00 H new ATOM 0 HG3 LYS A 87 0.309 2.753 8.213 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.736 0.801 8.973 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.143 1.645 8.357 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.278 2.772 10.485 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.759 1.905 10.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.184 4.195 10.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 3.949 3.593 9.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 2.497 4.463 9.398 1.00 0.00 H new ATOM 1291 N LEU A 88 2.482 -0.313 3.953 1.00 0.00 N ATOM 1292 CA LEU A 88 2.208 -0.907 2.651 1.00 0.00 C ATOM 1293 C LEU A 88 2.084 -2.402 2.908 1.00 0.00 C ATOM 1294 O LEU A 88 3.075 -3.105 3.052 1.00 0.00 O ATOM 1295 CB LEU A 88 3.346 -0.577 1.660 1.00 0.00 C ATOM 1296 CG LEU A 88 3.799 0.912 1.717 1.00 0.00 C ATOM 1297 CD1 LEU A 88 2.716 1.865 1.123 1.00 0.00 C ATOM 1298 CD2 LEU A 88 5.129 1.323 2.419 1.00 0.00 C ATOM 0 H LEU A 88 3.121 -0.836 4.552 1.00 0.00 H new ATOM 0 HA LEU A 88 1.297 -0.517 2.196 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.201 -1.218 1.873 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.016 -0.811 0.648 1.00 0.00 H new ATOM 0 HG LEU A 88 4.706 1.473 1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 88 3.067 2.895 1.180 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.531 1.602 0.082 1.00 0.00 H new ATOM 0 HD13 LEU A 88 1.792 1.765 1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.260 2.403 2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.092 1.031 3.468 1.00 0.00 H new ATOM 0 HD23 LEU A 88 5.967 0.823 1.933 1.00 0.00 H new ATOM 1310 N PHE A 89 0.810 -2.854 2.944 1.00 0.00 N ATOM 1311 CA PHE A 89 0.546 -4.267 3.173 1.00 0.00 C ATOM 1312 C PHE A 89 0.285 -4.750 1.737 1.00 0.00 C ATOM 1313 O PHE A 89 -0.805 -4.732 1.176 1.00 0.00 O ATOM 1314 CB PHE A 89 -0.578 -4.426 4.218 1.00 0.00 C ATOM 1315 CG PHE A 89 -0.556 -5.713 5.020 1.00 0.00 C ATOM 1316 CD1 PHE A 89 0.323 -6.765 4.746 1.00 0.00 C ATOM 1317 CD2 PHE A 89 -1.456 -5.871 6.071 1.00 0.00 C ATOM 1318 CE1 PHE A 89 0.273 -7.947 5.473 1.00 0.00 C ATOM 1319 CE2 PHE A 89 -1.496 -7.047 6.806 1.00 0.00 C ATOM 1320 CZ PHE A 89 -0.637 -8.090 6.507 1.00 0.00 C ATOM 0 H PHE A 89 -0.018 -2.272 2.820 1.00 0.00 H new ATOM 0 HA PHE A 89 1.331 -4.873 3.626 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.525 -3.587 4.912 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.537 -4.356 3.706 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.052 -6.657 3.957 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.133 -5.066 6.317 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.945 -8.757 5.231 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.202 -7.149 7.617 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.676 -9.008 7.075 1.00 0.00 H new ATOM 1330 N VAL A 90 1.442 -5.159 1.200 1.00 0.00 N ATOM 1331 CA VAL A 90 1.612 -5.565 -0.166 1.00 0.00 C ATOM 1332 C VAL A 90 1.366 -7.064 -0.335 1.00 0.00 C ATOM 1333 O VAL A 90 2.178 -7.962 -0.138 1.00 0.00 O ATOM 1334 CB VAL A 90 3.020 -5.069 -0.634 1.00 0.00 C ATOM 1335 CG1 VAL A 90 2.871 -3.602 -1.153 1.00 0.00 C ATOM 1336 CG2 VAL A 90 4.347 -5.601 -0.054 1.00 0.00 C ATOM 0 H VAL A 90 2.306 -5.211 1.740 1.00 0.00 H new ATOM 0 HA VAL A 90 0.867 -5.108 -0.817 1.00 0.00 H new ATOM 0 HB VAL A 90 3.340 -5.723 -1.445 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.841 -3.233 -1.486 1.00 0.00 H new ATOM 0 HG12 VAL A 90 2.169 -3.581 -1.987 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.498 -2.968 -0.349 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.184 -5.101 -0.542 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.381 -5.403 1.017 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.415 -6.675 -0.227 1.00 0.00 H new ATOM 1346 N GLY A 91 0.111 -7.218 -0.738 1.00 0.00 N ATOM 1347 CA GLY A 91 -0.431 -8.523 -1.069 1.00 0.00 C ATOM 1348 C GLY A 91 0.313 -9.196 -2.233 1.00 0.00 C ATOM 1349 O GLY A 91 0.430 -8.652 -3.325 1.00 0.00 O ATOM 0 H GLY A 91 -0.551 -6.449 -0.843 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -0.381 -9.166 -0.191 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -1.485 -8.419 -1.328 1.00 0.00 H new ATOM 1353 N GLY A 92 0.790 -10.418 -1.906 1.00 0.00 N ATOM 1354 CA GLY A 92 1.541 -11.241 -2.847 1.00 0.00 C ATOM 1355 C GLY A 92 3.041 -11.001 -2.639 1.00 0.00 C ATOM 1356 O GLY A 92 3.733 -11.776 -1.991 1.00 0.00 O ATOM 0 H GLY A 92 0.661 -10.847 -0.990 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.305 -12.294 -2.697 1.00 0.00 H new ATOM 0 HA3 GLY A 92 1.259 -10.994 -3.871 1.00 0.00 H new ATOM 1360 N ASN A 93 3.454 -9.868 -3.259 1.00 0.00 N ATOM 1361 CA ASN A 93 4.773 -9.244 -3.311 1.00 0.00 C ATOM 1362 C ASN A 93 5.880 -10.288 -3.097 1.00 0.00 C ATOM 1363 O ASN A 93 6.273 -10.585 -1.975 1.00 0.00 O ATOM 1364 CB ASN A 93 4.822 -8.106 -2.277 1.00 0.00 C ATOM 1365 CG ASN A 93 6.156 -7.341 -2.305 1.00 0.00 C ATOM 1366 OD1 ASN A 93 6.968 -7.436 -1.394 1.00 0.00 O ATOM 1367 ND2 ASN A 93 6.316 -6.580 -3.403 1.00 0.00 N ATOM 0 H ASN A 93 2.782 -9.316 -3.792 1.00 0.00 H new ATOM 0 HA ASN A 93 4.949 -8.816 -4.298 1.00 0.00 H new ATOM 0 HB2 ASN A 93 4.004 -7.411 -2.468 1.00 0.00 H new ATOM 0 HB3 ASN A 93 4.664 -8.518 -1.280 1.00 0.00 H new ATOM 0 HD21 ASN A 93 7.165 -6.026 -3.521 1.00 0.00 H new ATOM 0 HD22 ASN A 93 5.589 -6.557 -4.118 1.00 0.00 H new ATOM 1374 N ILE A 94 6.375 -10.784 -4.253 1.00 0.00 N ATOM 1375 CA ILE A 94 7.450 -11.767 -4.319 1.00 0.00 C ATOM 1376 C ILE A 94 6.889 -13.103 -3.797 1.00 0.00 C ATOM 1377 O ILE A 94 6.393 -13.218 -2.683 1.00 0.00 O ATOM 1378 CB ILE A 94 8.773 -11.310 -3.595 1.00 0.00 C ATOM 1379 CG1 ILE A 94 9.048 -9.790 -3.513 1.00 0.00 C ATOM 1380 CG2 ILE A 94 9.813 -12.477 -3.639 1.00 0.00 C ATOM 1381 CD1 ILE A 94 10.472 -9.411 -3.064 1.00 0.00 C ATOM 0 H ILE A 94 6.027 -10.502 -5.170 1.00 0.00 H new ATOM 0 HA ILE A 94 7.771 -11.886 -5.354 1.00 0.00 H new ATOM 0 HB ILE A 94 8.765 -11.177 -2.513 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.862 -9.349 -4.492 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.334 -9.343 -2.821 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.730 -12.166 -3.139 1.00 0.00 H new ATOM 0 HG22 ILE A 94 9.402 -13.350 -3.132 1.00 0.00 H new ATOM 0 HG23 ILE A 94 10.033 -12.730 -4.676 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.568 -8.326 -3.037 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.660 -9.817 -2.070 1.00 0.00 H new ATOM 0 HD13 ILE A 94 11.197 -9.822 -3.767 1.00 0.00 H new ATOM 1393 N VAL A 95 7.025 -14.103 -4.695 1.00 0.00 N ATOM 1394 CA VAL A 95 6.585 -15.464 -4.418 1.00 0.00 C ATOM 1395 C VAL A 95 7.741 -16.182 -3.702 1.00 0.00 C ATOM 1396 O VAL A 95 8.853 -15.674 -3.622 1.00 0.00 O ATOM 1397 CB VAL A 95 6.224 -16.165 -5.769 1.00 0.00 C ATOM 1398 CG1 VAL A 95 4.948 -17.045 -5.607 1.00 0.00 C ATOM 1399 CG2 VAL A 95 6.956 -15.802 -7.096 1.00 0.00 C ATOM 0 H VAL A 95 7.440 -13.979 -5.619 1.00 0.00 H new ATOM 0 HA VAL A 95 5.698 -15.485 -3.784 1.00 0.00 H new ATOM 0 HB VAL A 95 6.860 -16.792 -6.394 1.00 0.00 H new ATOM 0 HG11 VAL A 95 4.713 -17.524 -6.558 1.00 0.00 H new ATOM 0 HG12 VAL A 95 5.126 -17.809 -4.850 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.111 -16.419 -5.300 1.00 0.00 H new ATOM 0 HG21 VAL A 95 6.553 -16.404 -7.910 1.00 0.00 H new ATOM 0 HG22 VAL A 95 6.806 -14.745 -7.317 1.00 0.00 H new ATOM 0 HG23 VAL A 95 8.022 -16.002 -6.990 1.00 0.00 H new ATOM 1409 N VAL A 96 7.395 -17.388 -3.192 1.00 0.00 N ATOM 1410 CA VAL A 96 8.289 -18.286 -2.466 1.00 0.00 C ATOM 1411 C VAL A 96 9.206 -17.539 -1.477 1.00 0.00 C ATOM 1412 O VAL A 96 10.427 -17.562 -1.572 1.00 0.00 O ATOM 1413 CB VAL A 96 9.055 -19.237 -3.444 1.00 0.00 C ATOM 1414 CG1 VAL A 96 9.859 -18.442 -4.522 1.00 0.00 C ATOM 1415 CG2 VAL A 96 9.282 -20.762 -3.228 1.00 0.00 C ATOM 0 H VAL A 96 6.451 -17.764 -3.284 1.00 0.00 H new ATOM 0 HA VAL A 96 7.672 -18.928 -1.838 1.00 0.00 H new ATOM 0 HB VAL A 96 8.250 -19.884 -3.792 1.00 0.00 H new ATOM 0 HG11 VAL A 96 10.375 -19.141 -5.180 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.174 -17.830 -5.109 1.00 0.00 H new ATOM 0 HG13 VAL A 96 10.589 -17.799 -4.031 1.00 0.00 H new ATOM 0 HG21 VAL A 96 9.846 -21.168 -4.068 1.00 0.00 H new ATOM 0 HG22 VAL A 96 9.841 -20.920 -2.305 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.319 -21.267 -3.160 1.00 0.00 H new ATOM 1425 N GLY A 97 8.512 -16.886 -0.523 1.00 0.00 N ATOM 1426 CA GLY A 97 9.195 -16.119 0.507 1.00 0.00 C ATOM 1427 C GLY A 97 8.170 -15.618 1.527 1.00 0.00 C ATOM 1428 O GLY A 97 7.020 -15.349 1.200 1.00 0.00 O ATOM 0 H GLY A 97 7.494 -16.881 -0.454 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.944 -16.738 1.001 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.722 -15.276 0.060 1.00 0.00 H new ATOM 1432 N LYS A 98 8.666 -15.524 2.778 1.00 0.00 N ATOM 1433 CA LYS A 98 7.836 -15.069 3.881 1.00 0.00 C ATOM 1434 C LYS A 98 8.817 -14.850 5.032 1.00 0.00 C ATOM 1435 O LYS A 98 9.290 -15.802 5.640 1.00 0.00 O ATOM 1436 CB LYS A 98 6.774 -16.129 4.247 1.00 0.00 C ATOM 1437 CG LYS A 98 5.934 -15.757 5.478 1.00 0.00 C ATOM 1438 CD LYS A 98 4.898 -16.835 5.824 1.00 0.00 C ATOM 1439 CE LYS A 98 4.124 -16.522 7.109 1.00 0.00 C ATOM 1440 NZ LYS A 98 3.345 -15.292 7.031 1.00 0.00 N ATOM 0 H LYS A 98 9.625 -15.757 3.034 1.00 0.00 H new ATOM 0 HA LYS A 98 7.280 -14.164 3.636 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.110 -16.275 3.395 1.00 0.00 H new ATOM 0 HB3 LYS A 98 7.271 -17.081 4.431 1.00 0.00 H new ATOM 0 HG2 LYS A 98 6.594 -15.603 6.332 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.424 -14.811 5.295 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.195 -16.936 4.997 1.00 0.00 H new ATOM 0 HD3 LYS A 98 5.402 -17.795 5.933 1.00 0.00 H new ATOM 0 HE2 LYS A 98 3.455 -17.353 7.333 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.827 -16.446 7.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 3.645 -14.643 7.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.499 -14.842 6.106 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 2.335 -15.513 7.145 1.00 0.00 H new ATOM 1453 N GLN A 99 9.075 -13.541 5.278 1.00 0.00 N ATOM 1454 CA GLN A 99 9.967 -13.039 6.321 1.00 0.00 C ATOM 1455 C GLN A 99 11.376 -13.001 5.717 1.00 0.00 C ATOM 1456 O GLN A 99 12.013 -11.957 5.661 1.00 0.00 O ATOM 1457 CB GLN A 99 9.873 -13.815 7.659 1.00 0.00 C ATOM 1458 CG GLN A 99 10.594 -13.138 8.840 1.00 0.00 C ATOM 1459 CD GLN A 99 12.125 -13.246 8.746 1.00 0.00 C ATOM 1460 OE1 GLN A 99 12.835 -12.254 8.650 1.00 0.00 O ATOM 1461 NE2 GLN A 99 12.579 -14.512 8.785 1.00 0.00 N ATOM 0 H GLN A 99 8.648 -12.793 4.732 1.00 0.00 H new ATOM 0 HA GLN A 99 9.664 -12.036 6.620 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.822 -13.944 7.917 1.00 0.00 H new ATOM 0 HB3 GLN A 99 10.291 -14.812 7.517 1.00 0.00 H new ATOM 0 HG2 GLN A 99 10.310 -12.086 8.878 1.00 0.00 H new ATOM 0 HG3 GLN A 99 10.259 -13.592 9.773 1.00 0.00 H new ATOM 0 HE21 GLN A 99 11.921 -15.287 8.866 1.00 0.00 H new ATOM 0 HE22 GLN A 99 13.581 -14.696 8.733 1.00 0.00 H new ATOM 1470 N ASN A 100 11.824 -14.198 5.281 1.00 0.00 N ATOM 1471 CA ASN A 100 13.135 -14.358 4.684 1.00 0.00 C ATOM 1472 C ASN A 100 12.953 -14.037 3.196 1.00 0.00 C ATOM 1473 O ASN A 100 12.468 -14.842 2.410 1.00 0.00 O ATOM 1474 CB ASN A 100 13.702 -15.769 4.959 1.00 0.00 C ATOM 1475 CG ASN A 100 12.838 -16.936 4.430 1.00 0.00 C ATOM 1476 OD1 ASN A 100 11.626 -16.843 4.275 1.00 0.00 O ATOM 1477 ND2 ASN A 100 13.558 -18.039 4.161 1.00 0.00 N ATOM 0 H ASN A 100 11.283 -15.061 5.339 1.00 0.00 H new ATOM 0 HA ASN A 100 13.878 -13.687 5.115 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.693 -15.839 4.511 1.00 0.00 H new ATOM 0 HB3 ASN A 100 13.829 -15.890 6.035 1.00 0.00 H new ATOM 0 HD21 ASN A 100 13.096 -18.874 3.802 1.00 0.00 H new ATOM 0 HD22 ASN A 100 14.566 -18.040 4.316 1.00 0.00 H new ATOM 1484 N TRP A 101 13.373 -12.793 2.879 1.00 0.00 N ATOM 1485 CA TRP A 101 13.289 -12.288 1.520 1.00 0.00 C ATOM 1486 C TRP A 101 14.736 -12.283 1.006 1.00 0.00 C ATOM 1487 O TRP A 101 15.672 -12.313 1.798 1.00 0.00 O ATOM 1488 CB TRP A 101 12.710 -10.863 1.517 1.00 0.00 C ATOM 1489 CG TRP A 101 11.299 -10.873 2.062 1.00 0.00 C ATOM 1490 CD1 TRP A 101 10.882 -10.334 3.281 1.00 0.00 C ATOM 1491 CD2 TRP A 101 10.128 -11.438 1.440 1.00 0.00 C ATOM 1492 NE1 TRP A 101 9.551 -10.541 3.429 1.00 0.00 N ATOM 1493 CE2 TRP A 101 9.047 -11.216 2.325 1.00 0.00 C ATOM 1494 CE3 TRP A 101 9.924 -12.090 0.254 1.00 0.00 C ATOM 1495 CZ2 TRP A 101 7.793 -11.652 1.993 1.00 0.00 C ATOM 1496 CZ3 TRP A 101 8.648 -12.536 -0.085 1.00 0.00 C ATOM 1497 CH2 TRP A 101 7.583 -12.317 0.785 1.00 0.00 C ATOM 0 H TRP A 101 13.769 -12.135 3.551 1.00 0.00 H new ATOM 0 HA TRP A 101 12.637 -12.897 0.894 1.00 0.00 H new ATOM 0 HB2 TRP A 101 13.337 -10.206 2.121 1.00 0.00 H new ATOM 0 HB3 TRP A 101 12.713 -10.463 0.503 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.520 -9.832 3.993 1.00 0.00 H new ATOM 0 HE1 TRP A 101 9.000 -10.244 4.234 1.00 0.00 H new ATOM 0 HE3 TRP A 101 10.752 -12.259 -0.419 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 6.966 -11.481 2.666 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 8.485 -13.050 -1.021 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.594 -12.662 0.524 1.00 0.00 H new ATOM 1508 N PRO A 102 14.907 -12.239 -0.353 1.00 0.00 N ATOM 1509 CA PRO A 102 16.239 -12.217 -0.958 1.00 0.00 C ATOM 1510 C PRO A 102 16.911 -10.865 -0.624 1.00 0.00 C ATOM 1511 O PRO A 102 16.530 -10.148 0.294 1.00 0.00 O ATOM 1512 CB PRO A 102 15.986 -12.404 -2.475 1.00 0.00 C ATOM 1513 CG PRO A 102 14.526 -12.836 -2.614 1.00 0.00 C ATOM 1514 CD PRO A 102 13.828 -12.368 -1.337 1.00 0.00 C ATOM 0 HA PRO A 102 16.910 -12.993 -0.591 1.00 0.00 H new ATOM 0 HB2 PRO A 102 16.171 -11.477 -3.018 1.00 0.00 H new ATOM 0 HB3 PRO A 102 16.656 -13.156 -2.892 1.00 0.00 H new ATOM 0 HG2 PRO A 102 14.068 -12.388 -3.496 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.448 -13.917 -2.728 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.316 -11.418 -1.490 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.077 -13.086 -1.010 1.00 0.00 H new ATOM 1522 N ASP A 103 17.910 -10.554 -1.484 1.00 0.00 N ATOM 1523 CA ASP A 103 18.723 -9.346 -1.403 1.00 0.00 C ATOM 1524 C ASP A 103 17.819 -8.123 -1.646 1.00 0.00 C ATOM 1525 O ASP A 103 18.132 -7.015 -1.224 1.00 0.00 O ATOM 1526 CB ASP A 103 19.892 -9.416 -2.410 1.00 0.00 C ATOM 1527 CG ASP A 103 19.412 -9.581 -3.868 1.00 0.00 C ATOM 1528 OD1 ASP A 103 19.235 -10.717 -4.308 1.00 0.00 O ATOM 1529 OD2 ASP A 103 19.222 -8.571 -4.545 1.00 0.00 O ATOM 0 H ASP A 103 18.168 -11.157 -2.265 1.00 0.00 H new ATOM 0 HA ASP A 103 19.167 -9.255 -0.412 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.491 -8.509 -2.329 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.542 -10.251 -2.149 1.00 0.00 H new ATOM 1534 N VAL A 104 16.690 -8.390 -2.342 1.00 0.00 N ATOM 1535 CA VAL A 104 15.706 -7.372 -2.667 1.00 0.00 C ATOM 1536 C VAL A 104 15.180 -6.702 -1.397 1.00 0.00 C ATOM 1537 O VAL A 104 15.508 -5.550 -1.142 1.00 0.00 O ATOM 1538 CB VAL A 104 14.572 -7.953 -3.578 1.00 0.00 C ATOM 1539 CG1 VAL A 104 13.971 -9.271 -2.989 1.00 0.00 C ATOM 1540 CG2 VAL A 104 13.783 -7.128 -4.619 1.00 0.00 C ATOM 0 H VAL A 104 16.450 -9.320 -2.686 1.00 0.00 H new ATOM 0 HA VAL A 104 16.189 -6.589 -3.251 1.00 0.00 H new ATOM 0 HB VAL A 104 15.124 -8.153 -4.496 1.00 0.00 H new ATOM 0 HG11 VAL A 104 13.188 -9.641 -3.651 1.00 0.00 H new ATOM 0 HG12 VAL A 104 14.757 -10.021 -2.901 1.00 0.00 H new ATOM 0 HG13 VAL A 104 13.549 -9.070 -2.004 1.00 0.00 H new ATOM 0 HG21 VAL A 104 13.055 -7.769 -5.115 1.00 0.00 H new ATOM 0 HG22 VAL A 104 13.265 -6.310 -4.118 1.00 0.00 H new ATOM 0 HG23 VAL A 104 14.472 -6.721 -5.359 1.00 0.00 H new ATOM 1550 N GLU A 105 14.374 -7.456 -0.611 1.00 0.00 N ATOM 1551 CA GLU A 105 13.845 -6.862 0.605 1.00 0.00 C ATOM 1552 C GLU A 105 14.816 -7.137 1.754 1.00 0.00 C ATOM 1553 O GLU A 105 14.377 -7.241 2.888 1.00 0.00 O ATOM 1554 CB GLU A 105 12.391 -7.251 0.933 1.00 0.00 C ATOM 1555 CG GLU A 105 11.432 -7.025 -0.247 1.00 0.00 C ATOM 1556 CD GLU A 105 9.981 -7.363 0.142 1.00 0.00 C ATOM 1557 OE1 GLU A 105 9.591 -8.524 0.028 1.00 0.00 O ATOM 1558 OE2 GLU A 105 9.255 -6.458 0.552 1.00 0.00 O ATOM 0 H GLU A 105 14.097 -8.420 -0.795 1.00 0.00 H new ATOM 0 HA GLU A 105 13.775 -5.787 0.442 1.00 0.00 H new ATOM 0 HB2 GLU A 105 12.358 -8.300 1.226 1.00 0.00 H new ATOM 0 HB3 GLU A 105 12.049 -6.670 1.789 1.00 0.00 H new ATOM 0 HG2 GLU A 105 11.491 -5.987 -0.573 1.00 0.00 H new ATOM 0 HG3 GLU A 105 11.738 -7.643 -1.091 1.00 0.00 H new ATOM 1565 N GLN A 106 16.130 -7.263 1.437 1.00 0.00 N ATOM 1566 CA GLN A 106 17.137 -7.427 2.481 1.00 0.00 C ATOM 1567 C GLN A 106 17.408 -5.986 2.953 1.00 0.00 C ATOM 1568 O GLN A 106 17.537 -5.699 4.137 1.00 0.00 O ATOM 1569 CB GLN A 106 18.419 -8.078 1.939 1.00 0.00 C ATOM 1570 CG GLN A 106 19.519 -8.240 2.998 1.00 0.00 C ATOM 1571 CD GLN A 106 20.760 -8.907 2.388 1.00 0.00 C ATOM 1572 OE1 GLN A 106 21.771 -8.268 2.128 1.00 0.00 O ATOM 1573 NE2 GLN A 106 20.609 -10.228 2.182 1.00 0.00 N ATOM 0 H GLN A 106 16.497 -7.253 0.485 1.00 0.00 H new ATOM 0 HA GLN A 106 16.800 -8.084 3.283 1.00 0.00 H new ATOM 0 HB2 GLN A 106 18.174 -9.058 1.528 1.00 0.00 H new ATOM 0 HB3 GLN A 106 18.804 -7.475 1.117 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.786 -7.265 3.405 1.00 0.00 H new ATOM 0 HG3 GLN A 106 19.147 -8.841 3.828 1.00 0.00 H new ATOM 0 HE21 GLN A 106 19.731 -10.685 2.427 1.00 0.00 H new ATOM 0 HE22 GLN A 106 21.373 -10.772 1.781 1.00 0.00 H new ATOM 1582 N ARG A 107 17.467 -5.107 1.923 1.00 0.00 N ATOM 1583 CA ARG A 107 17.673 -3.687 2.133 1.00 0.00 C ATOM 1584 C ARG A 107 16.305 -3.111 2.521 1.00 0.00 C ATOM 1585 O ARG A 107 16.236 -2.180 3.315 1.00 0.00 O ATOM 1586 CB ARG A 107 18.282 -3.012 0.887 1.00 0.00 C ATOM 1587 CG ARG A 107 17.551 -3.335 -0.427 1.00 0.00 C ATOM 1588 CD ARG A 107 18.079 -2.542 -1.626 1.00 0.00 C ATOM 1589 NE ARG A 107 17.818 -1.120 -1.440 1.00 0.00 N ATOM 1590 CZ ARG A 107 18.024 -0.211 -2.419 1.00 0.00 C ATOM 1591 NH1 ARG A 107 18.494 -0.575 -3.610 1.00 0.00 N ATOM 1592 NH2 ARG A 107 17.751 1.069 -2.188 1.00 0.00 N ATOM 0 H ARG A 107 17.373 -5.375 0.943 1.00 0.00 H new ATOM 0 HA ARG A 107 18.397 -3.499 2.926 1.00 0.00 H new ATOM 0 HB2 ARG A 107 18.279 -1.932 1.035 1.00 0.00 H new ATOM 0 HB3 ARG A 107 19.324 -3.318 0.795 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.646 -4.401 -0.635 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.488 -3.128 -0.303 1.00 0.00 H new ATOM 0 HD2 ARG A 107 19.150 -2.711 -1.741 1.00 0.00 H new ATOM 0 HD3 ARG A 107 17.601 -2.891 -2.542 1.00 0.00 H new ATOM 0 HE ARG A 107 17.467 -0.799 -0.538 1.00 0.00 H new ATOM 0 HH11 ARG A 107 18.706 -1.555 -3.797 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.643 0.126 -4.336 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.390 1.357 -1.279 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.903 1.763 -2.920 1.00 0.00 H new ATOM 1606 N PHE A 108 15.223 -3.714 1.953 1.00 0.00 N ATOM 1607 CA PHE A 108 13.890 -3.231 2.300 1.00 0.00 C ATOM 1608 C PHE A 108 13.394 -4.031 3.525 1.00 0.00 C ATOM 1609 O PHE A 108 12.203 -4.026 3.805 1.00 0.00 O ATOM 1610 CB PHE A 108 12.885 -3.268 1.129 1.00 0.00 C ATOM 1611 CG PHE A 108 13.447 -2.726 -0.162 1.00 0.00 C ATOM 1612 CD1 PHE A 108 14.022 -1.459 -0.215 1.00 0.00 C ATOM 1613 CD2 PHE A 108 13.388 -3.482 -1.331 1.00 0.00 C ATOM 1614 CE1 PHE A 108 14.525 -0.959 -1.409 1.00 0.00 C ATOM 1615 CE2 PHE A 108 13.893 -2.988 -2.525 1.00 0.00 C ATOM 1616 CZ PHE A 108 14.463 -1.725 -2.564 1.00 0.00 C ATOM 0 H PHE A 108 15.257 -4.490 1.292 1.00 0.00 H new ATOM 0 HA PHE A 108 13.962 -2.172 2.547 1.00 0.00 H new ATOM 0 HB2 PHE A 108 12.560 -4.296 0.971 1.00 0.00 H new ATOM 0 HB3 PHE A 108 12.000 -2.692 1.401 1.00 0.00 H new ATOM 0 HD1 PHE A 108 14.077 -0.859 0.681 1.00 0.00 H new ATOM 0 HD2 PHE A 108 12.943 -4.466 -1.307 1.00 0.00 H new ATOM 0 HE1 PHE A 108 14.965 0.027 -1.438 1.00 0.00 H new ATOM 0 HE2 PHE A 108 13.842 -3.586 -3.423 1.00 0.00 H new ATOM 0 HZ PHE A 108 14.858 -1.338 -3.492 1.00 0.00 H new ATOM 1626 N LYS A 109 14.328 -4.746 4.213 1.00 0.00 N ATOM 1627 CA LYS A 109 13.999 -5.478 5.437 1.00 0.00 C ATOM 1628 C LYS A 109 14.249 -4.467 6.561 1.00 0.00 C ATOM 1629 O LYS A 109 13.516 -4.395 7.539 1.00 0.00 O ATOM 1630 CB LYS A 109 14.852 -6.748 5.670 1.00 0.00 C ATOM 1631 CG LYS A 109 14.002 -8.018 5.822 1.00 0.00 C ATOM 1632 CD LYS A 109 13.176 -8.030 7.116 1.00 0.00 C ATOM 1633 CE LYS A 109 12.340 -9.305 7.248 1.00 0.00 C ATOM 1634 NZ LYS A 109 11.563 -9.345 8.480 1.00 0.00 N ATOM 0 H LYS A 109 15.305 -4.821 3.930 1.00 0.00 H new ATOM 0 HA LYS A 109 12.975 -5.848 5.385 1.00 0.00 H new ATOM 0 HB2 LYS A 109 15.541 -6.875 4.835 1.00 0.00 H new ATOM 0 HB3 LYS A 109 15.458 -6.613 6.566 1.00 0.00 H new ATOM 0 HG2 LYS A 109 13.331 -8.105 4.967 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.655 -8.891 5.805 1.00 0.00 H new ATOM 0 HD2 LYS A 109 13.843 -7.943 7.973 1.00 0.00 H new ATOM 0 HD3 LYS A 109 12.518 -7.161 7.135 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.665 -9.382 6.395 1.00 0.00 H new ATOM 0 HE3 LYS A 109 13.000 -10.172 7.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 11.691 -10.268 8.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 11.886 -8.591 9.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.556 -9.204 8.260 1.00 0.00 H new ATOM 1647 N ALA A 110 15.348 -3.696 6.337 1.00 0.00 N ATOM 1648 CA ALA A 110 15.795 -2.651 7.245 1.00 0.00 C ATOM 1649 C ALA A 110 14.667 -1.615 7.326 1.00 0.00 C ATOM 1650 O ALA A 110 14.429 -1.017 8.368 1.00 0.00 O ATOM 1651 CB ALA A 110 17.107 -2.031 6.742 1.00 0.00 C ATOM 0 H ALA A 110 15.939 -3.798 5.512 1.00 0.00 H new ATOM 0 HA ALA A 110 16.003 -3.050 8.238 1.00 0.00 H new ATOM 0 HB1 ALA A 110 17.429 -1.251 7.432 1.00 0.00 H new ATOM 0 HB2 ALA A 110 17.875 -2.802 6.683 1.00 0.00 H new ATOM 0 HB3 ALA A 110 16.950 -1.599 5.754 1.00 0.00 H new ATOM 1657 N MET A 111 13.984 -1.456 6.167 1.00 0.00 N ATOM 1658 CA MET A 111 12.850 -0.559 6.080 1.00 0.00 C ATOM 1659 C MET A 111 11.720 -1.360 6.745 1.00 0.00 C ATOM 1660 O MET A 111 11.192 -0.979 7.783 1.00 0.00 O ATOM 1661 CB MET A 111 12.590 -0.192 4.607 1.00 0.00 C ATOM 1662 CG MET A 111 13.759 0.597 4.005 1.00 0.00 C ATOM 1663 SD MET A 111 13.351 1.282 2.388 1.00 0.00 S ATOM 1664 CE MET A 111 12.906 2.960 2.880 1.00 0.00 C ATOM 0 H MET A 111 14.210 -1.940 5.298 1.00 0.00 H new ATOM 0 HA MET A 111 12.980 0.404 6.575 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.428 -1.101 4.028 1.00 0.00 H new ATOM 0 HB3 MET A 111 11.677 0.398 4.535 1.00 0.00 H new ATOM 0 HG2 MET A 111 14.037 1.405 4.681 1.00 0.00 H new ATOM 0 HG3 MET A 111 14.628 -0.055 3.914 1.00 0.00 H new ATOM 0 HE1 MET A 111 12.097 3.323 2.245 1.00 0.00 H new ATOM 0 HE2 MET A 111 12.579 2.960 3.920 1.00 0.00 H new ATOM 0 HE3 MET A 111 13.772 3.613 2.772 1.00 0.00 H new ATOM 1674 N GLY A 112 11.436 -2.503 6.075 1.00 0.00 N ATOM 1675 CA GLY A 112 10.456 -3.527 6.435 1.00 0.00 C ATOM 1676 C GLY A 112 9.180 -3.059 7.151 1.00 0.00 C ATOM 1677 O GLY A 112 8.641 -3.763 7.996 1.00 0.00 O ATOM 0 H GLY A 112 11.925 -2.739 5.212 1.00 0.00 H new ATOM 0 HA2 GLY A 112 10.160 -4.046 5.523 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.952 -4.259 7.073 1.00 0.00 H new ATOM 1681 N PHE A 113 8.732 -1.847 6.761 1.00 0.00 N ATOM 1682 CA PHE A 113 7.513 -1.284 7.333 1.00 0.00 C ATOM 1683 C PHE A 113 6.327 -1.788 6.484 1.00 0.00 C ATOM 1684 O PHE A 113 5.172 -1.525 6.792 1.00 0.00 O ATOM 1685 CB PHE A 113 7.595 0.253 7.442 1.00 0.00 C ATOM 1686 CG PHE A 113 8.260 0.934 6.269 1.00 0.00 C ATOM 1687 CD1 PHE A 113 7.753 0.828 4.975 1.00 0.00 C ATOM 1688 CD2 PHE A 113 9.405 1.699 6.478 1.00 0.00 C ATOM 1689 CE1 PHE A 113 8.382 1.470 3.916 1.00 0.00 C ATOM 1690 CE2 PHE A 113 10.028 2.349 5.422 1.00 0.00 C ATOM 1691 CZ PHE A 113 9.518 2.231 4.139 1.00 0.00 C ATOM 0 H PHE A 113 9.192 -1.258 6.067 1.00 0.00 H new ATOM 0 HA PHE A 113 7.372 -1.619 8.361 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.586 0.650 7.551 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.139 0.511 8.351 1.00 0.00 H new ATOM 0 HD1 PHE A 113 6.864 0.242 4.794 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.813 1.787 7.474 1.00 0.00 H new ATOM 0 HE1 PHE A 113 7.985 1.376 2.916 1.00 0.00 H new ATOM 0 HE2 PHE A 113 10.910 2.947 5.600 1.00 0.00 H new ATOM 0 HZ PHE A 113 10.005 2.731 3.315 1.00 0.00 H new ATOM 1701 N ASP A 114 6.686 -2.510 5.401 1.00 0.00 N ATOM 1702 CA ASP A 114 5.755 -3.101 4.470 1.00 0.00 C ATOM 1703 C ASP A 114 5.768 -4.603 4.793 1.00 0.00 C ATOM 1704 O ASP A 114 6.823 -5.205 4.951 1.00 0.00 O ATOM 1705 CB ASP A 114 6.217 -2.803 3.028 1.00 0.00 C ATOM 1706 CG ASP A 114 7.649 -3.311 2.754 1.00 0.00 C ATOM 1707 OD1 ASP A 114 8.603 -2.596 3.062 1.00 0.00 O ATOM 1708 OD2 ASP A 114 7.790 -4.418 2.237 1.00 0.00 O ATOM 0 H ASP A 114 7.661 -2.691 5.161 1.00 0.00 H new ATOM 0 HA ASP A 114 4.744 -2.703 4.554 1.00 0.00 H new ATOM 0 HB2 ASP A 114 5.528 -3.270 2.324 1.00 0.00 H new ATOM 0 HB3 ASP A 114 6.175 -1.728 2.850 1.00 0.00 H new ATOM 1713 N ARG A 115 4.543 -5.160 4.900 1.00 0.00 N ATOM 1714 CA ARG A 115 4.366 -6.579 5.166 1.00 0.00 C ATOM 1715 C ARG A 115 3.809 -7.105 3.846 1.00 0.00 C ATOM 1716 O ARG A 115 3.500 -6.337 2.946 1.00 0.00 O ATOM 1717 CB ARG A 115 3.438 -6.837 6.373 1.00 0.00 C ATOM 1718 CG ARG A 115 2.534 -5.658 6.770 1.00 0.00 C ATOM 1719 CD ARG A 115 3.227 -4.648 7.687 1.00 0.00 C ATOM 1720 NE ARG A 115 2.273 -3.610 8.042 1.00 0.00 N ATOM 1721 CZ ARG A 115 2.623 -2.555 8.805 1.00 0.00 C ATOM 1722 NH1 ARG A 115 3.868 -2.405 9.253 1.00 0.00 N ATOM 1723 NH2 ARG A 115 1.702 -1.655 9.120 1.00 0.00 N ATOM 0 H ARG A 115 3.672 -4.639 4.804 1.00 0.00 H new ATOM 0 HA ARG A 115 5.287 -7.085 5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 115 2.808 -7.697 6.148 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.053 -7.108 7.232 1.00 0.00 H new ATOM 0 HG2 ARG A 115 2.196 -5.148 5.868 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.645 -6.043 7.270 1.00 0.00 H new ATOM 0 HD2 ARG A 115 3.597 -5.144 8.584 1.00 0.00 H new ATOM 0 HD3 ARG A 115 4.091 -4.212 7.185 1.00 0.00 H new ATOM 0 HE ARG A 115 1.313 -3.682 7.705 1.00 0.00 H new ATOM 0 HH11 ARG A 115 4.581 -3.097 9.020 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.109 -1.598 9.829 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.745 -1.766 8.786 1.00 0.00 H new ATOM 0 HH22 ARG A 115 1.951 -0.851 9.696 1.00 0.00 H new ATOM 1737 N VAL A 116 3.713 -8.449 3.767 1.00 0.00 N ATOM 1738 CA VAL A 116 3.191 -9.059 2.550 1.00 0.00 C ATOM 1739 C VAL A 116 2.295 -10.225 2.949 1.00 0.00 C ATOM 1740 O VAL A 116 2.488 -10.833 3.994 1.00 0.00 O ATOM 1741 CB VAL A 116 4.337 -9.600 1.620 1.00 0.00 C ATOM 1742 CG1 VAL A 116 5.643 -8.754 1.753 1.00 0.00 C ATOM 1743 CG2 VAL A 116 4.343 -10.987 0.905 1.00 0.00 C ATOM 0 H VAL A 116 3.981 -9.101 4.505 1.00 0.00 H new ATOM 0 HA VAL A 116 2.642 -8.299 1.994 1.00 0.00 H new ATOM 0 HB VAL A 116 3.843 -9.587 0.648 1.00 0.00 H new ATOM 0 HG11 VAL A 116 6.409 -9.162 1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.437 -7.721 1.474 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.995 -8.789 2.784 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.261 -11.095 0.327 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.288 -11.781 1.650 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.484 -11.056 0.238 1.00 0.00 H new ATOM 1753 N TYR A 117 1.312 -10.503 2.051 1.00 0.00 N ATOM 1754 CA TYR A 117 0.430 -11.625 2.319 1.00 0.00 C ATOM 1755 C TYR A 117 1.015 -12.750 1.435 1.00 0.00 C ATOM 1756 O TYR A 117 1.046 -12.607 0.218 1.00 0.00 O ATOM 1757 CB TYR A 117 -1.015 -11.330 1.914 1.00 0.00 C ATOM 1758 CG TYR A 117 -1.644 -10.097 2.515 1.00 0.00 C ATOM 1759 CD1 TYR A 117 -1.110 -8.830 2.319 1.00 0.00 C ATOM 1760 CD2 TYR A 117 -2.838 -10.205 3.220 1.00 0.00 C ATOM 1761 CE1 TYR A 117 -1.770 -7.701 2.743 1.00 0.00 C ATOM 1762 CE2 TYR A 117 -3.509 -9.078 3.671 1.00 0.00 C ATOM 1763 CZ TYR A 117 -2.983 -7.811 3.422 1.00 0.00 C ATOM 1764 OH TYR A 117 -3.653 -6.685 3.869 1.00 0.00 O ATOM 0 H TYR A 117 1.131 -9.988 1.189 1.00 0.00 H new ATOM 0 HA TYR A 117 0.387 -11.872 3.380 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -1.053 -11.238 0.829 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -1.627 -12.191 2.183 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -0.156 -8.730 1.823 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.250 -11.183 3.420 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -1.348 -6.726 2.550 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -4.437 -9.182 4.214 1.00 0.00 H new ATOM 0 HH TYR A 117 -3.126 -6.248 4.571 1.00 0.00 H new ATOM 1774 N PRO A 118 1.490 -13.873 2.061 1.00 0.00 N ATOM 1775 CA PRO A 118 2.085 -14.989 1.325 1.00 0.00 C ATOM 1776 C PRO A 118 1.029 -15.532 0.352 1.00 0.00 C ATOM 1777 O PRO A 118 -0.152 -15.510 0.659 1.00 0.00 O ATOM 1778 CB PRO A 118 2.448 -16.038 2.393 1.00 0.00 C ATOM 1779 CG PRO A 118 2.426 -15.284 3.720 1.00 0.00 C ATOM 1780 CD PRO A 118 1.496 -14.090 3.507 1.00 0.00 C ATOM 0 HA PRO A 118 2.966 -14.710 0.748 1.00 0.00 H new ATOM 0 HB2 PRO A 118 1.733 -16.861 2.396 1.00 0.00 H new ATOM 0 HB3 PRO A 118 3.430 -16.470 2.202 1.00 0.00 H new ATOM 0 HG2 PRO A 118 2.064 -15.922 4.526 1.00 0.00 H new ATOM 0 HG3 PRO A 118 3.427 -14.955 3.999 1.00 0.00 H new ATOM 0 HD2 PRO A 118 0.493 -14.299 3.880 1.00 0.00 H new ATOM 0 HD3 PRO A 118 1.856 -13.209 4.038 1.00 0.00 H new ATOM 1788 N PRO A 119 1.489 -16.048 -0.825 1.00 0.00 N ATOM 1789 CA PRO A 119 0.591 -16.581 -1.845 1.00 0.00 C ATOM 1790 C PRO A 119 -0.079 -17.821 -1.235 1.00 0.00 C ATOM 1791 O PRO A 119 0.564 -18.814 -0.918 1.00 0.00 O ATOM 1792 CB PRO A 119 1.510 -16.919 -3.030 1.00 0.00 C ATOM 1793 CG PRO A 119 2.902 -17.082 -2.412 1.00 0.00 C ATOM 1794 CD PRO A 119 2.901 -16.165 -1.189 1.00 0.00 C ATOM 0 HA PRO A 119 -0.199 -15.907 -2.176 1.00 0.00 H new ATOM 0 HB2 PRO A 119 1.190 -17.833 -3.531 1.00 0.00 H new ATOM 0 HB3 PRO A 119 1.500 -16.126 -3.777 1.00 0.00 H new ATOM 0 HG2 PRO A 119 3.089 -18.118 -2.129 1.00 0.00 H new ATOM 0 HG3 PRO A 119 3.683 -16.798 -3.118 1.00 0.00 H new ATOM 0 HD2 PRO A 119 3.488 -16.589 -0.374 1.00 0.00 H new ATOM 0 HD3 PRO A 119 3.334 -15.192 -1.421 1.00 0.00 H new ATOM 1802 N GLY A 120 -1.415 -17.669 -1.099 1.00 0.00 N ATOM 1803 CA GLY A 120 -2.269 -18.707 -0.535 1.00 0.00 C ATOM 1804 C GLY A 120 -2.926 -18.247 0.774 1.00 0.00 C ATOM 1805 O GLY A 120 -3.173 -19.040 1.675 1.00 0.00 O ATOM 0 H GLY A 120 -1.917 -16.826 -1.378 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.041 -18.975 -1.256 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.679 -19.605 -0.351 1.00 0.00 H new ATOM 1809 N THR A 121 -3.187 -16.921 0.816 1.00 0.00 N ATOM 1810 CA THR A 121 -3.814 -16.283 1.957 1.00 0.00 C ATOM 1811 C THR A 121 -5.326 -16.344 1.683 1.00 0.00 C ATOM 1812 O THR A 121 -5.803 -17.067 0.816 1.00 0.00 O ATOM 1813 CB THR A 121 -3.145 -14.881 2.142 1.00 0.00 C ATOM 1814 OG1 THR A 121 -2.521 -14.300 0.951 1.00 0.00 O ATOM 1815 CG2 THR A 121 -2.224 -14.879 3.404 1.00 0.00 C ATOM 0 H THR A 121 -2.964 -16.280 0.055 1.00 0.00 H new ATOM 0 HA THR A 121 -3.673 -16.760 2.927 1.00 0.00 H new ATOM 0 HB THR A 121 -3.966 -14.185 2.315 1.00 0.00 H new ATOM 0 HG1 THR A 121 -1.725 -14.820 0.712 1.00 0.00 H new ATOM 0 HG21 THR A 121 -1.766 -13.897 3.519 1.00 0.00 H new ATOM 0 HG22 THR A 121 -2.818 -15.108 4.289 1.00 0.00 H new ATOM 0 HG23 THR A 121 -1.444 -15.631 3.286 1.00 0.00 H new ATOM 1823 N SER A 122 -6.034 -15.543 2.498 1.00 0.00 N ATOM 1824 CA SER A 122 -7.464 -15.462 2.512 1.00 0.00 C ATOM 1825 C SER A 122 -7.815 -13.988 2.771 1.00 0.00 C ATOM 1826 O SER A 122 -6.955 -13.173 3.082 1.00 0.00 O ATOM 1827 CB SER A 122 -7.852 -16.373 3.721 1.00 0.00 C ATOM 1828 OG SER A 122 -7.002 -16.299 4.941 1.00 0.00 O ATOM 0 H SER A 122 -5.592 -14.924 3.178 1.00 0.00 H new ATOM 0 HA SER A 122 -7.974 -15.774 1.601 1.00 0.00 H new ATOM 0 HB2 SER A 122 -8.875 -16.131 4.009 1.00 0.00 H new ATOM 0 HB3 SER A 122 -7.854 -17.407 3.375 1.00 0.00 H new ATOM 0 HG SER A 122 -6.466 -15.479 4.917 1.00 0.00 H new ATOM 1834 N PRO A 123 -9.137 -13.661 2.625 1.00 0.00 N ATOM 1835 CA PRO A 123 -9.636 -12.315 2.895 1.00 0.00 C ATOM 1836 C PRO A 123 -9.789 -12.183 4.432 1.00 0.00 C ATOM 1837 O PRO A 123 -10.108 -11.119 4.945 1.00 0.00 O ATOM 1838 CB PRO A 123 -10.999 -12.265 2.194 1.00 0.00 C ATOM 1839 CG PRO A 123 -11.459 -13.724 2.178 1.00 0.00 C ATOM 1840 CD PRO A 123 -10.172 -14.544 2.079 1.00 0.00 C ATOM 0 HA PRO A 123 -8.989 -11.510 2.545 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -11.702 -11.630 2.733 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -10.915 -11.862 1.185 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -12.016 -13.972 3.081 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -12.118 -13.921 1.333 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -10.246 -15.470 2.649 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -9.955 -14.821 1.047 1.00 0.00 H new ATOM 1848 N GLU A 124 -9.537 -13.319 5.130 1.00 0.00 N ATOM 1849 CA GLU A 124 -9.582 -13.417 6.577 1.00 0.00 C ATOM 1850 C GLU A 124 -8.333 -12.679 7.098 1.00 0.00 C ATOM 1851 O GLU A 124 -8.304 -12.173 8.214 1.00 0.00 O ATOM 1852 CB GLU A 124 -9.620 -14.914 6.963 1.00 0.00 C ATOM 1853 CG GLU A 124 -8.866 -15.283 8.253 1.00 0.00 C ATOM 1854 CD GLU A 124 -9.068 -16.768 8.598 1.00 0.00 C ATOM 1855 OE1 GLU A 124 -8.346 -17.603 8.053 1.00 0.00 O ATOM 1856 OE2 GLU A 124 -9.944 -17.074 9.408 1.00 0.00 O ATOM 0 H GLU A 124 -9.294 -14.200 4.676 1.00 0.00 H new ATOM 0 HA GLU A 124 -10.467 -12.960 7.021 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -10.661 -15.217 7.072 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.203 -15.495 6.140 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -7.803 -15.075 8.130 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.220 -14.662 9.076 1.00 0.00 H new ATOM 1863 N THR A 125 -7.315 -12.644 6.211 1.00 0.00 N ATOM 1864 CA THR A 125 -6.054 -12.011 6.491 1.00 0.00 C ATOM 1865 C THR A 125 -6.238 -10.501 6.297 1.00 0.00 C ATOM 1866 O THR A 125 -5.418 -9.726 6.775 1.00 0.00 O ATOM 1867 CB THR A 125 -5.020 -12.624 5.487 1.00 0.00 C ATOM 1868 OG1 THR A 125 -5.246 -13.958 4.927 1.00 0.00 O ATOM 1869 CG2 THR A 125 -3.599 -12.570 6.076 1.00 0.00 C ATOM 0 H THR A 125 -7.368 -13.063 5.282 1.00 0.00 H new ATOM 0 HA THR A 125 -5.698 -12.173 7.508 1.00 0.00 H new ATOM 0 HB THR A 125 -5.166 -11.973 4.625 1.00 0.00 H new ATOM 0 HG1 THR A 125 -4.703 -14.613 5.413 1.00 0.00 H new ATOM 0 HG21 THR A 125 -2.894 -13.000 5.365 1.00 0.00 H new ATOM 0 HG22 THR A 125 -3.327 -11.533 6.275 1.00 0.00 H new ATOM 0 HG23 THR A 125 -3.569 -13.138 7.006 1.00 0.00 H new ATOM 1877 N THR A 126 -7.327 -10.103 5.584 1.00 0.00 N ATOM 1878 CA THR A 126 -7.535 -8.688 5.375 1.00 0.00 C ATOM 1879 C THR A 126 -8.247 -8.086 6.580 1.00 0.00 C ATOM 1880 O THR A 126 -8.270 -6.872 6.763 1.00 0.00 O ATOM 1881 CB THR A 126 -8.325 -8.263 4.138 1.00 0.00 C ATOM 1882 OG1 THR A 126 -9.787 -8.339 4.184 1.00 0.00 O ATOM 1883 CG2 THR A 126 -7.680 -8.802 2.838 1.00 0.00 C ATOM 0 H THR A 126 -8.026 -10.722 5.174 1.00 0.00 H new ATOM 0 HA THR A 126 -6.521 -8.319 5.223 1.00 0.00 H new ATOM 0 HB THR A 126 -8.222 -7.178 4.136 1.00 0.00 H new ATOM 0 HG1 THR A 126 -10.060 -9.246 4.434 1.00 0.00 H new ATOM 0 HG21 THR A 126 -8.269 -8.480 1.979 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.665 -8.415 2.748 1.00 0.00 H new ATOM 0 HG23 THR A 126 -7.651 -9.891 2.870 1.00 0.00 H new ATOM 1891 N ILE A 127 -8.843 -8.973 7.395 1.00 0.00 N ATOM 1892 CA ILE A 127 -9.445 -8.472 8.618 1.00 0.00 C ATOM 1893 C ILE A 127 -8.215 -8.026 9.448 1.00 0.00 C ATOM 1894 O ILE A 127 -8.235 -7.035 10.169 1.00 0.00 O ATOM 1895 CB ILE A 127 -10.288 -9.599 9.286 1.00 0.00 C ATOM 1896 CG1 ILE A 127 -11.114 -10.474 8.321 1.00 0.00 C ATOM 1897 CG2 ILE A 127 -10.587 -9.226 10.774 1.00 0.00 C ATOM 1898 CD1 ILE A 127 -11.957 -11.594 8.965 1.00 0.00 C ATOM 0 H ILE A 127 -8.915 -9.978 7.236 1.00 0.00 H new ATOM 0 HA ILE A 127 -10.148 -7.649 8.489 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.836 -10.559 9.535 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.783 -9.824 7.757 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -10.432 -10.929 7.603 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -11.177 -10.018 11.236 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.648 -9.110 11.316 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -11.145 -8.290 10.809 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -12.492 -12.139 8.188 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -11.302 -12.279 9.503 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -12.674 -11.156 9.660 1.00 0.00 H new ATOM 1910 N ALA A 128 -7.127 -8.809 9.214 1.00 0.00 N ATOM 1911 CA ALA A 128 -5.860 -8.570 9.847 1.00 0.00 C ATOM 1912 C ALA A 128 -5.096 -7.486 9.061 1.00 0.00 C ATOM 1913 O ALA A 128 -4.003 -7.118 9.474 1.00 0.00 O ATOM 1914 CB ALA A 128 -5.062 -9.874 10.008 1.00 0.00 C ATOM 0 H ALA A 128 -7.133 -9.610 8.582 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.019 -8.197 10.859 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.108 -9.660 10.490 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.629 -10.574 10.621 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.882 -10.314 9.027 1.00 0.00 H new ATOM 1920 N ASP A 129 -5.687 -6.972 7.943 1.00 0.00 N ATOM 1921 CA ASP A 129 -5.051 -5.924 7.156 1.00 0.00 C ATOM 1922 C ASP A 129 -4.895 -4.712 8.082 1.00 0.00 C ATOM 1923 O ASP A 129 -3.802 -4.295 8.433 1.00 0.00 O ATOM 1924 CB ASP A 129 -5.908 -5.504 5.934 1.00 0.00 C ATOM 1925 CG ASP A 129 -5.173 -4.623 4.897 1.00 0.00 C ATOM 1926 OD1 ASP A 129 -4.069 -4.157 5.159 1.00 0.00 O ATOM 1927 OD2 ASP A 129 -5.714 -4.416 3.816 1.00 0.00 O ATOM 0 H ASP A 129 -6.593 -7.276 7.586 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.098 -6.291 6.774 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.269 -6.403 5.435 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.785 -4.964 6.292 1.00 0.00 H new ATOM 1932 N MET A 130 -6.086 -4.204 8.453 1.00 0.00 N ATOM 1933 CA MET A 130 -6.189 -3.015 9.276 1.00 0.00 C ATOM 1934 C MET A 130 -6.210 -3.388 10.768 1.00 0.00 C ATOM 1935 O MET A 130 -6.458 -2.515 11.589 1.00 0.00 O ATOM 1936 CB MET A 130 -7.411 -2.187 8.820 1.00 0.00 C ATOM 1937 CG MET A 130 -7.159 -1.455 7.493 1.00 0.00 C ATOM 1938 SD MET A 130 -7.293 -2.523 6.062 1.00 0.00 S ATOM 1939 CE MET A 130 -6.125 -1.633 5.033 1.00 0.00 C ATOM 0 H MET A 130 -6.984 -4.610 8.188 1.00 0.00 H new ATOM 0 HA MET A 130 -5.310 -2.384 9.148 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.273 -2.846 8.711 1.00 0.00 H new ATOM 0 HB3 MET A 130 -7.662 -1.459 9.592 1.00 0.00 H new ATOM 0 HG2 MET A 130 -7.872 -0.637 7.396 1.00 0.00 H new ATOM 0 HG3 MET A 130 -6.164 -1.010 7.514 1.00 0.00 H new ATOM 0 HE1 MET A 130 -6.235 -1.954 3.997 1.00 0.00 H new ATOM 0 HE2 MET A 130 -6.319 -0.563 5.104 1.00 0.00 H new ATOM 0 HE3 MET A 130 -5.110 -1.841 5.372 1.00 0.00 H new ATOM 1949 N LYS A 131 -5.947 -4.664 11.134 1.00 0.00 N ATOM 1950 CA LYS A 131 -5.950 -4.955 12.568 1.00 0.00 C ATOM 1951 C LYS A 131 -4.531 -4.705 13.115 1.00 0.00 C ATOM 1952 O LYS A 131 -4.376 -4.265 14.247 1.00 0.00 O ATOM 1953 CB LYS A 131 -6.371 -6.405 12.849 1.00 0.00 C ATOM 1954 CG LYS A 131 -6.610 -6.698 14.338 1.00 0.00 C ATOM 1955 CD LYS A 131 -7.292 -8.054 14.572 1.00 0.00 C ATOM 1956 CE LYS A 131 -6.457 -9.247 14.094 1.00 0.00 C ATOM 1957 NZ LYS A 131 -7.102 -10.520 14.391 1.00 0.00 N ATOM 0 H LYS A 131 -5.747 -5.444 10.509 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.673 -4.305 13.061 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -7.283 -6.624 12.293 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -5.600 -7.078 12.474 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -5.656 -6.679 14.866 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -7.226 -5.907 14.766 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -7.500 -8.169 15.636 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -8.252 -8.063 14.057 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -6.292 -9.166 13.020 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -5.477 -9.217 14.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -6.504 -11.300 14.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.237 -10.610 15.418 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -8.026 -10.560 13.916 1.00 0.00 H new ATOM 1970 N GLU A 132 -3.516 -4.998 12.264 1.00 0.00 N ATOM 1971 CA GLU A 132 -2.129 -4.868 12.695 1.00 0.00 C ATOM 1972 C GLU A 132 -1.607 -3.462 12.402 1.00 0.00 C ATOM 1973 O GLU A 132 -0.937 -2.850 13.225 1.00 0.00 O ATOM 1974 CB GLU A 132 -1.274 -5.993 12.074 1.00 0.00 C ATOM 1975 CG GLU A 132 -1.037 -5.869 10.557 1.00 0.00 C ATOM 1976 CD GLU A 132 -0.331 -7.124 10.016 1.00 0.00 C ATOM 1977 OE1 GLU A 132 -0.969 -8.175 9.951 1.00 0.00 O ATOM 1978 OE2 GLU A 132 0.846 -7.040 9.666 1.00 0.00 O ATOM 0 H GLU A 132 -3.640 -5.317 11.303 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.061 -4.992 13.776 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -0.307 -6.014 12.577 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -1.758 -6.949 12.274 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -1.989 -5.731 10.045 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -0.432 -4.986 10.349 1.00 0.00 H new ATOM 1985 N VAL A 133 -1.950 -2.992 11.192 1.00 0.00 N ATOM 1986 CA VAL A 133 -1.505 -1.679 10.719 1.00 0.00 C ATOM 1987 C VAL A 133 -2.114 -0.516 11.531 1.00 0.00 C ATOM 1988 O VAL A 133 -1.481 0.521 11.687 1.00 0.00 O ATOM 1989 CB VAL A 133 -1.725 -1.564 9.165 1.00 0.00 C ATOM 1990 CG1 VAL A 133 -1.553 -0.084 8.689 1.00 0.00 C ATOM 1991 CG2 VAL A 133 -1.459 -2.691 8.136 1.00 0.00 C ATOM 0 H VAL A 133 -2.532 -3.503 10.528 1.00 0.00 H new ATOM 0 HA VAL A 133 -0.433 -1.590 10.896 1.00 0.00 H new ATOM 0 HB VAL A 133 -2.754 -1.920 9.119 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -1.709 -0.028 7.612 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -2.283 0.548 9.195 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.547 0.260 8.928 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -1.698 -2.333 7.135 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.409 -2.981 8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -2.083 -3.553 8.371 1.00 0.00 H new ATOM 2001 N LEU A 134 -3.350 -0.735 12.037 1.00 0.00 N ATOM 2002 CA LEU A 134 -4.004 0.311 12.815 1.00 0.00 C ATOM 2003 C LEU A 134 -3.613 0.098 14.283 1.00 0.00 C ATOM 2004 O LEU A 134 -3.469 1.052 15.038 1.00 0.00 O ATOM 2005 CB LEU A 134 -5.533 0.285 12.672 1.00 0.00 C ATOM 2006 CG LEU A 134 -6.051 0.497 11.215 1.00 0.00 C ATOM 2007 CD1 LEU A 134 -7.579 0.799 11.265 1.00 0.00 C ATOM 2008 CD2 LEU A 134 -5.198 0.558 9.902 1.00 0.00 C ATOM 0 H LEU A 134 -3.887 -1.595 11.921 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.678 1.284 12.447 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -5.903 -0.672 13.040 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.958 1.059 13.311 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.457 -0.055 10.487 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -7.954 0.949 10.252 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -8.101 -0.041 11.724 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.753 1.700 11.854 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.856 0.717 9.048 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -4.485 1.380 9.969 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.659 -0.381 9.775 1.00 0.00 H new ATOM 2020 N GLY A 135 -3.453 -1.197 14.645 1.00 0.00 N ATOM 2021 CA GLY A 135 -3.095 -1.559 16.010 1.00 0.00 C ATOM 2022 C GLY A 135 -1.702 -1.043 16.397 1.00 0.00 C ATOM 2023 O GLY A 135 -1.538 0.068 16.886 1.00 0.00 O ATOM 0 H GLY A 135 -3.567 -1.988 14.011 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -3.836 -1.153 16.699 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -3.122 -2.643 16.116 1.00 0.00 H new ATOM 2027 N VAL A 136 -0.723 -1.935 16.152 1.00 0.00 N ATOM 2028 CA VAL A 136 0.662 -1.616 16.455 1.00 0.00 C ATOM 2029 C VAL A 136 1.538 -2.631 15.720 1.00 0.00 C ATOM 2030 O VAL A 136 1.129 -3.751 15.437 1.00 0.00 O ATOM 2031 CB VAL A 136 0.918 -1.651 17.996 1.00 0.00 C ATOM 2032 CG1 VAL A 136 2.036 -0.635 18.376 1.00 0.00 C ATOM 2033 CG2 VAL A 136 -0.026 -2.321 19.035 1.00 0.00 C ATOM 0 H VAL A 136 -0.873 -2.862 15.753 1.00 0.00 H new ATOM 0 HA VAL A 136 0.903 -0.606 16.124 1.00 0.00 H new ATOM 0 HB VAL A 136 1.140 -2.672 18.307 1.00 0.00 H new ATOM 0 HG11 VAL A 136 2.207 -0.667 19.452 1.00 0.00 H new ATOM 0 HG12 VAL A 136 2.957 -0.896 17.855 1.00 0.00 H new ATOM 0 HG13 VAL A 136 1.728 0.370 18.088 1.00 0.00 H new ATOM 0 HG21 VAL A 136 0.389 -2.200 20.035 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.008 -1.851 18.990 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -0.121 -3.383 18.808 1.00 0.00 H new ATOM 2043 N GLU A 137 2.760 -2.143 15.436 1.00 0.00 N ATOM 2044 CA GLU A 137 3.763 -2.919 14.725 1.00 0.00 C ATOM 2045 C GLU A 137 5.095 -2.558 15.399 1.00 0.00 C ATOM 2046 O GLU A 137 5.480 -1.389 15.373 1.00 0.00 O ATOM 2047 CB GLU A 137 3.752 -2.551 13.224 1.00 0.00 C ATOM 2048 CG GLU A 137 2.439 -2.890 12.495 1.00 0.00 C ATOM 2049 CD GLU A 137 2.285 -4.400 12.225 1.00 0.00 C ATOM 2050 OE1 GLU A 137 1.997 -5.145 13.158 1.00 0.00 O ATOM 2051 OE2 GLU A 137 2.453 -4.816 11.080 1.00 0.00 O ATOM 2052 OXT GLU A 137 5.738 -3.453 15.947 1.00 0.00 O ATOM 0 H GLU A 137 3.067 -1.206 15.696 1.00 0.00 H new ATOM 0 HA GLU A 137 3.581 -3.993 14.771 1.00 0.00 H new ATOM 0 HB2 GLU A 137 3.944 -1.483 13.123 1.00 0.00 H new ATOM 0 HB3 GLU A 137 4.573 -3.070 12.729 1.00 0.00 H new ATOM 0 HG2 GLU A 137 1.596 -2.543 13.093 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.403 -2.350 11.549 1.00 0.00 H new TER 2059 GLU A 137 HETATM 2060 N4 FOP A 138 1.859 -15.542 -11.602 1.00 0.00 N HETATM 2061 C5 FOP A 138 0.700 -14.819 -11.080 1.00 0.00 C HETATM 2062 C6 FOP A 138 -0.007 -15.507 -9.897 1.00 0.00 C HETATM 2063 C7 FOP A 138 -0.720 -16.787 -10.345 1.00 0.00 C HETATM 2064 O7 FOP A 138 0.887 -15.764 -8.828 1.00 0.00 O HETATM 0 H73 FOP A 138 -1.466 -16.542 -11.101 1.00 0.00 H new HETATM 0 H72 FOP A 138 0.008 -17.481 -10.765 1.00 0.00 H new HETATM 0 H71 FOP A 138 -1.209 -17.250 -9.488 1.00 0.00 H new HETATM 0 H6 FOP A 138 -0.764 -14.816 -9.526 1.00 0.00 H new HETATM 0 H52 FOP A 138 1.020 -13.825 -10.767 1.00 0.00 H new HETATM 0 H51 FOP A 138 -0.020 -14.683 -11.887 1.00 0.00 H new HETATM 0 H43 FOP A 138 2.265 -15.020 -12.379 1.00 0.00 H new HETATM 0 H42 FOP A 138 2.555 -15.648 -10.864 1.00 0.00 H new HETATM 0 H41 FOP A 138 1.567 -16.463 -11.928 1.00 0.00 H new HETATM 2074 P DBI A 139 0.209 -16.172 -7.452 1.00 0.00 P HETATM 2075 O1P DBI A 139 -0.181 -17.703 -7.503 1.00 0.00 O HETATM 2076 O2P DBI A 139 1.259 -15.956 -6.291 1.00 0.00 O HETATM 2077 O3' DBI A 139 -1.070 -15.271 -7.182 1.00 0.00 O HETATM 2078 O5' DBI A 139 -4.211 -17.523 -6.534 1.00 0.00 O HETATM 2079 C5' DBI A 139 -4.200 -16.260 -7.150 1.00 0.00 C HETATM 2080 C4' DBI A 139 -3.337 -15.257 -6.376 1.00 0.00 C HETATM 2081 O4' DBI A 139 -3.894 -15.000 -5.103 1.00 0.00 O HETATM 2082 C1' DBI A 139 -2.863 -14.520 -4.261 1.00 0.00 C HETATM 2083 N1 DBI A 139 -2.860 -13.057 -4.246 1.00 0.00 N HETATM 2084 C8 DBI A 139 -3.169 -12.228 -3.173 1.00 0.00 C HETATM 2085 C7 DBI A 139 -3.623 -12.468 -1.907 1.00 0.00 C HETATM 2086 C6 DBI A 139 -3.763 -11.434 -0.974 1.00 0.00 C HETATM 2087 C11 DBI A 139 -4.223 -11.758 0.418 1.00 0.00 C HETATM 2088 C10 DBI A 139 -3.607 -8.944 -0.398 1.00 0.00 C HETATM 2089 C5 DBI A 139 -3.480 -10.114 -1.357 1.00 0.00 C HETATM 2090 C4 DBI A 139 -3.067 -9.877 -2.670 1.00 0.00 C HETATM 2091 C9 DBI A 139 -2.896 -10.895 -3.567 1.00 0.00 C HETATM 2092 N3 DBI A 139 -2.475 -10.938 -4.886 1.00 0.00 N HETATM 2093 C2 DBI A 139 -2.465 -12.240 -5.238 1.00 0.00 C HETATM 2094 C2' DBI A 139 -1.565 -15.188 -4.747 1.00 0.00 C HETATM 2095 O2' DBI A 139 -0.437 -14.344 -4.701 1.00 0.00 O HETATM 2096 C3' DBI A 139 -1.904 -15.721 -6.133 1.00 0.00 C HETATM 0 HO21 DBI A 139 0.313 -14.775 -5.162 1.00 0.00 H new HETATM 0 H5'2 DBI A 139 -3.822 -16.355 -8.168 1.00 0.00 H new HETATM 0 H5'1 DBI A 139 -5.220 -15.882 -7.223 1.00 0.00 H new HETATM 0 H113 DBI A 139 -5.209 -12.220 0.377 1.00 0.00 H new HETATM 0 H112 DBI A 139 -3.518 -12.448 0.883 1.00 0.00 H new HETATM 0 H111 DBI A 139 -4.276 -10.842 1.006 1.00 0.00 H new HETATM 0 H103 DBI A 139 -4.635 -8.875 -0.043 1.00 0.00 H new HETATM 0 H102 DBI A 139 -2.940 -9.095 0.450 1.00 0.00 H new HETATM 0 H101 DBI A 139 -3.337 -8.021 -0.912 1.00 0.00 H new HETATM 0 HO5 DBI A 139 -4.772 -18.136 -7.054 1.00 0.00 H new HETATM 0 H7 DBI A 139 -3.882 -13.486 -1.617 1.00 0.00 H new HETATM 0 H4' DBI A 139 -3.317 -14.370 -7.010 1.00 0.00 H new HETATM 0 H4 DBI A 139 -2.876 -8.852 -2.989 1.00 0.00 H new HETATM 0 H3' DBI A 139 -1.763 -16.802 -6.143 1.00 0.00 H new HETATM 0 H2' DBI A 139 -1.251 -15.994 -4.084 1.00 0.00 H new HETATM 0 H2 DBI A 139 -2.167 -12.593 -6.225 1.00 0.00 H new HETATM 0 H1' DBI A 139 -2.999 -14.784 -3.212 1.00 0.00 H new