USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1236 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 86 ASN : amide:sc= -5.14! C(o=-5.1!,f=-15!) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 49 HIS :FLIP no HE2:sc= -0.235 F(o=-1.6,f=-0.24) USER MOD Set 2.2: A 94 LYS NZ :NH3+ -135:sc=-0.00499 (180deg=0) USER MOD Set 3.1: A 42 HIS : no HD1:sc= 0.0577 K(o=0.058,f=-3.4!) USER MOD Set 3.2: A 44 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 27 ASN :FLIP amide:sc= -3.65! C(o=-13!,f=-7.4!) USER MOD Set 4.2: A 144 HIS :FLIP no HD1:sc= -1.54 F(o=-8.5,f=-7.4) USER MOD Set 4.3: A 148 CYS SG : rot 169:sc= -2.17! USER MOD Set 5.1: A 19 CYS SG : rot 150:sc= 1.07 USER MOD Set 5.2: A 23 LYS NZ :NH3+ -111:sc= 0.721 (180deg=-0.327) USER MOD Single : A 1 GLY N :NH3+ -152:sc= 0.00837 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 MET CE :methyl 152:sc= -0.319 (180deg=-1.36) USER MOD Single : A 11 CYS SG : rot -114:sc= -2.44! USER MOD Single : A 26 ASN : amide:sc= -2.46 X(o=-2.5,f=-2.5!) USER MOD Single : A 35 GLN : amide:sc= -5.63! C(o=-5.6!,f=-5.2!) USER MOD Single : A 37 SER OG : rot -77:sc= -0.138! USER MOD Single : A 41 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.14) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 75:sc= -2.97! USER MOD Single : A 64 THR OG1 : rot 85:sc= -5.66! USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.00021) USER MOD Single : A 74 GLN :FLIP amide:sc= -0.231 F(o=-1.1,f=-0.23) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -144:sc= -4.4! (180deg=-7.49!) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.125 K(o=-0.13,f=-2.5!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 TYR OH : rot 180:sc= -0.829 USER MOD Single : A 104 LYS NZ :NH3+ 138:sc= 0.751 (180deg=-0.293) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 HIS : no HD1:sc= -0.0951 K(o=-0.095,f=-0.66) USER MOD Single : A 116 HIS : no HE2:sc= -4.39! C(o=-4.4!,f=-12!) USER MOD Single : A 117 GLN : amide:sc= -1.49 K(o=-1.5,f=-3.3!) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 CYS SG : rot 180:sc= -3.08 USER MOD Single : A 129 GLN : amide:sc= -7.43! C(o=-7.4!,f=-11!) USER MOD Single : A 132 GLN :FLIP amide:sc= -0.0305 F(o=-1.7!,f=-0.031) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl -152:sc= -0.927 (180deg=-3.05) USER MOD Single : A 137 LYS NZ :NH3+ -164:sc= -1.48 (180deg=-1.73!) USER MOD Single : A 141 GLN :FLIP amide:sc= -1.15 F(o=-3.8!,f=-1.2) USER MOD Single : A 145 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.18) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.445 -4.643 -6.115 1.00 0.00 N ATOM 2 CA GLY A 1 19.089 -5.912 -5.840 1.00 0.00 C ATOM 3 C GLY A 1 18.341 -6.655 -4.742 1.00 0.00 C ATOM 4 O GLY A 1 17.114 -6.720 -4.757 1.00 0.00 O ATOM 0 H1 GLY A 1 18.621 -4.371 -7.103 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.421 -4.732 -5.958 1.00 0.00 H new ATOM 0 H3 GLY A 1 18.830 -3.914 -5.481 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.116 -6.518 -6.746 1.00 0.00 H new ATOM 0 HA3 GLY A 1 20.123 -5.745 -5.537 1.00 0.00 H new ATOM 8 N PRO A 2 19.086 -7.217 -3.787 1.00 0.00 N ATOM 9 CA PRO A 2 18.551 -7.965 -2.670 1.00 0.00 C ATOM 10 C PRO A 2 17.887 -7.010 -1.688 1.00 0.00 C ATOM 11 O PRO A 2 17.276 -7.445 -0.714 1.00 0.00 O ATOM 12 CB PRO A 2 19.764 -8.644 -2.037 1.00 0.00 C ATOM 13 CG PRO A 2 20.898 -7.667 -2.345 1.00 0.00 C ATOM 14 CD PRO A 2 20.531 -7.156 -3.736 1.00 0.00 C ATOM 0 HA PRO A 2 17.795 -8.692 -2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 2 19.633 -8.787 -0.964 1.00 0.00 H new ATOM 0 HB3 PRO A 2 19.949 -9.627 -2.470 1.00 0.00 H new ATOM 0 HG2 PRO A 2 20.945 -6.858 -1.616 1.00 0.00 H new ATOM 0 HG3 PRO A 2 21.870 -8.160 -2.338 1.00 0.00 H new ATOM 0 HD2 PRO A 2 20.889 -6.138 -3.890 1.00 0.00 H new ATOM 0 HD3 PRO A 2 20.980 -7.773 -4.514 1.00 0.00 H new ATOM 22 N LEU A 3 17.980 -5.734 -1.901 1.00 0.00 N ATOM 23 CA LEU A 3 17.350 -4.756 -0.970 1.00 0.00 C ATOM 24 C LEU A 3 15.864 -4.625 -1.298 1.00 0.00 C ATOM 25 O LEU A 3 15.480 -4.445 -2.438 1.00 0.00 O ATOM 26 CB LEU A 3 18.029 -3.396 -1.137 1.00 0.00 C ATOM 27 CG LEU A 3 17.440 -2.399 -0.138 1.00 0.00 C ATOM 28 CD1 LEU A 3 17.933 -2.722 1.275 1.00 0.00 C ATOM 29 CD2 LEU A 3 17.878 -0.984 -0.520 1.00 0.00 C ATOM 0 H LEU A 3 18.472 -5.317 -2.691 1.00 0.00 H new ATOM 0 HA LEU A 3 17.465 -5.101 0.057 1.00 0.00 H new ATOM 0 HB2 LEU A 3 19.103 -3.493 -0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 3 17.889 -3.031 -2.155 1.00 0.00 H new ATOM 0 HG LEU A 3 16.352 -2.467 -0.160 1.00 0.00 H new ATOM 0 HD11 LEU A 3 17.509 -2.007 1.980 1.00 0.00 H new ATOM 0 HD12 LEU A 3 17.621 -3.730 1.548 1.00 0.00 H new ATOM 0 HD13 LEU A 3 19.021 -2.659 1.304 1.00 0.00 H new ATOM 0 HD21 LEU A 3 17.460 -0.270 0.190 1.00 0.00 H new ATOM 0 HD22 LEU A 3 18.966 -0.922 -0.499 1.00 0.00 H new ATOM 0 HD23 LEU A 3 17.520 -0.751 -1.523 1.00 0.00 H new ATOM 41 N GLY A 4 15.020 -4.708 -0.306 1.00 0.00 N ATOM 42 CA GLY A 4 13.557 -4.582 -0.554 1.00 0.00 C ATOM 43 C GLY A 4 12.926 -5.974 -0.628 1.00 0.00 C ATOM 44 O GLY A 4 11.718 -6.118 -0.645 1.00 0.00 O ATOM 0 H GLY A 4 15.282 -4.858 0.668 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.092 -4.003 0.243 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.381 -4.042 -1.484 1.00 0.00 H new ATOM 48 N SER A 5 13.730 -7.000 -0.667 1.00 0.00 N ATOM 49 CA SER A 5 13.169 -8.379 -0.735 1.00 0.00 C ATOM 50 C SER A 5 12.868 -8.871 0.682 1.00 0.00 C ATOM 51 O SER A 5 12.346 -9.951 0.877 1.00 0.00 O ATOM 52 CB SER A 5 14.184 -9.313 -1.395 1.00 0.00 C ATOM 53 OG SER A 5 14.384 -8.914 -2.744 1.00 0.00 O ATOM 0 H SER A 5 14.748 -6.944 -0.655 1.00 0.00 H new ATOM 0 HA SER A 5 12.251 -8.371 -1.323 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.128 -9.284 -0.852 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.826 -10.342 -1.358 1.00 0.00 H new ATOM 0 HG SER A 5 15.036 -9.510 -3.168 1.00 0.00 H new ATOM 59 N MET A 6 13.194 -8.089 1.674 1.00 0.00 N ATOM 60 CA MET A 6 12.931 -8.513 3.078 1.00 0.00 C ATOM 61 C MET A 6 11.640 -7.869 3.584 1.00 0.00 C ATOM 62 O MET A 6 10.995 -7.106 2.890 1.00 0.00 O ATOM 63 CB MET A 6 14.094 -8.075 3.973 1.00 0.00 C ATOM 64 CG MET A 6 14.354 -9.148 5.029 1.00 0.00 C ATOM 65 SD MET A 6 15.367 -8.455 6.358 1.00 0.00 S ATOM 66 CE MET A 6 14.101 -7.378 7.074 1.00 0.00 C ATOM 0 H MET A 6 13.632 -7.173 1.573 1.00 0.00 H new ATOM 0 HA MET A 6 12.831 -9.598 3.107 1.00 0.00 H new ATOM 0 HB2 MET A 6 14.990 -7.916 3.372 1.00 0.00 H new ATOM 0 HB3 MET A 6 13.860 -7.125 4.454 1.00 0.00 H new ATOM 0 HG2 MET A 6 13.409 -9.514 5.431 1.00 0.00 H new ATOM 0 HG3 MET A 6 14.861 -10.001 4.578 1.00 0.00 H new ATOM 0 HE1 MET A 6 14.301 -7.238 8.136 1.00 0.00 H new ATOM 0 HE2 MET A 6 14.119 -6.411 6.571 1.00 0.00 H new ATOM 0 HE3 MET A 6 13.120 -7.835 6.947 1.00 0.00 H new ATOM 76 N ALA A 7 11.264 -8.166 4.798 1.00 0.00 N ATOM 77 CA ALA A 7 10.023 -7.571 5.371 1.00 0.00 C ATOM 78 C ALA A 7 8.805 -8.023 4.572 1.00 0.00 C ATOM 79 O ALA A 7 8.912 -8.504 3.462 1.00 0.00 O ATOM 80 CB ALA A 7 10.121 -6.045 5.335 1.00 0.00 C ATOM 0 H ALA A 7 11.766 -8.799 5.421 1.00 0.00 H new ATOM 0 HA ALA A 7 9.915 -7.906 6.403 1.00 0.00 H new ATOM 0 HB1 ALA A 7 9.213 -5.612 5.754 1.00 0.00 H new ATOM 0 HB2 ALA A 7 10.981 -5.722 5.921 1.00 0.00 H new ATOM 0 HB3 ALA A 7 10.239 -5.712 4.304 1.00 0.00 H new ATOM 86 N LEU A 8 7.643 -7.877 5.145 1.00 0.00 N ATOM 87 CA LEU A 8 6.401 -8.304 4.442 1.00 0.00 C ATOM 88 C LEU A 8 5.729 -7.089 3.796 1.00 0.00 C ATOM 89 O LEU A 8 5.659 -6.024 4.377 1.00 0.00 O ATOM 90 CB LEU A 8 5.433 -8.919 5.455 1.00 0.00 C ATOM 91 CG LEU A 8 6.199 -9.793 6.453 1.00 0.00 C ATOM 92 CD1 LEU A 8 7.006 -8.908 7.406 1.00 0.00 C ATOM 93 CD2 LEU A 8 5.200 -10.611 7.269 1.00 0.00 C ATOM 0 H LEU A 8 7.499 -7.479 6.073 1.00 0.00 H new ATOM 0 HA LEU A 8 6.657 -9.035 3.675 1.00 0.00 H new ATOM 0 HB2 LEU A 8 4.900 -8.130 5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.684 -9.517 4.937 1.00 0.00 H new ATOM 0 HG LEU A 8 6.874 -10.453 5.909 1.00 0.00 H new ATOM 0 HD11 LEU A 8 7.549 -9.535 8.113 1.00 0.00 H new ATOM 0 HD12 LEU A 8 7.715 -8.309 6.834 1.00 0.00 H new ATOM 0 HD13 LEU A 8 6.330 -8.248 7.950 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.738 -11.236 7.982 1.00 0.00 H new ATOM 0 HD22 LEU A 8 4.533 -9.938 7.807 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.616 -11.243 6.601 1.00 0.00 H new ATOM 105 N ARG A 9 5.221 -7.242 2.603 1.00 0.00 N ATOM 106 CA ARG A 9 4.537 -6.099 1.934 1.00 0.00 C ATOM 107 C ARG A 9 3.087 -6.053 2.421 1.00 0.00 C ATOM 108 O ARG A 9 2.428 -7.069 2.520 1.00 0.00 O ATOM 109 CB ARG A 9 4.571 -6.299 0.417 1.00 0.00 C ATOM 110 CG ARG A 9 4.164 -5.002 -0.281 1.00 0.00 C ATOM 111 CD ARG A 9 4.174 -5.215 -1.797 1.00 0.00 C ATOM 112 NE ARG A 9 5.550 -5.593 -2.230 1.00 0.00 N ATOM 113 CZ ARG A 9 5.755 -6.053 -3.434 1.00 0.00 C ATOM 114 NH1 ARG A 9 4.758 -6.172 -4.267 1.00 0.00 N ATOM 115 NH2 ARG A 9 6.960 -6.388 -3.803 1.00 0.00 N ATOM 0 H ARG A 9 5.250 -8.107 2.064 1.00 0.00 H new ATOM 0 HA ARG A 9 5.040 -5.163 2.176 1.00 0.00 H new ATOM 0 HB2 ARG A 9 5.572 -6.595 0.102 1.00 0.00 H new ATOM 0 HB3 ARG A 9 3.895 -7.105 0.131 1.00 0.00 H new ATOM 0 HG2 ARG A 9 3.171 -4.696 0.048 1.00 0.00 H new ATOM 0 HG3 ARG A 9 4.851 -4.200 -0.011 1.00 0.00 H new ATOM 0 HD2 ARG A 9 3.466 -5.997 -2.071 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.857 -4.305 -2.306 1.00 0.00 H new ATOM 0 HE ARG A 9 6.333 -5.492 -1.584 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.817 -5.905 -3.978 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.920 -6.532 -5.208 1.00 0.00 H new ATOM 0 HH21 ARG A 9 7.739 -6.290 -3.151 1.00 0.00 H new ATOM 0 HH22 ARG A 9 7.124 -6.748 -4.743 1.00 0.00 H new ATOM 129 N ALA A 10 2.583 -4.892 2.742 1.00 0.00 N ATOM 130 CA ALA A 10 1.180 -4.815 3.239 1.00 0.00 C ATOM 131 C ALA A 10 0.511 -3.535 2.749 1.00 0.00 C ATOM 132 O ALA A 10 1.161 -2.566 2.410 1.00 0.00 O ATOM 133 CB ALA A 10 1.186 -4.807 4.764 1.00 0.00 C ATOM 0 H ALA A 10 3.077 -4.001 2.682 1.00 0.00 H new ATOM 0 HA ALA A 10 0.629 -5.677 2.864 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.161 -4.751 5.132 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.653 -5.721 5.131 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.747 -3.944 5.121 1.00 0.00 H new ATOM 139 N CYS A 11 -0.791 -3.526 2.723 1.00 0.00 N ATOM 140 CA CYS A 11 -1.513 -2.310 2.272 1.00 0.00 C ATOM 141 C CYS A 11 -2.847 -2.210 3.013 1.00 0.00 C ATOM 142 O CYS A 11 -3.660 -3.112 2.973 1.00 0.00 O ATOM 143 CB CYS A 11 -1.771 -2.406 0.770 1.00 0.00 C ATOM 144 SG CYS A 11 -0.456 -1.542 -0.123 1.00 0.00 S ATOM 0 H CYS A 11 -1.385 -4.309 2.995 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.912 -1.426 2.483 1.00 0.00 H new ATOM 0 HB2 CYS A 11 -1.808 -3.451 0.462 1.00 0.00 H new ATOM 0 HB3 CYS A 11 -2.739 -1.968 0.528 1.00 0.00 H new ATOM 0 HG CYS A 11 -0.953 -0.508 -0.735 1.00 0.00 H new ATOM 150 N GLY A 12 -3.079 -1.117 3.684 1.00 0.00 N ATOM 151 CA GLY A 12 -4.361 -0.943 4.422 1.00 0.00 C ATOM 152 C GLY A 12 -5.015 0.358 3.968 1.00 0.00 C ATOM 153 O GLY A 12 -4.479 1.066 3.140 1.00 0.00 O ATOM 0 H GLY A 12 -2.432 -0.332 3.753 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -5.025 -1.786 4.230 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.178 -0.919 5.496 1.00 0.00 H new ATOM 157 N LEU A 13 -6.172 0.680 4.482 1.00 0.00 N ATOM 158 CA LEU A 13 -6.837 1.936 4.037 1.00 0.00 C ATOM 159 C LEU A 13 -7.140 2.853 5.220 1.00 0.00 C ATOM 160 O LEU A 13 -7.944 2.534 6.074 1.00 0.00 O ATOM 161 CB LEU A 13 -8.169 1.600 3.346 1.00 0.00 C ATOM 162 CG LEU A 13 -8.054 1.799 1.834 1.00 0.00 C ATOM 163 CD1 LEU A 13 -9.427 1.633 1.183 1.00 0.00 C ATOM 164 CD2 LEU A 13 -7.538 3.203 1.534 1.00 0.00 C ATOM 0 H LEU A 13 -6.678 0.136 5.181 1.00 0.00 H new ATOM 0 HA LEU A 13 -6.158 2.443 3.351 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.448 0.569 3.563 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -8.961 2.235 3.743 1.00 0.00 H new ATOM 0 HG LEU A 13 -7.362 1.057 1.435 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.339 1.776 0.106 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.807 0.632 1.386 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -10.115 2.373 1.592 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -7.458 3.339 0.455 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -8.230 3.940 1.942 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -6.557 3.335 1.990 1.00 0.00 H new ATOM 176 N ILE A 14 -6.566 4.025 5.237 1.00 0.00 N ATOM 177 CA ILE A 14 -6.900 4.983 6.318 1.00 0.00 C ATOM 178 C ILE A 14 -8.176 5.677 5.865 1.00 0.00 C ATOM 179 O ILE A 14 -8.158 6.601 5.076 1.00 0.00 O ATOM 180 CB ILE A 14 -5.770 5.997 6.521 1.00 0.00 C ATOM 181 CG1 ILE A 14 -4.588 5.297 7.199 1.00 0.00 C ATOM 182 CG2 ILE A 14 -6.258 7.143 7.408 1.00 0.00 C ATOM 183 CD1 ILE A 14 -3.392 6.248 7.266 1.00 0.00 C ATOM 0 H ILE A 14 -5.886 4.355 4.553 1.00 0.00 H new ATOM 0 HA ILE A 14 -7.033 4.478 7.275 1.00 0.00 H new ATOM 0 HB ILE A 14 -5.461 6.398 5.556 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -4.869 4.980 8.203 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.319 4.398 6.644 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -5.451 7.862 7.550 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -7.105 7.637 6.931 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -6.566 6.748 8.376 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -2.554 5.745 7.749 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -3.105 6.543 6.257 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -3.663 7.134 7.840 1.00 0.00 H new ATOM 195 N ILE A 15 -9.285 5.183 6.317 1.00 0.00 N ATOM 196 CA ILE A 15 -10.594 5.730 5.887 1.00 0.00 C ATOM 197 C ILE A 15 -10.978 6.937 6.729 1.00 0.00 C ATOM 198 O ILE A 15 -10.780 6.964 7.926 1.00 0.00 O ATOM 199 CB ILE A 15 -11.622 4.622 6.065 1.00 0.00 C ATOM 200 CG1 ILE A 15 -11.219 3.441 5.180 1.00 0.00 C ATOM 201 CG2 ILE A 15 -13.018 5.114 5.682 1.00 0.00 C ATOM 202 CD1 ILE A 15 -11.993 2.194 5.596 1.00 0.00 C ATOM 0 H ILE A 15 -9.342 4.409 6.979 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.545 6.058 4.849 1.00 0.00 H new ATOM 0 HB ILE A 15 -11.651 4.315 7.110 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -11.421 3.673 4.134 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -10.147 3.260 5.265 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -13.738 4.307 5.816 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -13.294 5.956 6.317 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -13.019 5.431 4.639 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -11.702 1.357 4.962 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -11.769 1.957 6.636 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -13.062 2.376 5.488 1.00 0.00 H new ATOM 214 N PHE A 16 -11.535 7.937 6.102 1.00 0.00 N ATOM 215 CA PHE A 16 -11.944 9.145 6.856 1.00 0.00 C ATOM 216 C PHE A 16 -13.292 9.648 6.337 1.00 0.00 C ATOM 217 O PHE A 16 -13.439 9.963 5.174 1.00 0.00 O ATOM 218 CB PHE A 16 -10.890 10.233 6.668 1.00 0.00 C ATOM 219 CG PHE A 16 -10.907 10.718 5.236 1.00 0.00 C ATOM 220 CD1 PHE A 16 -10.114 10.081 4.273 1.00 0.00 C ATOM 221 CD2 PHE A 16 -11.709 11.807 4.870 1.00 0.00 C ATOM 222 CE1 PHE A 16 -10.122 10.530 2.947 1.00 0.00 C ATOM 223 CE2 PHE A 16 -11.718 12.256 3.543 1.00 0.00 C ATOM 224 CZ PHE A 16 -10.924 11.618 2.583 1.00 0.00 C ATOM 0 H PHE A 16 -11.723 7.965 5.100 1.00 0.00 H new ATOM 0 HA PHE A 16 -12.037 8.899 7.914 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -11.086 11.064 7.346 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -9.903 9.844 6.918 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.495 9.242 4.554 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -12.320 12.300 5.611 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.510 10.038 2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -12.338 13.094 3.261 1.00 0.00 H new ATOM 0 HZ PHE A 16 -10.930 11.965 1.560 1.00 0.00 H new ATOM 234 N ARG A 17 -14.275 9.746 7.191 1.00 0.00 N ATOM 235 CA ARG A 17 -15.601 10.250 6.732 1.00 0.00 C ATOM 236 C ARG A 17 -15.619 11.770 6.878 1.00 0.00 C ATOM 237 O ARG A 17 -15.580 12.296 7.972 1.00 0.00 O ATOM 238 CB ARG A 17 -16.714 9.645 7.592 1.00 0.00 C ATOM 239 CG ARG A 17 -18.026 9.613 6.798 1.00 0.00 C ATOM 240 CD ARG A 17 -18.486 11.040 6.490 1.00 0.00 C ATOM 241 NE ARG A 17 -19.856 11.003 5.901 1.00 0.00 N ATOM 242 CZ ARG A 17 -20.032 10.562 4.685 1.00 0.00 C ATOM 243 NH1 ARG A 17 -19.010 10.145 3.988 1.00 0.00 N ATOM 244 NH2 ARG A 17 -21.231 10.536 4.168 1.00 0.00 N ATOM 0 H ARG A 17 -14.218 9.501 8.179 1.00 0.00 H new ATOM 0 HA ARG A 17 -15.763 9.967 5.692 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -16.440 8.636 7.900 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -16.843 10.232 8.501 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -17.886 9.059 5.870 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -18.793 9.090 7.369 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -18.486 11.638 7.401 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -17.793 11.516 5.796 1.00 0.00 H new ATOM 0 HE ARG A 17 -20.655 11.322 6.448 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -18.074 10.164 4.394 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -19.147 9.800 3.038 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -22.029 10.860 4.714 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -21.369 10.192 3.218 1.00 0.00 H new ATOM 258 N ARG A 18 -15.679 12.482 5.788 1.00 0.00 N ATOM 259 CA ARG A 18 -15.695 13.968 5.877 1.00 0.00 C ATOM 260 C ARG A 18 -17.130 14.449 6.096 1.00 0.00 C ATOM 261 O ARG A 18 -18.054 13.994 5.452 1.00 0.00 O ATOM 262 CB ARG A 18 -15.142 14.566 4.583 1.00 0.00 C ATOM 263 CG ARG A 18 -14.962 16.075 4.755 1.00 0.00 C ATOM 264 CD ARG A 18 -14.452 16.677 3.446 1.00 0.00 C ATOM 265 NE ARG A 18 -13.135 16.068 3.100 1.00 0.00 N ATOM 266 CZ ARG A 18 -12.337 16.670 2.262 1.00 0.00 C ATOM 267 NH1 ARG A 18 -12.692 17.807 1.725 1.00 0.00 N ATOM 268 NH2 ARG A 18 -11.183 16.141 1.961 1.00 0.00 N ATOM 0 H ARG A 18 -15.718 12.101 4.843 1.00 0.00 H new ATOM 0 HA ARG A 18 -15.074 14.289 6.714 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.188 14.101 4.334 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -15.822 14.362 3.756 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -15.909 16.536 5.036 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.257 16.279 5.561 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -15.170 16.496 2.646 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.350 17.758 3.545 1.00 0.00 H new ATOM 0 HE ARG A 18 -12.858 15.180 3.519 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -13.593 18.223 1.961 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -12.068 18.278 1.070 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -10.903 15.255 2.381 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -10.561 16.614 1.305 1.00 0.00 H new ATOM 282 N CYS A 19 -17.320 15.366 7.003 1.00 0.00 N ATOM 283 CA CYS A 19 -18.692 15.878 7.268 1.00 0.00 C ATOM 284 C CYS A 19 -18.909 17.168 6.476 1.00 0.00 C ATOM 285 O CYS A 19 -18.026 17.994 6.361 1.00 0.00 O ATOM 286 CB CYS A 19 -18.847 16.164 8.764 1.00 0.00 C ATOM 287 SG CYS A 19 -20.404 15.454 9.354 1.00 0.00 S ATOM 0 H CYS A 19 -16.584 15.783 7.572 1.00 0.00 H new ATOM 0 HA CYS A 19 -19.428 15.134 6.963 1.00 0.00 H new ATOM 0 HB2 CYS A 19 -18.009 15.739 9.316 1.00 0.00 H new ATOM 0 HB3 CYS A 19 -18.834 17.239 8.943 1.00 0.00 H new ATOM 0 HG CYS A 19 -20.280 15.114 10.603 1.00 0.00 H new ATOM 293 N LEU A 20 -20.078 17.349 5.923 1.00 0.00 N ATOM 294 CA LEU A 20 -20.341 18.586 5.135 1.00 0.00 C ATOM 295 C LEU A 20 -19.999 19.804 5.989 1.00 0.00 C ATOM 296 O LEU A 20 -19.382 20.746 5.531 1.00 0.00 O ATOM 297 CB LEU A 20 -21.820 18.632 4.757 1.00 0.00 C ATOM 298 CG LEU A 20 -22.215 17.317 4.086 1.00 0.00 C ATOM 299 CD1 LEU A 20 -23.694 17.366 3.696 1.00 0.00 C ATOM 300 CD2 LEU A 20 -21.367 17.104 2.830 1.00 0.00 C ATOM 0 H LEU A 20 -20.859 16.696 5.983 1.00 0.00 H new ATOM 0 HA LEU A 20 -19.731 18.588 4.232 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -22.429 18.796 5.646 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -22.008 19.468 4.083 1.00 0.00 H new ATOM 0 HG LEU A 20 -22.047 16.494 4.781 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -23.975 16.428 3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -24.301 17.514 4.589 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -23.860 18.191 3.003 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -21.651 16.166 2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -21.532 17.928 2.136 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -20.313 17.067 3.105 1.00 0.00 H new ATOM 312 N ILE A 21 -20.385 19.787 7.235 1.00 0.00 N ATOM 313 CA ILE A 21 -20.074 20.939 8.126 1.00 0.00 C ATOM 314 C ILE A 21 -19.752 20.421 9.533 1.00 0.00 C ATOM 315 O ILE A 21 -20.001 19.275 9.848 1.00 0.00 O ATOM 316 CB ILE A 21 -21.268 21.897 8.183 1.00 0.00 C ATOM 317 CG1 ILE A 21 -22.514 21.212 7.614 1.00 0.00 C ATOM 318 CG2 ILE A 21 -20.956 23.145 7.352 1.00 0.00 C ATOM 319 CD1 ILE A 21 -22.932 20.065 8.536 1.00 0.00 C ATOM 0 H ILE A 21 -20.902 19.025 7.674 1.00 0.00 H new ATOM 0 HA ILE A 21 -19.212 21.477 7.731 1.00 0.00 H new ATOM 0 HB ILE A 21 -21.453 22.178 9.220 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -23.327 21.932 7.520 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -22.308 20.832 6.613 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -21.804 23.829 7.390 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -20.072 23.639 7.756 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -20.769 22.856 6.318 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -23.819 19.577 8.131 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -22.120 19.341 8.607 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -23.155 20.458 9.528 1.00 0.00 H new ATOM 331 N PRO A 22 -19.192 21.256 10.369 1.00 0.00 N ATOM 332 CA PRO A 22 -18.817 20.877 11.768 1.00 0.00 C ATOM 333 C PRO A 22 -20.014 20.426 12.616 1.00 0.00 C ATOM 334 O PRO A 22 -21.142 20.809 12.376 1.00 0.00 O ATOM 335 CB PRO A 22 -18.227 22.162 12.359 1.00 0.00 C ATOM 336 CG PRO A 22 -17.880 23.027 11.195 1.00 0.00 C ATOM 337 CD PRO A 22 -18.848 22.658 10.078 1.00 0.00 C ATOM 0 HA PRO A 22 -18.131 20.030 11.764 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -18.945 22.657 13.013 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -17.345 21.945 12.961 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -17.971 24.082 11.455 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -16.848 22.863 10.884 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -19.731 23.297 10.085 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -18.386 22.762 9.096 1.00 0.00 H new ATOM 345 N LYS A 23 -19.764 19.623 13.619 1.00 0.00 N ATOM 346 CA LYS A 23 -20.867 19.152 14.508 1.00 0.00 C ATOM 347 C LYS A 23 -20.456 19.378 15.964 1.00 0.00 C ATOM 348 O LYS A 23 -20.852 20.342 16.591 1.00 0.00 O ATOM 349 CB LYS A 23 -21.109 17.656 14.276 1.00 0.00 C ATOM 350 CG LYS A 23 -21.295 17.390 12.779 1.00 0.00 C ATOM 351 CD LYS A 23 -22.615 17.998 12.300 1.00 0.00 C ATOM 352 CE LYS A 23 -22.750 17.781 10.795 1.00 0.00 C ATOM 353 NZ LYS A 23 -22.910 16.327 10.510 1.00 0.00 N ATOM 0 H LYS A 23 -18.837 19.272 13.861 1.00 0.00 H new ATOM 0 HA LYS A 23 -21.781 19.703 14.287 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -20.267 17.078 14.656 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -21.992 17.331 14.826 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -20.463 17.818 12.219 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -21.289 16.317 12.588 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -23.453 17.536 12.823 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -22.643 19.063 12.530 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -23.609 18.333 10.414 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -21.870 18.167 10.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -22.058 15.971 10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -23.046 15.811 11.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -23.738 16.182 9.897 1.00 0.00 H new ATOM 367 N VAL A 24 -19.654 18.503 16.499 1.00 0.00 N ATOM 368 CA VAL A 24 -19.194 18.660 17.909 1.00 0.00 C ATOM 369 C VAL A 24 -18.214 19.834 17.986 1.00 0.00 C ATOM 370 O VAL A 24 -17.723 20.177 19.043 1.00 0.00 O ATOM 371 CB VAL A 24 -18.494 17.378 18.364 1.00 0.00 C ATOM 372 CG1 VAL A 24 -17.936 17.569 19.777 1.00 0.00 C ATOM 373 CG2 VAL A 24 -19.499 16.225 18.369 1.00 0.00 C ATOM 0 H VAL A 24 -19.294 17.679 16.018 1.00 0.00 H new ATOM 0 HA VAL A 24 -20.049 18.851 18.557 1.00 0.00 H new ATOM 0 HB VAL A 24 -17.677 17.151 17.679 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -17.438 16.654 20.098 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -17.220 18.391 19.778 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -18.752 17.798 20.463 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -19.002 15.311 18.693 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -20.315 16.457 19.054 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -19.897 16.085 17.364 1.00 0.00 H new ATOM 383 N ASP A 25 -17.915 20.437 16.867 1.00 0.00 N ATOM 384 CA ASP A 25 -16.956 21.581 16.850 1.00 0.00 C ATOM 385 C ASP A 25 -15.585 21.101 17.328 1.00 0.00 C ATOM 386 O ASP A 25 -14.914 21.761 18.095 1.00 0.00 O ATOM 387 CB ASP A 25 -17.461 22.701 17.763 1.00 0.00 C ATOM 388 CG ASP A 25 -18.776 23.253 17.214 1.00 0.00 C ATOM 389 OD1 ASP A 25 -19.477 23.913 17.962 1.00 0.00 O ATOM 390 OD2 ASP A 25 -19.060 23.008 16.053 1.00 0.00 O ATOM 0 H ASP A 25 -18.297 20.184 15.956 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.872 21.966 15.834 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -17.608 22.322 18.774 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -16.718 23.496 17.825 1.00 0.00 H new ATOM 396 N ASN A 26 -15.166 19.954 16.870 1.00 0.00 N ATOM 397 CA ASN A 26 -13.838 19.418 17.278 1.00 0.00 C ATOM 398 C ASN A 26 -13.089 18.951 16.031 1.00 0.00 C ATOM 399 O ASN A 26 -12.280 19.665 15.475 1.00 0.00 O ATOM 400 CB ASN A 26 -14.033 18.239 18.235 1.00 0.00 C ATOM 401 CG ASN A 26 -12.706 17.909 18.918 1.00 0.00 C ATOM 402 OD1 ASN A 26 -11.838 18.754 19.025 1.00 0.00 O ATOM 403 ND2 ASN A 26 -12.506 16.709 19.387 1.00 0.00 N ATOM 0 H ASN A 26 -15.690 19.361 16.226 1.00 0.00 H new ATOM 0 HA ASN A 26 -13.264 20.195 17.783 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -14.787 18.485 18.983 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.398 17.370 17.688 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -11.623 16.480 19.843 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -13.233 15.999 19.298 1.00 0.00 H new ATOM 410 N ASN A 27 -13.363 17.758 15.582 1.00 0.00 N ATOM 411 CA ASN A 27 -12.679 17.242 14.364 1.00 0.00 C ATOM 412 C ASN A 27 -13.701 17.114 13.231 1.00 0.00 C ATOM 413 O ASN A 27 -14.621 16.322 13.299 1.00 0.00 O ATOM 414 CB ASN A 27 -12.067 15.872 14.657 1.00 0.00 C ATOM 415 CG ASN A 27 -10.985 15.561 13.620 1.00 0.00 C ATOM 416 OD1 ASN A 27 -10.704 14.320 13.338 1.00 0.00 O flip ATOM 417 ND2 ASN A 27 -10.391 16.462 13.058 1.00 0.00 N flip ATOM 0 H ASN A 27 -14.033 17.117 16.007 1.00 0.00 H new ATOM 0 HA ASN A 27 -11.888 17.932 14.070 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -11.639 15.861 15.659 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -12.840 15.104 14.632 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -10.611 17.433 13.279 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -9.673 16.246 12.366 1.00 0.00 H new ATOM 424 N ALA A 28 -13.552 17.888 12.194 1.00 0.00 N ATOM 425 CA ALA A 28 -14.517 17.813 11.061 1.00 0.00 C ATOM 426 C ALA A 28 -14.407 16.452 10.374 1.00 0.00 C ATOM 427 O ALA A 28 -15.332 15.995 9.731 1.00 0.00 O ATOM 428 CB ALA A 28 -14.192 18.906 10.045 1.00 0.00 C ATOM 0 H ALA A 28 -12.803 18.571 12.081 1.00 0.00 H new ATOM 0 HA ALA A 28 -15.528 17.948 11.445 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -14.897 18.853 9.215 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -14.268 19.882 10.524 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -13.179 18.764 9.670 1.00 0.00 H new ATOM 434 N ILE A 29 -13.276 15.816 10.480 1.00 0.00 N ATOM 435 CA ILE A 29 -13.097 14.500 9.807 1.00 0.00 C ATOM 436 C ILE A 29 -12.966 13.371 10.834 1.00 0.00 C ATOM 437 O ILE A 29 -12.328 13.510 11.856 1.00 0.00 O ATOM 438 CB ILE A 29 -11.839 14.562 8.944 1.00 0.00 C ATOM 439 CG1 ILE A 29 -12.063 15.559 7.808 1.00 0.00 C ATOM 440 CG2 ILE A 29 -11.544 13.186 8.362 1.00 0.00 C ATOM 441 CD1 ILE A 29 -10.767 16.321 7.524 1.00 0.00 C ATOM 0 H ILE A 29 -12.467 16.150 11.004 1.00 0.00 H new ATOM 0 HA ILE A 29 -13.971 14.292 9.190 1.00 0.00 H new ATOM 0 HB ILE A 29 -10.993 14.880 9.554 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -12.391 15.034 6.911 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -12.855 16.258 8.076 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -10.645 13.236 7.747 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -11.390 12.474 9.172 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -12.385 12.862 7.749 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -10.932 17.030 6.713 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.458 16.859 8.420 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.986 15.617 7.236 1.00 0.00 H new ATOM 453 N GLU A 30 -13.563 12.245 10.543 1.00 0.00 N ATOM 454 CA GLU A 30 -13.485 11.077 11.472 1.00 0.00 C ATOM 455 C GLU A 30 -12.832 9.910 10.728 1.00 0.00 C ATOM 456 O GLU A 30 -12.780 9.903 9.518 1.00 0.00 O ATOM 457 CB GLU A 30 -14.895 10.678 11.913 1.00 0.00 C ATOM 458 CG GLU A 30 -15.576 11.865 12.600 1.00 0.00 C ATOM 459 CD GLU A 30 -16.958 11.439 13.096 1.00 0.00 C ATOM 460 OE1 GLU A 30 -17.392 10.358 12.731 1.00 0.00 O ATOM 461 OE2 GLU A 30 -17.562 12.200 13.834 1.00 0.00 O ATOM 0 H GLU A 30 -14.106 12.083 9.695 1.00 0.00 H new ATOM 0 HA GLU A 30 -12.897 11.337 12.353 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -15.480 10.360 11.050 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -14.847 9.829 12.595 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.969 12.213 13.436 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -15.668 12.699 11.904 1.00 0.00 H new ATOM 469 N PHE A 31 -12.323 8.928 11.428 1.00 0.00 N ATOM 470 CA PHE A 31 -11.665 7.782 10.727 1.00 0.00 C ATOM 471 C PHE A 31 -12.330 6.457 11.117 1.00 0.00 C ATOM 472 O PHE A 31 -12.894 6.321 12.184 1.00 0.00 O ATOM 473 CB PHE A 31 -10.184 7.730 11.113 1.00 0.00 C ATOM 474 CG PHE A 31 -9.510 9.029 10.733 1.00 0.00 C ATOM 475 CD1 PHE A 31 -9.111 9.255 9.409 1.00 0.00 C ATOM 476 CD2 PHE A 31 -9.277 10.009 11.709 1.00 0.00 C ATOM 477 CE1 PHE A 31 -8.483 10.457 9.061 1.00 0.00 C ATOM 478 CE2 PHE A 31 -8.648 11.210 11.359 1.00 0.00 C ATOM 479 CZ PHE A 31 -8.252 11.434 10.036 1.00 0.00 C ATOM 0 H PHE A 31 -12.334 8.869 12.446 1.00 0.00 H new ATOM 0 HA PHE A 31 -11.768 7.928 9.652 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -10.084 7.558 12.185 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -9.696 6.896 10.609 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -9.288 8.501 8.656 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -9.583 9.837 12.730 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -8.177 10.630 8.040 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -8.468 11.964 12.111 1.00 0.00 H new ATOM 0 HZ PHE A 31 -7.768 12.361 9.767 1.00 0.00 H new ATOM 489 N LEU A 32 -12.243 5.470 10.258 1.00 0.00 N ATOM 490 CA LEU A 32 -12.842 4.140 10.576 1.00 0.00 C ATOM 491 C LEU A 32 -11.816 3.315 11.351 1.00 0.00 C ATOM 492 O LEU A 32 -10.686 3.160 10.931 1.00 0.00 O ATOM 493 CB LEU A 32 -13.213 3.402 9.281 1.00 0.00 C ATOM 494 CG LEU A 32 -13.661 1.974 9.611 1.00 0.00 C ATOM 495 CD1 LEU A 32 -14.864 2.018 10.551 1.00 0.00 C ATOM 496 CD2 LEU A 32 -14.059 1.251 8.323 1.00 0.00 C ATOM 0 H LEU A 32 -11.782 5.530 9.350 1.00 0.00 H new ATOM 0 HA LEU A 32 -13.744 4.281 11.172 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -14.012 3.934 8.764 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -12.357 3.378 8.606 1.00 0.00 H new ATOM 0 HG LEU A 32 -12.839 1.443 10.092 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -15.181 1.001 10.784 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -14.588 2.532 11.472 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -15.683 2.552 10.069 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -14.377 0.236 8.559 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -14.879 1.786 7.844 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -13.205 1.215 7.647 1.00 0.00 H new ATOM 508 N LEU A 33 -12.199 2.784 12.478 1.00 0.00 N ATOM 509 CA LEU A 33 -11.240 1.972 13.277 1.00 0.00 C ATOM 510 C LEU A 33 -11.845 0.601 13.570 1.00 0.00 C ATOM 511 O LEU A 33 -12.998 0.481 13.926 1.00 0.00 O ATOM 512 CB LEU A 33 -10.935 2.690 14.589 1.00 0.00 C ATOM 513 CG LEU A 33 -9.808 3.695 14.358 1.00 0.00 C ATOM 514 CD1 LEU A 33 -9.792 4.720 15.489 1.00 0.00 C ATOM 515 CD2 LEU A 33 -8.471 2.953 14.329 1.00 0.00 C ATOM 0 H LEU A 33 -13.132 2.877 12.880 1.00 0.00 H new ATOM 0 HA LEU A 33 -10.317 1.843 12.712 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -11.826 3.201 14.954 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -10.645 1.969 15.354 1.00 0.00 H new ATOM 0 HG LEU A 33 -9.968 4.207 13.409 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -8.987 5.435 15.321 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.746 5.247 15.516 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -9.632 4.211 16.439 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -7.663 3.666 14.164 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -8.317 2.443 15.280 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -8.479 2.221 13.522 1.00 0.00 H new ATOM 527 N LEU A 34 -11.066 -0.432 13.418 1.00 0.00 N ATOM 528 CA LEU A 34 -11.579 -1.803 13.681 1.00 0.00 C ATOM 529 C LEU A 34 -10.904 -2.367 14.934 1.00 0.00 C ATOM 530 O LEU A 34 -9.721 -2.189 15.147 1.00 0.00 O ATOM 531 CB LEU A 34 -11.259 -2.689 12.476 1.00 0.00 C ATOM 532 CG LEU A 34 -11.783 -2.016 11.206 1.00 0.00 C ATOM 533 CD1 LEU A 34 -11.401 -2.852 9.988 1.00 0.00 C ATOM 534 CD2 LEU A 34 -13.306 -1.904 11.275 1.00 0.00 C ATOM 0 H LEU A 34 -10.091 -0.385 13.121 1.00 0.00 H new ATOM 0 HA LEU A 34 -12.657 -1.775 13.839 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.183 -2.847 12.401 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -11.718 -3.670 12.598 1.00 0.00 H new ATOM 0 HG LEU A 34 -11.344 -1.022 11.122 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.775 -2.371 9.084 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -10.316 -2.937 9.931 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -11.839 -3.846 10.077 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -13.677 -1.424 10.369 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -13.740 -2.900 11.362 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.588 -1.308 12.143 1.00 0.00 H new ATOM 546 N GLN A 35 -11.646 -3.045 15.764 1.00 0.00 N ATOM 547 CA GLN A 35 -11.046 -3.623 17.003 1.00 0.00 C ATOM 548 C GLN A 35 -10.183 -4.828 16.628 1.00 0.00 C ATOM 549 O GLN A 35 -10.453 -5.520 15.671 1.00 0.00 O ATOM 550 CB GLN A 35 -12.161 -4.063 17.952 1.00 0.00 C ATOM 551 CG GLN A 35 -11.553 -4.532 19.276 1.00 0.00 C ATOM 552 CD GLN A 35 -11.048 -3.324 20.064 1.00 0.00 C ATOM 553 OE1 GLN A 35 -11.819 -2.464 20.438 1.00 0.00 O ATOM 554 NE2 GLN A 35 -9.776 -3.223 20.336 1.00 0.00 N ATOM 0 H GLN A 35 -12.642 -3.225 15.640 1.00 0.00 H new ATOM 0 HA GLN A 35 -10.429 -2.873 17.498 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -12.849 -3.236 18.129 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.740 -4.869 17.500 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -12.298 -5.073 19.859 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -10.733 -5.224 19.086 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -9.128 -3.946 20.022 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -9.429 -2.421 20.863 1.00 0.00 H new ATOM 563 N ALA A 36 -9.141 -5.082 17.371 1.00 0.00 N ATOM 564 CA ALA A 36 -8.257 -6.242 17.052 1.00 0.00 C ATOM 565 C ALA A 36 -8.967 -7.554 17.406 1.00 0.00 C ATOM 566 O ALA A 36 -8.470 -8.628 17.137 1.00 0.00 O ATOM 567 CB ALA A 36 -6.964 -6.132 17.861 1.00 0.00 C ATOM 0 H ALA A 36 -8.862 -4.536 18.186 1.00 0.00 H new ATOM 0 HA ALA A 36 -8.028 -6.235 15.986 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.317 -6.978 17.630 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -6.453 -5.204 17.606 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -7.199 -6.136 18.925 1.00 0.00 H new ATOM 573 N SER A 37 -10.118 -7.473 18.017 1.00 0.00 N ATOM 574 CA SER A 37 -10.857 -8.712 18.398 1.00 0.00 C ATOM 575 C SER A 37 -10.065 -9.470 19.466 1.00 0.00 C ATOM 576 O SER A 37 -10.566 -9.763 20.535 1.00 0.00 O ATOM 577 CB SER A 37 -11.043 -9.607 17.172 1.00 0.00 C ATOM 578 OG SER A 37 -9.863 -10.370 16.961 1.00 0.00 O ATOM 0 H SER A 37 -10.580 -6.600 18.270 1.00 0.00 H new ATOM 0 HA SER A 37 -11.835 -8.437 18.792 1.00 0.00 H new ATOM 0 HB2 SER A 37 -11.896 -10.269 17.318 1.00 0.00 H new ATOM 0 HB3 SER A 37 -11.258 -8.999 16.293 1.00 0.00 H new ATOM 0 HG SER A 37 -9.178 -9.805 16.545 1.00 0.00 H new ATOM 584 N ASP A 38 -8.831 -9.789 19.186 1.00 0.00 N ATOM 585 CA ASP A 38 -8.002 -10.526 20.183 1.00 0.00 C ATOM 586 C ASP A 38 -6.690 -9.774 20.409 1.00 0.00 C ATOM 587 O ASP A 38 -6.500 -8.680 19.916 1.00 0.00 O ATOM 588 CB ASP A 38 -7.704 -11.933 19.659 1.00 0.00 C ATOM 589 CG ASP A 38 -6.875 -11.835 18.376 1.00 0.00 C ATOM 590 OD1 ASP A 38 -6.390 -10.755 18.087 1.00 0.00 O ATOM 591 OD2 ASP A 38 -6.741 -12.846 17.704 1.00 0.00 O ATOM 0 H ASP A 38 -8.360 -9.571 18.308 1.00 0.00 H new ATOM 0 HA ASP A 38 -8.545 -10.599 21.125 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -7.162 -12.506 20.412 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -8.635 -12.464 19.463 1.00 0.00 H new ATOM 597 N GLY A 39 -5.783 -10.352 21.149 1.00 0.00 N ATOM 598 CA GLY A 39 -4.485 -9.665 21.401 1.00 0.00 C ATOM 599 C GLY A 39 -4.634 -8.702 22.581 1.00 0.00 C ATOM 600 O GLY A 39 -5.471 -8.884 23.442 1.00 0.00 O ATOM 0 H GLY A 39 -5.884 -11.267 21.588 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.709 -10.400 21.614 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -4.172 -9.120 20.511 1.00 0.00 H new ATOM 604 N ILE A 40 -3.825 -7.680 22.628 1.00 0.00 N ATOM 605 CA ILE A 40 -3.916 -6.708 23.754 1.00 0.00 C ATOM 606 C ILE A 40 -5.204 -5.890 23.618 1.00 0.00 C ATOM 607 O ILE A 40 -5.455 -4.985 24.387 1.00 0.00 O ATOM 608 CB ILE A 40 -2.697 -5.779 23.729 1.00 0.00 C ATOM 609 CG1 ILE A 40 -2.824 -4.782 22.572 1.00 0.00 C ATOM 610 CG2 ILE A 40 -1.430 -6.617 23.543 1.00 0.00 C ATOM 611 CD1 ILE A 40 -1.641 -3.811 22.605 1.00 0.00 C ATOM 0 H ILE A 40 -3.105 -7.476 21.935 1.00 0.00 H new ATOM 0 HA ILE A 40 -3.933 -7.245 24.702 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.642 -5.229 24.669 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.846 -5.313 21.620 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -3.762 -4.233 22.652 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.560 -5.961 23.524 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.336 -7.322 24.369 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -1.491 -7.165 22.603 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -1.730 -3.101 21.783 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -1.640 -3.271 23.552 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -0.710 -4.368 22.504 1.00 0.00 H new ATOM 623 N HIS A 41 -6.019 -6.204 22.646 1.00 0.00 N ATOM 624 CA HIS A 41 -7.295 -5.454 22.457 1.00 0.00 C ATOM 625 C HIS A 41 -6.993 -4.016 22.028 1.00 0.00 C ATOM 626 O HIS A 41 -7.448 -3.068 22.636 1.00 0.00 O ATOM 627 CB HIS A 41 -8.092 -5.442 23.765 1.00 0.00 C ATOM 628 CG HIS A 41 -8.153 -6.836 24.326 1.00 0.00 C ATOM 629 ND1 HIS A 41 -8.896 -7.844 23.724 1.00 0.00 N ATOM 630 CD2 HIS A 41 -7.570 -7.408 25.431 1.00 0.00 C ATOM 631 CE1 HIS A 41 -8.741 -8.957 24.464 1.00 0.00 C ATOM 632 NE2 HIS A 41 -7.944 -8.742 25.512 1.00 0.00 N ATOM 0 H HIS A 41 -5.855 -6.951 21.972 1.00 0.00 H new ATOM 0 HA HIS A 41 -7.884 -5.946 21.682 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -7.623 -4.769 24.483 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.099 -5.066 23.586 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -6.921 -6.899 26.128 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -9.204 -9.906 24.238 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -7.667 -9.417 26.224 1.00 0.00 H new ATOM 641 N HIS A 42 -6.232 -3.846 20.979 1.00 0.00 N ATOM 642 CA HIS A 42 -5.907 -2.468 20.509 1.00 0.00 C ATOM 643 C HIS A 42 -6.729 -2.153 19.258 1.00 0.00 C ATOM 644 O HIS A 42 -7.339 -3.023 18.669 1.00 0.00 O ATOM 645 CB HIS A 42 -4.416 -2.380 20.178 1.00 0.00 C ATOM 646 CG HIS A 42 -4.089 -3.347 19.072 1.00 0.00 C ATOM 647 ND1 HIS A 42 -4.157 -4.721 19.248 1.00 0.00 N ATOM 648 CD2 HIS A 42 -3.691 -3.154 17.772 1.00 0.00 C ATOM 649 CE1 HIS A 42 -3.805 -5.295 18.083 1.00 0.00 C ATOM 650 NE2 HIS A 42 -3.512 -4.385 17.154 1.00 0.00 N ATOM 0 H HIS A 42 -5.822 -4.601 20.428 1.00 0.00 H new ATOM 0 HA HIS A 42 -6.146 -1.749 21.292 1.00 0.00 H new ATOM 0 HB2 HIS A 42 -4.159 -1.365 19.876 1.00 0.00 H new ATOM 0 HB3 HIS A 42 -3.822 -2.609 21.063 1.00 0.00 H new ATOM 0 HD2 HIS A 42 -3.540 -2.193 17.302 1.00 0.00 H new ATOM 0 HE1 HIS A 42 -3.765 -6.362 17.921 1.00 0.00 H new ATOM 0 HE2 HIS A 42 -3.218 -4.556 16.192 1.00 0.00 H new ATOM 659 N TRP A 43 -6.756 -0.914 18.847 1.00 0.00 N ATOM 660 CA TRP A 43 -7.544 -0.548 17.635 1.00 0.00 C ATOM 661 C TRP A 43 -6.602 -0.352 16.447 1.00 0.00 C ATOM 662 O TRP A 43 -5.529 0.204 16.578 1.00 0.00 O ATOM 663 CB TRP A 43 -8.297 0.758 17.887 1.00 0.00 C ATOM 664 CG TRP A 43 -9.272 0.572 19.008 1.00 0.00 C ATOM 665 CD1 TRP A 43 -8.968 0.661 20.322 1.00 0.00 C ATOM 666 CD2 TRP A 43 -10.698 0.283 18.934 1.00 0.00 C ATOM 667 NE1 TRP A 43 -10.115 0.436 21.061 1.00 0.00 N ATOM 668 CE2 TRP A 43 -11.208 0.201 20.252 1.00 0.00 C ATOM 669 CE3 TRP A 43 -11.590 0.085 17.865 1.00 0.00 C ATOM 670 CZ2 TRP A 43 -12.554 -0.069 20.499 1.00 0.00 C ATOM 671 CZ3 TRP A 43 -12.945 -0.186 18.112 1.00 0.00 C ATOM 672 CH2 TRP A 43 -13.425 -0.264 19.426 1.00 0.00 C ATOM 0 H TRP A 43 -6.267 -0.140 19.297 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.252 -1.348 17.417 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -7.593 1.553 18.133 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -8.822 1.066 16.983 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -7.990 0.873 20.728 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -10.149 0.443 22.080 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -11.230 0.142 16.848 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -12.920 -0.127 21.514 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -13.622 -0.335 17.284 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -14.468 -0.475 19.608 1.00 0.00 H new ATOM 683 N THR A 44 -7.000 -0.793 15.287 1.00 0.00 N ATOM 684 CA THR A 44 -6.136 -0.625 14.085 1.00 0.00 C ATOM 685 C THR A 44 -7.020 -0.593 12.836 1.00 0.00 C ATOM 686 O THR A 44 -8.065 -1.212 12.795 1.00 0.00 O ATOM 687 CB THR A 44 -5.158 -1.799 13.993 1.00 0.00 C ATOM 688 OG1 THR A 44 -5.614 -2.859 14.822 1.00 0.00 O ATOM 689 CG2 THR A 44 -3.770 -1.349 14.457 1.00 0.00 C ATOM 0 H THR A 44 -7.889 -1.264 15.119 1.00 0.00 H new ATOM 0 HA THR A 44 -5.574 0.306 14.160 1.00 0.00 H new ATOM 0 HB THR A 44 -5.100 -2.142 12.960 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.990 -3.612 14.763 1.00 0.00 H new ATOM 0 HG21 THR A 44 -3.075 -2.186 14.391 1.00 0.00 H new ATOM 0 HG22 THR A 44 -3.420 -0.536 13.821 1.00 0.00 H new ATOM 0 HG23 THR A 44 -3.826 -1.004 15.490 1.00 0.00 H new ATOM 697 N PRO A 45 -6.605 0.123 11.822 1.00 0.00 N ATOM 698 CA PRO A 45 -7.374 0.229 10.549 1.00 0.00 C ATOM 699 C PRO A 45 -7.348 -1.080 9.759 1.00 0.00 C ATOM 700 O PRO A 45 -6.481 -1.910 9.951 1.00 0.00 O ATOM 701 CB PRO A 45 -6.656 1.331 9.769 1.00 0.00 C ATOM 702 CG PRO A 45 -5.274 1.380 10.326 1.00 0.00 C ATOM 703 CD PRO A 45 -5.361 0.903 11.777 1.00 0.00 C ATOM 0 HA PRO A 45 -8.427 0.446 10.731 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -6.641 1.110 8.702 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -7.161 2.289 9.889 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -4.603 0.743 9.750 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -4.873 2.392 10.276 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -4.499 0.295 12.049 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -5.391 1.742 12.472 1.00 0.00 H new ATOM 711 N PRO A 46 -8.293 -1.262 8.878 1.00 0.00 N ATOM 712 CA PRO A 46 -8.383 -2.492 8.043 1.00 0.00 C ATOM 713 C PRO A 46 -7.138 -2.686 7.175 1.00 0.00 C ATOM 714 O PRO A 46 -6.960 -2.022 6.173 1.00 0.00 O ATOM 715 CB PRO A 46 -9.619 -2.271 7.164 1.00 0.00 C ATOM 716 CG PRO A 46 -9.954 -0.817 7.263 1.00 0.00 C ATOM 717 CD PRO A 46 -9.372 -0.313 8.582 1.00 0.00 C ATOM 0 HA PRO A 46 -8.455 -3.388 8.659 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -9.416 -2.553 6.131 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -10.452 -2.885 7.504 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -9.534 -0.266 6.421 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -11.033 -0.667 7.236 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -8.994 0.705 8.489 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -10.123 -0.303 9.372 1.00 0.00 H new ATOM 725 N LYS A 47 -6.276 -3.594 7.549 1.00 0.00 N ATOM 726 CA LYS A 47 -5.047 -3.829 6.744 1.00 0.00 C ATOM 727 C LYS A 47 -4.934 -5.309 6.394 1.00 0.00 C ATOM 728 O LYS A 47 -5.519 -6.161 7.034 1.00 0.00 O ATOM 729 CB LYS A 47 -3.815 -3.394 7.543 1.00 0.00 C ATOM 730 CG LYS A 47 -3.625 -4.318 8.746 1.00 0.00 C ATOM 731 CD LYS A 47 -2.466 -3.803 9.604 1.00 0.00 C ATOM 732 CE LYS A 47 -2.082 -4.855 10.647 1.00 0.00 C ATOM 733 NZ LYS A 47 -0.608 -4.827 10.863 1.00 0.00 N ATOM 0 H LYS A 47 -6.372 -4.182 8.377 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.105 -3.246 5.825 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.930 -3.422 6.908 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -3.933 -2.364 7.879 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.540 -4.357 9.337 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.419 -5.334 8.409 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.608 -3.575 8.972 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -2.753 -2.875 10.099 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.601 -4.659 11.585 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.392 -5.845 10.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -0.347 -5.542 11.572 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -0.122 -5.034 9.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.324 -3.885 11.201 1.00 0.00 H new ATOM 747 N GLY A 48 -4.181 -5.622 5.377 1.00 0.00 N ATOM 748 CA GLY A 48 -4.021 -7.046 4.970 1.00 0.00 C ATOM 749 C GLY A 48 -2.690 -7.216 4.235 1.00 0.00 C ATOM 750 O GLY A 48 -1.877 -6.315 4.189 1.00 0.00 O ATOM 0 H GLY A 48 -3.667 -4.950 4.807 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -4.050 -7.692 5.847 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -4.847 -7.347 4.325 1.00 0.00 H new ATOM 754 N HIS A 49 -2.461 -8.364 3.659 1.00 0.00 N ATOM 755 CA HIS A 49 -1.183 -8.592 2.928 1.00 0.00 C ATOM 756 C HIS A 49 -1.450 -8.575 1.421 1.00 0.00 C ATOM 757 O HIS A 49 -2.432 -9.113 0.949 1.00 0.00 O ATOM 758 CB HIS A 49 -0.606 -9.950 3.330 1.00 0.00 C ATOM 759 CG HIS A 49 -0.227 -9.921 4.786 1.00 0.00 C ATOM 760 ND1 HIS A 49 -0.984 -9.948 5.931 1.00 0.00 N flip ATOM 761 CD2 HIS A 49 1.095 -9.863 5.205 1.00 0.00 C flip ATOM 762 CE1 HIS A 49 -0.148 -9.906 7.041 1.00 0.00 C flip ATOM 763 NE2 HIS A 49 1.092 -9.857 6.552 1.00 0.00 N flip ATOM 0 H HIS A 49 -3.105 -9.155 3.663 1.00 0.00 H new ATOM 0 HA HIS A 49 -0.471 -7.805 3.179 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -1.339 -10.737 3.149 1.00 0.00 H new ATOM 0 HB3 HIS A 49 0.267 -10.181 2.720 1.00 0.00 H new ATOM 0 HD1 HIS A 49 -2.003 -9.992 5.962 1.00 0.00 H new ATOM 0 HD2 HIS A 49 1.966 -9.829 4.568 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -0.441 -9.912 8.080 1.00 0.00 H new ATOM 772 N VAL A 50 -0.589 -7.953 0.663 1.00 0.00 N ATOM 773 CA VAL A 50 -0.803 -7.894 -0.810 1.00 0.00 C ATOM 774 C VAL A 50 -0.182 -9.125 -1.478 1.00 0.00 C ATOM 775 O VAL A 50 0.939 -9.501 -1.202 1.00 0.00 O ATOM 776 CB VAL A 50 -0.165 -6.614 -1.366 1.00 0.00 C ATOM 777 CG1 VAL A 50 0.642 -5.922 -0.266 1.00 0.00 C ATOM 778 CG2 VAL A 50 0.757 -6.950 -2.541 1.00 0.00 C ATOM 0 H VAL A 50 0.252 -7.484 1.000 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.872 -7.884 -1.021 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.955 -5.949 -1.713 1.00 0.00 H new ATOM 0 HG11 VAL A 50 1.094 -5.013 -0.663 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.018 -5.666 0.563 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.425 -6.593 0.087 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.204 -6.034 -2.927 1.00 0.00 H new ATOM 0 HG22 VAL A 50 1.545 -7.624 -2.204 1.00 0.00 H new ATOM 0 HG23 VAL A 50 0.180 -7.432 -3.330 1.00 0.00 H new ATOM 788 N GLU A 51 -0.912 -9.750 -2.362 1.00 0.00 N ATOM 789 CA GLU A 51 -0.385 -10.952 -3.069 1.00 0.00 C ATOM 790 C GLU A 51 0.799 -10.521 -3.954 1.00 0.00 C ATOM 791 O GLU A 51 1.239 -9.390 -3.880 1.00 0.00 O ATOM 792 CB GLU A 51 -1.519 -11.542 -3.919 1.00 0.00 C ATOM 793 CG GLU A 51 -1.772 -13.008 -3.539 1.00 0.00 C ATOM 794 CD GLU A 51 -2.881 -13.075 -2.483 1.00 0.00 C ATOM 795 OE1 GLU A 51 -2.916 -12.201 -1.634 1.00 0.00 O ATOM 796 OE2 GLU A 51 -3.672 -14.002 -2.542 1.00 0.00 O ATOM 0 H GLU A 51 -1.858 -9.477 -2.626 1.00 0.00 H new ATOM 0 HA GLU A 51 -0.037 -11.708 -2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -2.430 -10.961 -3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.262 -11.474 -4.976 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -2.060 -13.580 -4.421 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -0.858 -13.458 -3.152 1.00 0.00 H new ATOM 804 N PRO A 52 1.329 -11.398 -4.776 1.00 0.00 N ATOM 805 CA PRO A 52 2.487 -11.057 -5.654 1.00 0.00 C ATOM 806 C PRO A 52 2.076 -10.169 -6.831 1.00 0.00 C ATOM 807 O PRO A 52 2.429 -9.008 -6.897 1.00 0.00 O ATOM 808 CB PRO A 52 2.981 -12.415 -6.151 1.00 0.00 C ATOM 809 CG PRO A 52 1.797 -13.321 -6.084 1.00 0.00 C ATOM 810 CD PRO A 52 0.895 -12.793 -4.966 1.00 0.00 C ATOM 0 HA PRO A 52 3.249 -10.490 -5.119 1.00 0.00 H new ATOM 0 HB2 PRO A 52 3.364 -12.344 -7.169 1.00 0.00 H new ATOM 0 HB3 PRO A 52 3.795 -12.787 -5.530 1.00 0.00 H new ATOM 0 HG2 PRO A 52 1.266 -13.333 -7.036 1.00 0.00 H new ATOM 0 HG3 PRO A 52 2.106 -14.346 -5.879 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -0.157 -12.848 -5.245 1.00 0.00 H new ATOM 0 HD3 PRO A 52 1.013 -13.374 -4.052 1.00 0.00 H new ATOM 818 N GLY A 53 1.329 -10.702 -7.758 1.00 0.00 N ATOM 819 CA GLY A 53 0.893 -9.881 -8.921 1.00 0.00 C ATOM 820 C GLY A 53 -0.310 -9.032 -8.511 1.00 0.00 C ATOM 821 O GLY A 53 -1.043 -8.528 -9.341 1.00 0.00 O ATOM 0 H GLY A 53 1.003 -11.668 -7.760 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.709 -9.240 -9.256 1.00 0.00 H new ATOM 0 HA3 GLY A 53 0.630 -10.526 -9.759 1.00 0.00 H new ATOM 825 N GLU A 54 -0.519 -8.870 -7.233 1.00 0.00 N ATOM 826 CA GLU A 54 -1.673 -8.059 -6.757 1.00 0.00 C ATOM 827 C GLU A 54 -1.258 -6.591 -6.632 1.00 0.00 C ATOM 828 O GLU A 54 -0.120 -6.279 -6.340 1.00 0.00 O ATOM 829 CB GLU A 54 -2.128 -8.569 -5.389 1.00 0.00 C ATOM 830 CG GLU A 54 -3.413 -7.852 -4.985 1.00 0.00 C ATOM 831 CD GLU A 54 -3.806 -8.253 -3.560 1.00 0.00 C ATOM 832 OE1 GLU A 54 -3.035 -8.954 -2.928 1.00 0.00 O ATOM 833 OE2 GLU A 54 -4.873 -7.850 -3.127 1.00 0.00 O ATOM 0 H GLU A 54 0.063 -9.267 -6.496 1.00 0.00 H new ATOM 0 HA GLU A 54 -2.490 -8.147 -7.473 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.295 -9.645 -5.427 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -1.351 -8.393 -4.646 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -3.271 -6.773 -5.043 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.215 -8.106 -5.678 1.00 0.00 H new ATOM 841 N ASP A 55 -2.173 -5.689 -6.850 1.00 0.00 N ATOM 842 CA ASP A 55 -1.840 -4.239 -6.745 1.00 0.00 C ATOM 843 C ASP A 55 -1.658 -3.853 -5.284 1.00 0.00 C ATOM 844 O ASP A 55 -2.129 -4.521 -4.384 1.00 0.00 O ATOM 845 CB ASP A 55 -2.975 -3.402 -7.312 1.00 0.00 C ATOM 846 CG ASP A 55 -2.542 -1.937 -7.399 1.00 0.00 C ATOM 847 OD1 ASP A 55 -1.920 -1.580 -8.386 1.00 0.00 O ATOM 848 OD2 ASP A 55 -2.844 -1.197 -6.478 1.00 0.00 O ATOM 0 H ASP A 55 -3.141 -5.893 -7.097 1.00 0.00 H new ATOM 0 HA ASP A 55 -0.921 -4.058 -7.303 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.252 -3.769 -8.300 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -3.858 -3.493 -6.680 1.00 0.00 H new ATOM 854 N ASP A 56 -0.988 -2.767 -5.048 1.00 0.00 N ATOM 855 CA ASP A 56 -0.778 -2.308 -3.649 1.00 0.00 C ATOM 856 C ASP A 56 -2.079 -1.712 -3.102 1.00 0.00 C ATOM 857 O ASP A 56 -2.513 -2.031 -2.011 1.00 0.00 O ATOM 858 CB ASP A 56 0.322 -1.244 -3.630 1.00 0.00 C ATOM 859 CG ASP A 56 -0.134 -0.017 -4.423 1.00 0.00 C ATOM 860 OD1 ASP A 56 -1.013 -0.164 -5.255 1.00 0.00 O ATOM 861 OD2 ASP A 56 0.410 1.052 -4.190 1.00 0.00 O ATOM 0 H ASP A 56 -0.574 -2.172 -5.766 1.00 0.00 H new ATOM 0 HA ASP A 56 -0.482 -3.153 -3.027 1.00 0.00 H new ATOM 0 HB2 ASP A 56 0.550 -0.961 -2.602 1.00 0.00 H new ATOM 0 HB3 ASP A 56 1.239 -1.647 -4.060 1.00 0.00 H new ATOM 867 N LEU A 57 -2.704 -0.840 -3.849 1.00 0.00 N ATOM 868 CA LEU A 57 -3.971 -0.216 -3.371 1.00 0.00 C ATOM 869 C LEU A 57 -5.117 -1.232 -3.402 1.00 0.00 C ATOM 870 O LEU A 57 -5.897 -1.320 -2.474 1.00 0.00 O ATOM 871 CB LEU A 57 -4.321 0.980 -4.262 1.00 0.00 C ATOM 872 CG LEU A 57 -5.635 1.608 -3.788 1.00 0.00 C ATOM 873 CD1 LEU A 57 -5.510 2.023 -2.323 1.00 0.00 C ATOM 874 CD2 LEU A 57 -5.944 2.843 -4.632 1.00 0.00 C ATOM 0 H LEU A 57 -2.391 -0.533 -4.770 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.830 0.119 -2.344 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.520 1.719 -4.227 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.413 0.659 -5.299 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.438 0.878 -3.893 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -6.447 2.469 -1.990 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -5.289 1.146 -1.714 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -4.705 2.750 -2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -6.879 3.290 -4.294 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -5.137 3.568 -4.526 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.037 2.554 -5.679 1.00 0.00 H new ATOM 886 N GLU A 58 -5.233 -2.002 -4.450 1.00 0.00 N ATOM 887 CA GLU A 58 -6.343 -2.995 -4.508 1.00 0.00 C ATOM 888 C GLU A 58 -6.274 -3.882 -3.267 1.00 0.00 C ATOM 889 O GLU A 58 -7.280 -4.226 -2.682 1.00 0.00 O ATOM 890 CB GLU A 58 -6.213 -3.859 -5.767 1.00 0.00 C ATOM 891 CG GLU A 58 -6.605 -3.038 -7.002 1.00 0.00 C ATOM 892 CD GLU A 58 -5.482 -2.070 -7.381 1.00 0.00 C ATOM 893 OE1 GLU A 58 -5.193 -1.187 -6.589 1.00 0.00 O ATOM 894 OE2 GLU A 58 -4.930 -2.228 -8.457 1.00 0.00 O ATOM 0 H GLU A 58 -4.614 -1.987 -5.261 1.00 0.00 H new ATOM 0 HA GLU A 58 -7.299 -2.472 -4.541 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -5.189 -4.219 -5.868 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -6.853 -4.737 -5.684 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -6.815 -3.705 -7.838 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -7.520 -2.481 -6.800 1.00 0.00 H new ATOM 902 N THR A 59 -5.091 -4.226 -2.839 1.00 0.00 N ATOM 903 CA THR A 59 -4.976 -5.055 -1.613 1.00 0.00 C ATOM 904 C THR A 59 -5.645 -4.291 -0.478 1.00 0.00 C ATOM 905 O THR A 59 -6.388 -4.842 0.310 1.00 0.00 O ATOM 906 CB THR A 59 -3.499 -5.301 -1.293 1.00 0.00 C ATOM 907 OG1 THR A 59 -2.919 -6.054 -2.349 1.00 0.00 O ATOM 908 CG2 THR A 59 -3.368 -6.071 0.023 1.00 0.00 C ATOM 0 H THR A 59 -4.208 -3.971 -3.282 1.00 0.00 H new ATOM 0 HA THR A 59 -5.458 -6.023 -1.751 1.00 0.00 H new ATOM 0 HB THR A 59 -2.984 -4.346 -1.192 1.00 0.00 H new ATOM 0 HG1 THR A 59 -2.779 -5.474 -3.126 1.00 0.00 H new ATOM 0 HG21 THR A 59 -2.314 -6.241 0.242 1.00 0.00 H new ATOM 0 HG22 THR A 59 -3.817 -5.492 0.830 1.00 0.00 H new ATOM 0 HG23 THR A 59 -3.880 -7.030 -0.064 1.00 0.00 H new ATOM 916 N ALA A 60 -5.415 -3.008 -0.414 1.00 0.00 N ATOM 917 CA ALA A 60 -6.064 -2.190 0.642 1.00 0.00 C ATOM 918 C ALA A 60 -7.567 -2.158 0.368 1.00 0.00 C ATOM 919 O ALA A 60 -8.377 -2.296 1.261 1.00 0.00 O ATOM 920 CB ALA A 60 -5.501 -0.770 0.598 1.00 0.00 C ATOM 0 H ALA A 60 -4.805 -2.493 -1.049 1.00 0.00 H new ATOM 0 HA ALA A 60 -5.873 -2.618 1.626 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -5.975 -0.166 1.372 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.425 -0.800 0.769 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -5.701 -0.330 -0.379 1.00 0.00 H new ATOM 926 N LEU A 61 -7.941 -1.990 -0.873 1.00 0.00 N ATOM 927 CA LEU A 61 -9.388 -1.963 -1.224 1.00 0.00 C ATOM 928 C LEU A 61 -10.028 -3.292 -0.821 1.00 0.00 C ATOM 929 O LEU A 61 -11.037 -3.330 -0.144 1.00 0.00 O ATOM 930 CB LEU A 61 -9.525 -1.801 -2.734 1.00 0.00 C ATOM 931 CG LEU A 61 -8.881 -0.492 -3.181 1.00 0.00 C ATOM 932 CD1 LEU A 61 -8.934 -0.412 -4.706 1.00 0.00 C ATOM 933 CD2 LEU A 61 -9.643 0.690 -2.579 1.00 0.00 C ATOM 0 H LEU A 61 -7.303 -1.870 -1.660 1.00 0.00 H new ATOM 0 HA LEU A 61 -9.877 -1.138 -0.706 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -9.051 -2.641 -3.242 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -10.578 -1.812 -3.015 1.00 0.00 H new ATOM 0 HG LEU A 61 -7.845 -0.456 -2.843 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -8.476 0.520 -5.038 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -8.391 -1.255 -5.134 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -9.972 -0.444 -5.036 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -9.180 1.623 -2.900 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -10.679 0.664 -2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -9.613 0.626 -1.491 1.00 0.00 H new ATOM 945 N ARG A 62 -9.443 -4.379 -1.238 1.00 0.00 N ATOM 946 CA ARG A 62 -10.008 -5.714 -0.887 1.00 0.00 C ATOM 947 C ARG A 62 -10.030 -5.877 0.634 1.00 0.00 C ATOM 948 O ARG A 62 -10.998 -6.339 1.202 1.00 0.00 O ATOM 949 CB ARG A 62 -9.136 -6.810 -1.499 1.00 0.00 C ATOM 950 CG ARG A 62 -9.801 -8.171 -1.279 1.00 0.00 C ATOM 951 CD ARG A 62 -8.886 -9.279 -1.808 1.00 0.00 C ATOM 952 NE ARG A 62 -7.724 -9.443 -0.889 1.00 0.00 N ATOM 953 CZ ARG A 62 -6.760 -10.266 -1.194 1.00 0.00 C ATOM 954 NH1 ARG A 62 -6.797 -10.931 -2.317 1.00 0.00 N ATOM 955 NH2 ARG A 62 -5.753 -10.422 -0.377 1.00 0.00 N ATOM 0 H ARG A 62 -8.597 -4.402 -1.807 1.00 0.00 H new ATOM 0 HA ARG A 62 -11.023 -5.792 -1.276 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.999 -6.628 -2.565 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -8.146 -6.799 -1.044 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -9.998 -8.324 -0.218 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -10.763 -8.204 -1.790 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -9.438 -10.216 -1.885 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -8.538 -9.031 -2.811 1.00 0.00 H new ATOM 0 HE ARG A 62 -7.683 -8.910 -0.020 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -7.581 -10.807 -2.958 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -6.042 -11.574 -2.554 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -5.721 -9.900 0.499 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -4.998 -11.066 -0.615 1.00 0.00 H new ATOM 969 N ALA A 63 -8.970 -5.501 1.293 1.00 0.00 N ATOM 970 CA ALA A 63 -8.932 -5.637 2.777 1.00 0.00 C ATOM 971 C ALA A 63 -9.934 -4.665 3.403 1.00 0.00 C ATOM 972 O ALA A 63 -10.533 -4.945 4.421 1.00 0.00 O ATOM 973 CB ALA A 63 -7.524 -5.310 3.283 1.00 0.00 C ATOM 0 H ALA A 63 -8.130 -5.106 0.870 1.00 0.00 H new ATOM 0 HA ALA A 63 -9.192 -6.658 3.055 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.495 -5.409 4.368 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.808 -6.000 2.836 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.266 -4.288 3.005 1.00 0.00 H new ATOM 979 N THR A 64 -10.109 -3.520 2.803 1.00 0.00 N ATOM 980 CA THR A 64 -11.061 -2.520 3.361 1.00 0.00 C ATOM 981 C THR A 64 -12.468 -3.119 3.440 1.00 0.00 C ATOM 982 O THR A 64 -13.157 -2.977 4.428 1.00 0.00 O ATOM 983 CB THR A 64 -11.080 -1.290 2.455 1.00 0.00 C ATOM 984 OG1 THR A 64 -9.752 -0.815 2.280 1.00 0.00 O ATOM 985 CG2 THR A 64 -11.932 -0.192 3.089 1.00 0.00 C ATOM 0 H THR A 64 -9.632 -3.234 1.948 1.00 0.00 H new ATOM 0 HA THR A 64 -10.741 -2.238 4.364 1.00 0.00 H new ATOM 0 HB THR A 64 -11.505 -1.561 1.488 1.00 0.00 H new ATOM 0 HG1 THR A 64 -9.323 -1.304 1.547 1.00 0.00 H new ATOM 0 HG21 THR A 64 -11.942 0.682 2.438 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.951 -0.555 3.225 1.00 0.00 H new ATOM 0 HG23 THR A 64 -11.512 0.081 4.057 1.00 0.00 H new ATOM 993 N GLN A 65 -12.904 -3.784 2.406 1.00 0.00 N ATOM 994 CA GLN A 65 -14.267 -4.381 2.433 1.00 0.00 C ATOM 995 C GLN A 65 -14.245 -5.703 3.207 1.00 0.00 C ATOM 996 O GLN A 65 -15.155 -6.012 3.949 1.00 0.00 O ATOM 997 CB GLN A 65 -14.763 -4.602 0.998 1.00 0.00 C ATOM 998 CG GLN A 65 -14.951 -6.096 0.726 1.00 0.00 C ATOM 999 CD GLN A 65 -15.383 -6.293 -0.728 1.00 0.00 C ATOM 1000 OE1 GLN A 65 -14.681 -5.905 -1.641 1.00 0.00 O ATOM 1001 NE2 GLN A 65 -16.518 -6.884 -0.985 1.00 0.00 N ATOM 0 H GLN A 65 -12.377 -3.939 1.547 1.00 0.00 H new ATOM 0 HA GLN A 65 -14.951 -3.699 2.938 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.706 -4.076 0.847 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -14.048 -4.184 0.290 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -14.022 -6.632 0.917 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.702 -6.509 1.400 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -17.108 -7.210 -0.220 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -16.815 -7.020 -1.951 1.00 0.00 H new ATOM 1010 N GLU A 66 -13.217 -6.485 3.043 1.00 0.00 N ATOM 1011 CA GLU A 66 -13.148 -7.780 3.775 1.00 0.00 C ATOM 1012 C GLU A 66 -13.081 -7.519 5.281 1.00 0.00 C ATOM 1013 O GLU A 66 -13.655 -8.237 6.073 1.00 0.00 O ATOM 1014 CB GLU A 66 -11.900 -8.545 3.337 1.00 0.00 C ATOM 1015 CG GLU A 66 -12.066 -9.006 1.887 1.00 0.00 C ATOM 1016 CD GLU A 66 -13.205 -10.025 1.804 1.00 0.00 C ATOM 1017 OE1 GLU A 66 -13.580 -10.549 2.839 1.00 0.00 O ATOM 1018 OE2 GLU A 66 -13.680 -10.264 0.706 1.00 0.00 O ATOM 0 H GLU A 66 -12.423 -6.285 2.435 1.00 0.00 H new ATOM 0 HA GLU A 66 -14.037 -8.369 3.550 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -11.020 -7.909 3.429 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -11.741 -9.405 3.987 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -12.280 -8.152 1.245 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -11.138 -9.451 1.527 1.00 0.00 H new ATOM 1026 N GLU A 67 -12.375 -6.497 5.680 1.00 0.00 N ATOM 1027 CA GLU A 67 -12.260 -6.193 7.135 1.00 0.00 C ATOM 1028 C GLU A 67 -13.199 -5.041 7.515 1.00 0.00 C ATOM 1029 O GLU A 67 -13.189 -4.573 8.636 1.00 0.00 O ATOM 1030 CB GLU A 67 -10.816 -5.805 7.456 1.00 0.00 C ATOM 1031 CG GLU A 67 -9.891 -6.988 7.155 1.00 0.00 C ATOM 1032 CD GLU A 67 -8.454 -6.620 7.532 1.00 0.00 C ATOM 1033 OE1 GLU A 67 -7.613 -7.503 7.510 1.00 0.00 O ATOM 1034 OE2 GLU A 67 -8.220 -5.464 7.838 1.00 0.00 O ATOM 0 H GLU A 67 -11.873 -5.859 5.062 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.541 -7.077 7.707 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -10.521 -4.939 6.864 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -10.729 -5.519 8.504 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -10.212 -7.866 7.715 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.946 -7.247 6.098 1.00 0.00 H new ATOM 1042 N ALA A 68 -14.008 -4.575 6.601 1.00 0.00 N ATOM 1043 CA ALA A 68 -14.930 -3.453 6.936 1.00 0.00 C ATOM 1044 C ALA A 68 -16.185 -3.523 6.065 1.00 0.00 C ATOM 1045 O ALA A 68 -17.218 -2.989 6.409 1.00 0.00 O ATOM 1046 CB ALA A 68 -14.221 -2.120 6.689 1.00 0.00 C ATOM 0 H ALA A 68 -14.070 -4.921 5.643 1.00 0.00 H new ATOM 0 HA ALA A 68 -15.217 -3.533 7.985 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -14.895 -1.299 6.934 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -13.332 -2.059 7.316 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -13.931 -2.051 5.641 1.00 0.00 H new ATOM 1052 N GLY A 69 -16.109 -4.169 4.936 1.00 0.00 N ATOM 1053 CA GLY A 69 -17.305 -4.266 4.053 1.00 0.00 C ATOM 1054 C GLY A 69 -17.362 -3.045 3.134 1.00 0.00 C ATOM 1055 O GLY A 69 -18.249 -2.915 2.314 1.00 0.00 O ATOM 0 H GLY A 69 -15.271 -4.634 4.586 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -17.259 -5.179 3.459 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -18.211 -4.323 4.656 1.00 0.00 H new ATOM 1059 N ILE A 70 -16.424 -2.149 3.265 1.00 0.00 N ATOM 1060 CA ILE A 70 -16.426 -0.941 2.400 1.00 0.00 C ATOM 1061 C ILE A 70 -15.337 -1.093 1.333 1.00 0.00 C ATOM 1062 O ILE A 70 -14.195 -1.374 1.636 1.00 0.00 O ATOM 1063 CB ILE A 70 -16.145 0.298 3.254 1.00 0.00 C ATOM 1064 CG1 ILE A 70 -16.980 0.246 4.539 1.00 0.00 C ATOM 1065 CG2 ILE A 70 -16.543 1.541 2.463 1.00 0.00 C ATOM 1066 CD1 ILE A 70 -16.353 1.147 5.607 1.00 0.00 C ATOM 0 H ILE A 70 -15.656 -2.203 3.935 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.398 -0.829 1.919 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.086 0.329 3.509 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -18.001 0.568 4.333 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -17.037 -0.779 4.904 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -16.347 2.431 3.061 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -15.962 1.588 1.542 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -17.604 1.493 2.220 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -16.952 1.104 6.517 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -15.341 0.805 5.823 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.319 2.174 5.243 1.00 0.00 H new ATOM 1078 N GLU A 71 -15.685 -0.927 0.086 1.00 0.00 N ATOM 1079 CA GLU A 71 -14.678 -1.076 -1.005 1.00 0.00 C ATOM 1080 C GLU A 71 -14.511 0.248 -1.753 1.00 0.00 C ATOM 1081 O GLU A 71 -15.274 1.175 -1.574 1.00 0.00 O ATOM 1082 CB GLU A 71 -15.155 -2.152 -1.982 1.00 0.00 C ATOM 1083 CG GLU A 71 -16.415 -1.658 -2.697 1.00 0.00 C ATOM 1084 CD GLU A 71 -16.965 -2.773 -3.588 1.00 0.00 C ATOM 1085 OE1 GLU A 71 -16.313 -3.797 -3.692 1.00 0.00 O ATOM 1086 OE2 GLU A 71 -18.031 -2.584 -4.152 1.00 0.00 O ATOM 0 H GLU A 71 -16.628 -0.694 -0.226 1.00 0.00 H new ATOM 0 HA GLU A 71 -13.720 -1.362 -0.572 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -14.373 -2.373 -2.708 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -15.365 -3.078 -1.448 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -17.166 -1.357 -1.967 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -16.184 -0.778 -3.298 1.00 0.00 H new ATOM 1094 N ALA A 72 -13.519 0.339 -2.603 1.00 0.00 N ATOM 1095 CA ALA A 72 -13.307 1.602 -3.369 1.00 0.00 C ATOM 1096 C ALA A 72 -14.626 2.026 -4.001 1.00 0.00 C ATOM 1097 O ALA A 72 -14.937 3.195 -4.089 1.00 0.00 O ATOM 1098 CB ALA A 72 -12.264 1.364 -4.460 1.00 0.00 C ATOM 0 H ALA A 72 -12.849 -0.405 -2.798 1.00 0.00 H new ATOM 0 HA ALA A 72 -12.954 2.387 -2.701 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -12.107 2.285 -5.021 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -11.324 1.053 -4.003 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -12.615 0.583 -5.135 1.00 0.00 H new ATOM 1104 N GLY A 73 -15.416 1.081 -4.418 1.00 0.00 N ATOM 1105 CA GLY A 73 -16.728 1.430 -5.017 1.00 0.00 C ATOM 1106 C GLY A 73 -17.597 2.076 -3.940 1.00 0.00 C ATOM 1107 O GLY A 73 -18.616 2.671 -4.224 1.00 0.00 O ATOM 0 H GLY A 73 -15.210 0.083 -4.370 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -16.592 2.114 -5.854 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -17.214 0.537 -5.411 1.00 0.00 H new ATOM 1111 N GLN A 74 -17.198 1.951 -2.698 1.00 0.00 N ATOM 1112 CA GLN A 74 -18.002 2.548 -1.595 1.00 0.00 C ATOM 1113 C GLN A 74 -17.237 3.708 -0.932 1.00 0.00 C ATOM 1114 O GLN A 74 -17.812 4.476 -0.186 1.00 0.00 O ATOM 1115 CB GLN A 74 -18.329 1.463 -0.564 1.00 0.00 C ATOM 1116 CG GLN A 74 -19.359 1.994 0.439 1.00 0.00 C ATOM 1117 CD GLN A 74 -20.691 2.229 -0.274 1.00 0.00 C ATOM 1118 OE1 GLN A 74 -21.237 3.414 -0.233 1.00 0.00 O flip ATOM 1119 NE2 GLN A 74 -21.243 1.327 -0.873 1.00 0.00 N flip ATOM 0 H GLN A 74 -16.352 1.462 -2.404 1.00 0.00 H new ATOM 0 HA GLN A 74 -18.929 2.949 -2.004 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -18.719 0.577 -1.066 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -17.422 1.160 -0.041 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -19.491 1.281 1.253 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -19.004 2.923 0.884 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -20.817 0.401 -0.906 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -22.132 1.496 -1.343 1.00 0.00 H new ATOM 1128 N LEU A 75 -15.961 3.872 -1.207 1.00 0.00 N ATOM 1129 CA LEU A 75 -15.226 5.026 -0.592 1.00 0.00 C ATOM 1130 C LEU A 75 -14.498 5.812 -1.677 1.00 0.00 C ATOM 1131 O LEU A 75 -14.560 5.496 -2.849 1.00 0.00 O ATOM 1132 CB LEU A 75 -14.188 4.594 0.466 1.00 0.00 C ATOM 1133 CG LEU A 75 -13.995 3.078 0.492 1.00 0.00 C ATOM 1134 CD1 LEU A 75 -12.749 2.723 -0.311 1.00 0.00 C ATOM 1135 CD2 LEU A 75 -13.795 2.609 1.934 1.00 0.00 C ATOM 0 H LEU A 75 -15.408 3.271 -1.817 1.00 0.00 H new ATOM 0 HA LEU A 75 -15.980 5.636 -0.094 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.234 5.078 0.257 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.509 4.936 1.450 1.00 0.00 H new ATOM 0 HG LEU A 75 -14.874 2.594 0.065 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -12.603 1.643 -0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -12.871 3.060 -1.340 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -11.880 3.212 0.130 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -13.658 1.528 1.949 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.914 3.093 2.355 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -14.671 2.872 2.527 1.00 0.00 H new ATOM 1147 N THR A 76 -13.802 6.839 -1.282 1.00 0.00 N ATOM 1148 CA THR A 76 -13.048 7.669 -2.261 1.00 0.00 C ATOM 1149 C THR A 76 -11.584 7.717 -1.840 1.00 0.00 C ATOM 1150 O THR A 76 -11.251 8.251 -0.804 1.00 0.00 O ATOM 1151 CB THR A 76 -13.627 9.086 -2.267 1.00 0.00 C ATOM 1152 OG1 THR A 76 -14.922 9.064 -2.849 1.00 0.00 O ATOM 1153 CG2 THR A 76 -12.715 10.017 -3.066 1.00 0.00 C ATOM 0 H THR A 76 -13.722 7.143 -0.312 1.00 0.00 H new ATOM 0 HA THR A 76 -13.129 7.240 -3.260 1.00 0.00 H new ATOM 0 HB THR A 76 -13.696 9.452 -1.243 1.00 0.00 H new ATOM 0 HG1 THR A 76 -15.295 9.970 -2.852 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.133 11.024 -3.066 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.725 10.035 -2.611 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.636 9.657 -4.092 1.00 0.00 H new ATOM 1161 N ILE A 77 -10.705 7.171 -2.632 1.00 0.00 N ATOM 1162 CA ILE A 77 -9.264 7.193 -2.261 1.00 0.00 C ATOM 1163 C ILE A 77 -8.674 8.543 -2.668 1.00 0.00 C ATOM 1164 O ILE A 77 -8.816 8.976 -3.795 1.00 0.00 O ATOM 1165 CB ILE A 77 -8.527 6.068 -2.997 1.00 0.00 C ATOM 1166 CG1 ILE A 77 -9.368 4.784 -2.965 1.00 0.00 C ATOM 1167 CG2 ILE A 77 -7.178 5.814 -2.319 1.00 0.00 C ATOM 1168 CD1 ILE A 77 -9.460 4.243 -1.536 1.00 0.00 C ATOM 0 H ILE A 77 -10.921 6.712 -3.517 1.00 0.00 H new ATOM 0 HA ILE A 77 -9.154 7.048 -1.186 1.00 0.00 H new ATOM 0 HB ILE A 77 -8.365 6.363 -4.034 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -10.368 4.987 -3.349 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -8.922 4.033 -3.617 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.653 5.014 -2.841 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.578 6.723 -2.351 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -7.341 5.523 -1.281 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -10.059 3.333 -1.530 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -8.459 4.021 -1.166 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -9.927 4.990 -0.894 1.00 0.00 H new ATOM 1180 N ILE A 78 -8.024 9.224 -1.764 1.00 0.00 N ATOM 1181 CA ILE A 78 -7.445 10.550 -2.113 1.00 0.00 C ATOM 1182 C ILE A 78 -6.057 10.364 -2.722 1.00 0.00 C ATOM 1183 O ILE A 78 -5.275 9.539 -2.290 1.00 0.00 O ATOM 1184 CB ILE A 78 -7.366 11.428 -0.863 1.00 0.00 C ATOM 1185 CG1 ILE A 78 -8.396 12.552 -0.986 1.00 0.00 C ATOM 1186 CG2 ILE A 78 -5.965 12.034 -0.724 1.00 0.00 C ATOM 1187 CD1 ILE A 78 -9.803 11.952 -1.035 1.00 0.00 C ATOM 0 H ILE A 78 -7.870 8.920 -0.803 1.00 0.00 H new ATOM 0 HA ILE A 78 -8.086 11.042 -2.845 1.00 0.00 H new ATOM 0 HB ILE A 78 -7.572 10.821 0.018 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -8.309 13.234 -0.140 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -8.207 13.136 -1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -5.925 12.656 0.170 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.229 11.234 -0.643 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.744 12.643 -1.600 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -10.537 12.753 -1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -9.886 11.288 -1.896 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -9.990 11.387 -0.122 1.00 0.00 H new ATOM 1199 N GLU A 79 -5.761 11.120 -3.739 1.00 0.00 N ATOM 1200 CA GLU A 79 -4.439 10.998 -4.415 1.00 0.00 C ATOM 1201 C GLU A 79 -3.501 12.115 -3.950 1.00 0.00 C ATOM 1202 O GLU A 79 -3.930 13.193 -3.591 1.00 0.00 O ATOM 1203 CB GLU A 79 -4.645 11.101 -5.924 1.00 0.00 C ATOM 1204 CG GLU A 79 -5.593 9.990 -6.379 1.00 0.00 C ATOM 1205 CD GLU A 79 -5.794 10.071 -7.894 1.00 0.00 C ATOM 1206 OE1 GLU A 79 -5.348 11.045 -8.478 1.00 0.00 O ATOM 1207 OE2 GLU A 79 -6.394 9.160 -8.441 1.00 0.00 O ATOM 0 H GLU A 79 -6.383 11.824 -4.136 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.991 10.037 -4.162 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -5.059 12.076 -6.181 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -3.689 11.014 -6.440 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -5.184 9.017 -6.108 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -6.552 10.086 -5.870 1.00 0.00 H new ATOM 1215 N GLY A 80 -2.221 11.864 -3.966 1.00 0.00 N ATOM 1216 CA GLY A 80 -1.246 12.906 -3.536 1.00 0.00 C ATOM 1217 C GLY A 80 -0.712 12.576 -2.142 1.00 0.00 C ATOM 1218 O GLY A 80 0.350 13.020 -1.756 1.00 0.00 O ATOM 0 H GLY A 80 -1.807 10.979 -4.259 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -0.422 12.961 -4.247 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -1.726 13.885 -3.529 1.00 0.00 H new ATOM 1222 N PHE A 81 -1.435 11.797 -1.384 1.00 0.00 N ATOM 1223 CA PHE A 81 -0.956 11.442 -0.017 1.00 0.00 C ATOM 1224 C PHE A 81 -0.599 9.960 0.055 1.00 0.00 C ATOM 1225 O PHE A 81 -1.408 9.104 -0.248 1.00 0.00 O ATOM 1226 CB PHE A 81 -2.050 11.723 1.008 1.00 0.00 C ATOM 1227 CG PHE A 81 -1.613 11.162 2.339 1.00 0.00 C ATOM 1228 CD1 PHE A 81 -1.786 9.800 2.611 1.00 0.00 C ATOM 1229 CD2 PHE A 81 -1.017 11.995 3.290 1.00 0.00 C ATOM 1230 CE1 PHE A 81 -1.367 9.271 3.837 1.00 0.00 C ATOM 1231 CE2 PHE A 81 -0.596 11.465 4.515 1.00 0.00 C ATOM 1232 CZ PHE A 81 -0.772 10.105 4.789 1.00 0.00 C ATOM 0 H PHE A 81 -2.333 11.392 -1.650 1.00 0.00 H new ATOM 0 HA PHE A 81 -0.074 12.044 0.200 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -2.227 12.795 1.089 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -2.989 11.267 0.695 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -2.243 9.157 1.874 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -0.882 13.046 3.080 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -1.503 8.220 4.048 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -0.134 12.108 5.250 1.00 0.00 H new ATOM 0 HZ PHE A 81 -0.448 9.699 5.736 1.00 0.00 H new ATOM 1242 N LYS A 82 0.591 9.643 0.483 1.00 0.00 N ATOM 1243 CA LYS A 82 0.965 8.208 0.603 1.00 0.00 C ATOM 1244 C LYS A 82 2.130 8.051 1.579 1.00 0.00 C ATOM 1245 O LYS A 82 3.193 8.614 1.396 1.00 0.00 O ATOM 1246 CB LYS A 82 1.373 7.647 -0.754 1.00 0.00 C ATOM 1247 CG LYS A 82 0.679 6.299 -0.977 1.00 0.00 C ATOM 1248 CD LYS A 82 1.682 5.281 -1.518 1.00 0.00 C ATOM 1249 CE LYS A 82 2.436 5.861 -2.714 1.00 0.00 C ATOM 1250 NZ LYS A 82 1.642 6.962 -3.328 1.00 0.00 N ATOM 0 H LYS A 82 1.315 10.309 0.753 1.00 0.00 H new ATOM 0 HA LYS A 82 0.099 7.659 0.973 1.00 0.00 H new ATOM 0 HB2 LYS A 82 1.099 8.345 -1.545 1.00 0.00 H new ATOM 0 HB3 LYS A 82 2.455 7.523 -0.798 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.253 5.940 -0.040 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -0.147 6.417 -1.678 1.00 0.00 H new ATOM 0 HD2 LYS A 82 2.387 5.004 -0.735 1.00 0.00 H new ATOM 0 HD3 LYS A 82 1.162 4.370 -1.815 1.00 0.00 H new ATOM 0 HE2 LYS A 82 3.408 6.236 -2.395 1.00 0.00 H new ATOM 0 HE3 LYS A 82 2.622 5.080 -3.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 1.767 6.946 -4.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 0.636 6.833 -3.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 1.968 7.876 -2.953 1.00 0.00 H new ATOM 1264 N ARG A 83 1.939 7.273 2.600 1.00 0.00 N ATOM 1265 CA ARG A 83 3.021 7.040 3.592 1.00 0.00 C ATOM 1266 C ARG A 83 2.904 5.602 4.090 1.00 0.00 C ATOM 1267 O ARG A 83 1.819 5.132 4.370 1.00 0.00 O ATOM 1268 CB ARG A 83 2.857 8.006 4.771 1.00 0.00 C ATOM 1269 CG ARG A 83 4.059 7.891 5.712 1.00 0.00 C ATOM 1270 CD ARG A 83 5.232 8.701 5.152 1.00 0.00 C ATOM 1271 NE ARG A 83 6.420 8.529 6.034 1.00 0.00 N ATOM 1272 CZ ARG A 83 7.195 7.489 5.886 1.00 0.00 C ATOM 1273 NH1 ARG A 83 6.929 6.603 4.966 1.00 0.00 N ATOM 1274 NH2 ARG A 83 8.237 7.339 6.658 1.00 0.00 N ATOM 0 H ARG A 83 1.067 6.781 2.794 1.00 0.00 H new ATOM 0 HA ARG A 83 3.996 7.206 3.134 1.00 0.00 H new ATOM 0 HB2 ARG A 83 2.768 9.029 4.404 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.938 7.780 5.312 1.00 0.00 H new ATOM 0 HG2 ARG A 83 3.793 8.256 6.704 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.347 6.846 5.824 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.466 8.370 4.140 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.962 9.755 5.088 1.00 0.00 H new ATOM 0 HE ARG A 83 6.628 9.223 6.752 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.116 6.723 4.362 1.00 0.00 H new ATOM 0 HH12 ARG A 83 7.535 5.790 4.850 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.444 8.034 7.375 1.00 0.00 H new ATOM 0 HH22 ARG A 83 8.844 6.527 6.544 1.00 0.00 H new ATOM 1288 N GLU A 84 3.992 4.890 4.205 1.00 0.00 N ATOM 1289 CA GLU A 84 3.880 3.486 4.687 1.00 0.00 C ATOM 1290 C GLU A 84 4.500 3.348 6.069 1.00 0.00 C ATOM 1291 O GLU A 84 5.552 3.885 6.348 1.00 0.00 O ATOM 1292 CB GLU A 84 4.580 2.522 3.726 1.00 0.00 C ATOM 1293 CG GLU A 84 6.003 2.997 3.443 1.00 0.00 C ATOM 1294 CD GLU A 84 5.963 4.284 2.619 1.00 0.00 C ATOM 1295 OE1 GLU A 84 6.980 4.955 2.555 1.00 0.00 O ATOM 1296 OE2 GLU A 84 4.919 4.575 2.064 1.00 0.00 O ATOM 0 H GLU A 84 4.936 5.212 3.991 1.00 0.00 H new ATOM 0 HA GLU A 84 2.820 3.235 4.735 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.602 1.521 4.156 1.00 0.00 H new ATOM 0 HB3 GLU A 84 4.019 2.456 2.794 1.00 0.00 H new ATOM 0 HG2 GLU A 84 6.532 3.170 4.380 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.554 2.226 2.904 1.00 0.00 H new ATOM 1304 N LEU A 85 3.858 2.617 6.937 1.00 0.00 N ATOM 1305 CA LEU A 85 4.423 2.429 8.293 1.00 0.00 C ATOM 1306 C LEU A 85 5.128 1.076 8.325 1.00 0.00 C ATOM 1307 O LEU A 85 4.513 0.045 8.142 1.00 0.00 O ATOM 1308 CB LEU A 85 3.296 2.445 9.331 1.00 0.00 C ATOM 1309 CG LEU A 85 2.328 3.596 9.032 1.00 0.00 C ATOM 1310 CD1 LEU A 85 1.435 3.848 10.252 1.00 0.00 C ATOM 1311 CD2 LEU A 85 3.105 4.871 8.702 1.00 0.00 C ATOM 0 H LEU A 85 2.971 2.145 6.763 1.00 0.00 H new ATOM 0 HA LEU A 85 5.124 3.231 8.525 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.761 1.495 9.315 1.00 0.00 H new ATOM 0 HB3 LEU A 85 3.713 2.559 10.332 1.00 0.00 H new ATOM 0 HG LEU A 85 1.712 3.322 8.175 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.748 4.666 10.037 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.866 2.946 10.479 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.055 4.111 11.109 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.405 5.680 8.492 1.00 0.00 H new ATOM 0 HD22 LEU A 85 3.732 5.145 9.551 1.00 0.00 H new ATOM 0 HD23 LEU A 85 3.733 4.698 7.828 1.00 0.00 H new ATOM 1323 N ASN A 86 6.414 1.070 8.539 1.00 0.00 N ATOM 1324 CA ASN A 86 7.150 -0.223 8.560 1.00 0.00 C ATOM 1325 C ASN A 86 7.760 -0.443 9.943 1.00 0.00 C ATOM 1326 O ASN A 86 8.586 0.323 10.401 1.00 0.00 O ATOM 1327 CB ASN A 86 8.267 -0.179 7.514 1.00 0.00 C ATOM 1328 CG ASN A 86 7.719 0.416 6.216 1.00 0.00 C ATOM 1329 OD1 ASN A 86 6.549 0.724 6.123 1.00 0.00 O ATOM 1330 ND2 ASN A 86 8.521 0.593 5.203 1.00 0.00 N ATOM 0 H ASN A 86 6.984 1.900 8.699 1.00 0.00 H new ATOM 0 HA ASN A 86 6.463 -1.039 8.335 1.00 0.00 H new ATOM 0 HB2 ASN A 86 9.100 0.421 7.880 1.00 0.00 H new ATOM 0 HB3 ASN A 86 8.652 -1.183 7.334 1.00 0.00 H new ATOM 0 HD21 ASN A 86 8.165 0.990 4.334 1.00 0.00 H new ATOM 0 HD22 ASN A 86 9.505 0.334 5.280 1.00 0.00 H new ATOM 1337 N TYR A 87 7.368 -1.492 10.611 1.00 0.00 N ATOM 1338 CA TYR A 87 7.933 -1.769 11.955 1.00 0.00 C ATOM 1339 C TYR A 87 7.902 -3.270 12.214 1.00 0.00 C ATOM 1340 O TYR A 87 7.080 -3.987 11.676 1.00 0.00 O ATOM 1341 CB TYR A 87 7.113 -1.041 13.021 1.00 0.00 C ATOM 1342 CG TYR A 87 5.640 -1.267 12.774 1.00 0.00 C ATOM 1343 CD1 TYR A 87 5.035 -2.453 13.202 1.00 0.00 C ATOM 1344 CD2 TYR A 87 4.879 -0.290 12.117 1.00 0.00 C ATOM 1345 CE1 TYR A 87 3.671 -2.665 12.977 1.00 0.00 C ATOM 1346 CE2 TYR A 87 3.513 -0.502 11.891 1.00 0.00 C ATOM 1347 CZ TYR A 87 2.908 -1.689 12.322 1.00 0.00 C ATOM 1348 OH TYR A 87 1.562 -1.900 12.100 1.00 0.00 O ATOM 0 H TYR A 87 6.680 -2.169 10.281 1.00 0.00 H new ATOM 0 HA TYR A 87 8.963 -1.415 11.997 1.00 0.00 H new ATOM 0 HB2 TYR A 87 7.385 -1.403 14.013 1.00 0.00 H new ATOM 0 HB3 TYR A 87 7.336 0.026 12.999 1.00 0.00 H new ATOM 0 HD1 TYR A 87 5.622 -3.206 13.707 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.346 0.626 11.785 1.00 0.00 H new ATOM 0 HE1 TYR A 87 3.205 -3.581 13.308 1.00 0.00 H new ATOM 0 HE2 TYR A 87 2.926 0.250 11.384 1.00 0.00 H new ATOM 0 HH TYR A 87 1.182 -1.125 11.636 1.00 0.00 H new ATOM 1358 N VAL A 88 8.790 -3.750 13.032 1.00 0.00 N ATOM 1359 CA VAL A 88 8.816 -5.207 13.330 1.00 0.00 C ATOM 1360 C VAL A 88 8.342 -5.438 14.767 1.00 0.00 C ATOM 1361 O VAL A 88 9.050 -5.172 15.718 1.00 0.00 O ATOM 1362 CB VAL A 88 10.242 -5.737 13.155 1.00 0.00 C ATOM 1363 CG1 VAL A 88 11.184 -5.004 14.108 1.00 0.00 C ATOM 1364 CG2 VAL A 88 10.278 -7.232 13.465 1.00 0.00 C ATOM 0 H VAL A 88 9.501 -3.196 13.509 1.00 0.00 H new ATOM 0 HA VAL A 88 8.153 -5.736 12.645 1.00 0.00 H new ATOM 0 HB VAL A 88 10.560 -5.570 12.126 1.00 0.00 H new ATOM 0 HG11 VAL A 88 12.198 -5.384 13.981 1.00 0.00 H new ATOM 0 HG12 VAL A 88 11.166 -3.937 13.888 1.00 0.00 H new ATOM 0 HG13 VAL A 88 10.861 -5.168 15.136 1.00 0.00 H new ATOM 0 HG21 VAL A 88 11.294 -7.605 13.339 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.955 -7.398 14.493 1.00 0.00 H new ATOM 0 HG23 VAL A 88 9.611 -7.761 12.785 1.00 0.00 H new ATOM 1374 N ALA A 89 7.148 -5.937 14.927 1.00 0.00 N ATOM 1375 CA ALA A 89 6.623 -6.190 16.300 1.00 0.00 C ATOM 1376 C ALA A 89 6.707 -7.687 16.608 1.00 0.00 C ATOM 1377 O ALA A 89 7.509 -8.125 17.410 1.00 0.00 O ATOM 1378 CB ALA A 89 5.165 -5.735 16.378 1.00 0.00 C ATOM 0 H ALA A 89 6.512 -6.181 14.167 1.00 0.00 H new ATOM 0 HA ALA A 89 7.217 -5.635 17.026 1.00 0.00 H new ATOM 0 HB1 ALA A 89 4.780 -5.919 17.381 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.104 -4.670 16.156 1.00 0.00 H new ATOM 0 HB3 ALA A 89 4.571 -6.291 15.653 1.00 0.00 H new ATOM 1384 N ARG A 90 5.884 -8.472 15.972 1.00 0.00 N ATOM 1385 CA ARG A 90 5.903 -9.942 16.213 1.00 0.00 C ATOM 1386 C ARG A 90 7.267 -10.513 15.816 1.00 0.00 C ATOM 1387 O ARG A 90 7.456 -11.711 15.774 1.00 0.00 O ATOM 1388 CB ARG A 90 4.806 -10.606 15.379 1.00 0.00 C ATOM 1389 CG ARG A 90 5.112 -10.420 13.891 1.00 0.00 C ATOM 1390 CD ARG A 90 3.883 -10.803 13.062 1.00 0.00 C ATOM 1391 NE ARG A 90 2.855 -9.731 13.172 1.00 0.00 N ATOM 1392 CZ ARG A 90 1.880 -9.835 14.037 1.00 0.00 C ATOM 1393 NH1 ARG A 90 1.800 -10.881 14.815 1.00 0.00 N ATOM 1394 NH2 ARG A 90 0.982 -8.891 14.121 1.00 0.00 N ATOM 0 H ARG A 90 5.194 -8.156 15.291 1.00 0.00 H new ATOM 0 HA ARG A 90 5.727 -10.139 17.271 1.00 0.00 H new ATOM 0 HB2 ARG A 90 4.745 -11.668 15.619 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.837 -10.169 15.619 1.00 0.00 H new ATOM 0 HG2 ARG A 90 5.388 -9.384 13.693 1.00 0.00 H new ATOM 0 HG3 ARG A 90 5.963 -11.038 13.604 1.00 0.00 H new ATOM 0 HD2 ARG A 90 4.165 -10.945 12.019 1.00 0.00 H new ATOM 0 HD3 ARG A 90 3.475 -11.750 13.414 1.00 0.00 H new ATOM 0 HE ARG A 90 2.912 -8.910 12.569 1.00 0.00 H new ATOM 0 HH11 ARG A 90 2.500 -11.620 14.749 1.00 0.00 H new ATOM 0 HH12 ARG A 90 1.038 -10.959 15.489 1.00 0.00 H new ATOM 0 HH21 ARG A 90 1.042 -8.075 13.513 1.00 0.00 H new ATOM 0 HH22 ARG A 90 0.221 -8.970 14.795 1.00 0.00 H new ATOM 1408 N ASN A 91 8.208 -9.655 15.508 1.00 0.00 N ATOM 1409 CA ASN A 91 9.571 -10.112 15.091 1.00 0.00 C ATOM 1410 C ASN A 91 9.618 -10.184 13.566 1.00 0.00 C ATOM 1411 O ASN A 91 10.390 -10.918 12.985 1.00 0.00 O ATOM 1412 CB ASN A 91 9.881 -11.492 15.681 1.00 0.00 C ATOM 1413 CG ASN A 91 11.398 -11.692 15.736 1.00 0.00 C ATOM 1414 OD1 ASN A 91 12.150 -10.836 15.317 1.00 0.00 O ATOM 1415 ND2 ASN A 91 11.881 -12.795 16.242 1.00 0.00 N ATOM 0 H ASN A 91 8.088 -8.642 15.528 1.00 0.00 H new ATOM 0 HA ASN A 91 10.316 -9.406 15.459 1.00 0.00 H new ATOM 0 HB2 ASN A 91 9.455 -11.576 16.681 1.00 0.00 H new ATOM 0 HB3 ASN A 91 9.422 -12.271 15.073 1.00 0.00 H new ATOM 0 HD21 ASN A 91 12.890 -12.937 16.285 1.00 0.00 H new ATOM 0 HD22 ASN A 91 11.249 -13.514 16.594 1.00 0.00 H new ATOM 1422 N LYS A 92 8.795 -9.406 12.920 1.00 0.00 N ATOM 1423 CA LYS A 92 8.771 -9.388 11.433 1.00 0.00 C ATOM 1424 C LYS A 92 8.375 -7.978 10.974 1.00 0.00 C ATOM 1425 O LYS A 92 7.347 -7.464 11.367 1.00 0.00 O ATOM 1426 CB LYS A 92 7.733 -10.394 10.930 1.00 0.00 C ATOM 1427 CG LYS A 92 8.346 -11.272 9.834 1.00 0.00 C ATOM 1428 CD LYS A 92 9.256 -12.331 10.469 1.00 0.00 C ATOM 1429 CE LYS A 92 9.594 -13.409 9.434 1.00 0.00 C ATOM 1430 NZ LYS A 92 11.070 -13.465 9.238 1.00 0.00 N ATOM 0 H LYS A 92 8.130 -8.774 13.366 1.00 0.00 H new ATOM 0 HA LYS A 92 9.751 -9.654 11.037 1.00 0.00 H new ATOM 0 HB2 LYS A 92 7.387 -11.016 11.755 1.00 0.00 H new ATOM 0 HB3 LYS A 92 6.862 -9.867 10.541 1.00 0.00 H new ATOM 0 HG2 LYS A 92 7.557 -11.755 9.258 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.918 -10.657 9.139 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.171 -11.866 10.836 1.00 0.00 H new ATOM 0 HD3 LYS A 92 8.761 -12.782 11.329 1.00 0.00 H new ATOM 0 HE2 LYS A 92 9.224 -14.378 9.769 1.00 0.00 H new ATOM 0 HE3 LYS A 92 9.099 -13.188 8.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 11.299 -14.197 8.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 11.411 -12.542 8.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 11.532 -13.695 10.141 1.00 0.00 H new ATOM 1444 N PRO A 93 9.184 -7.350 10.163 1.00 0.00 N ATOM 1445 CA PRO A 93 8.906 -5.975 9.666 1.00 0.00 C ATOM 1446 C PRO A 93 7.898 -5.982 8.536 1.00 0.00 C ATOM 1447 O PRO A 93 8.077 -6.656 7.543 1.00 0.00 O ATOM 1448 CB PRO A 93 10.251 -5.502 9.153 1.00 0.00 C ATOM 1449 CG PRO A 93 10.936 -6.749 8.708 1.00 0.00 C ATOM 1450 CD PRO A 93 10.442 -7.872 9.617 1.00 0.00 C ATOM 0 HA PRO A 93 8.483 -5.338 10.443 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.137 -4.796 8.331 1.00 0.00 H new ATOM 0 HB3 PRO A 93 10.818 -4.994 9.933 1.00 0.00 H new ATOM 0 HG2 PRO A 93 10.705 -6.966 7.665 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.018 -6.642 8.779 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.284 -8.797 9.062 1.00 0.00 H new ATOM 0 HD3 PRO A 93 11.160 -8.093 10.407 1.00 0.00 H new ATOM 1458 N LYS A 94 6.849 -5.241 8.673 1.00 0.00 N ATOM 1459 CA LYS A 94 5.823 -5.218 7.602 1.00 0.00 C ATOM 1460 C LYS A 94 5.611 -3.792 7.106 1.00 0.00 C ATOM 1461 O LYS A 94 5.226 -2.910 7.847 1.00 0.00 O ATOM 1462 CB LYS A 94 4.511 -5.785 8.154 1.00 0.00 C ATOM 1463 CG LYS A 94 3.499 -5.938 7.020 1.00 0.00 C ATOM 1464 CD LYS A 94 2.646 -7.189 7.254 1.00 0.00 C ATOM 1465 CE LYS A 94 1.706 -6.962 8.437 1.00 0.00 C ATOM 1466 NZ LYS A 94 1.422 -8.264 9.107 1.00 0.00 N ATOM 0 H LYS A 94 6.653 -4.648 9.479 1.00 0.00 H new ATOM 0 HA LYS A 94 6.160 -5.827 6.763 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.691 -6.751 8.626 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.113 -5.123 8.923 1.00 0.00 H new ATOM 0 HG2 LYS A 94 2.861 -5.056 6.968 1.00 0.00 H new ATOM 0 HG3 LYS A 94 4.018 -6.013 6.064 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.069 -7.419 6.358 1.00 0.00 H new ATOM 0 HD3 LYS A 94 3.289 -8.047 7.448 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.158 -6.268 9.146 1.00 0.00 H new ATOM 0 HE3 LYS A 94 0.777 -6.508 8.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 0.404 -8.337 9.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.710 -9.045 8.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.954 -8.319 9.999 1.00 0.00 H new ATOM 1480 N THR A 95 5.841 -3.567 5.842 1.00 0.00 N ATOM 1481 CA THR A 95 5.638 -2.207 5.281 1.00 0.00 C ATOM 1482 C THR A 95 4.149 -2.018 5.029 1.00 0.00 C ATOM 1483 O THR A 95 3.509 -2.842 4.405 1.00 0.00 O ATOM 1484 CB THR A 95 6.399 -2.072 3.958 1.00 0.00 C ATOM 1485 OG1 THR A 95 7.797 -2.135 4.205 1.00 0.00 O ATOM 1486 CG2 THR A 95 6.051 -0.737 3.287 1.00 0.00 C ATOM 0 H THR A 95 6.161 -4.269 5.175 1.00 0.00 H new ATOM 0 HA THR A 95 6.007 -1.454 5.978 1.00 0.00 H new ATOM 0 HB THR A 95 6.111 -2.888 3.295 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.283 -2.050 3.358 1.00 0.00 H new ATOM 0 HG21 THR A 95 6.596 -0.649 2.347 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.980 -0.697 3.090 1.00 0.00 H new ATOM 0 HG23 THR A 95 6.330 0.085 3.946 1.00 0.00 H new ATOM 1494 N VAL A 96 3.585 -0.951 5.508 1.00 0.00 N ATOM 1495 CA VAL A 96 2.134 -0.730 5.295 1.00 0.00 C ATOM 1496 C VAL A 96 1.925 0.597 4.574 1.00 0.00 C ATOM 1497 O VAL A 96 2.221 1.641 5.101 1.00 0.00 O ATOM 1498 CB VAL A 96 1.439 -0.681 6.656 1.00 0.00 C ATOM 1499 CG1 VAL A 96 -0.067 -0.509 6.459 1.00 0.00 C ATOM 1500 CG2 VAL A 96 1.706 -1.985 7.412 1.00 0.00 C ATOM 0 H VAL A 96 4.065 -0.223 6.037 1.00 0.00 H new ATOM 0 HA VAL A 96 1.719 -1.538 4.693 1.00 0.00 H new ATOM 0 HB VAL A 96 1.828 0.161 7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.559 -0.474 7.431 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.260 0.419 5.921 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -0.457 -1.349 5.884 1.00 0.00 H new ATOM 0 HG21 VAL A 96 1.211 -1.951 8.382 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.318 -2.825 6.836 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.779 -2.109 7.556 1.00 0.00 H new ATOM 1510 N ILE A 97 1.391 0.562 3.386 1.00 0.00 N ATOM 1511 CA ILE A 97 1.145 1.828 2.642 1.00 0.00 C ATOM 1512 C ILE A 97 -0.294 2.252 2.908 1.00 0.00 C ATOM 1513 O ILE A 97 -1.208 1.459 2.816 1.00 0.00 O ATOM 1514 CB ILE A 97 1.371 1.589 1.147 1.00 0.00 C ATOM 1515 CG1 ILE A 97 2.785 1.019 0.944 1.00 0.00 C ATOM 1516 CG2 ILE A 97 1.216 2.906 0.380 1.00 0.00 C ATOM 1517 CD1 ILE A 97 3.748 2.115 0.469 1.00 0.00 C ATOM 0 H ILE A 97 1.114 -0.289 2.897 1.00 0.00 H new ATOM 0 HA ILE A 97 1.827 2.614 2.968 1.00 0.00 H new ATOM 0 HB ILE A 97 0.634 0.880 0.769 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.147 0.590 1.878 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.756 0.212 0.212 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.378 2.729 -0.683 1.00 0.00 H new ATOM 0 HG22 ILE A 97 0.211 3.300 0.533 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.948 3.627 0.744 1.00 0.00 H new ATOM 0 HD11 ILE A 97 4.743 1.691 0.332 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.394 2.525 -0.477 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.792 2.909 1.215 1.00 0.00 H new ATOM 1529 N TYR A 98 -0.507 3.486 3.280 1.00 0.00 N ATOM 1530 CA TYR A 98 -1.894 3.922 3.593 1.00 0.00 C ATOM 1531 C TYR A 98 -2.372 5.023 2.652 1.00 0.00 C ATOM 1532 O TYR A 98 -1.697 6.005 2.418 1.00 0.00 O ATOM 1533 CB TYR A 98 -1.943 4.474 5.017 1.00 0.00 C ATOM 1534 CG TYR A 98 -1.949 3.348 6.026 1.00 0.00 C ATOM 1535 CD1 TYR A 98 -2.994 2.416 6.037 1.00 0.00 C ATOM 1536 CD2 TYR A 98 -0.919 3.251 6.970 1.00 0.00 C ATOM 1537 CE1 TYR A 98 -3.007 1.389 6.988 1.00 0.00 C ATOM 1538 CE2 TYR A 98 -0.930 2.223 7.918 1.00 0.00 C ATOM 1539 CZ TYR A 98 -1.976 1.292 7.928 1.00 0.00 C ATOM 1540 OH TYR A 98 -1.992 0.278 8.867 1.00 0.00 O ATOM 0 H TYR A 98 0.212 4.202 3.379 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.541 3.052 3.478 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.083 5.121 5.191 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.835 5.088 5.144 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -3.790 2.490 5.311 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -0.115 3.972 6.966 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -3.814 0.671 6.996 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -0.132 2.147 8.642 1.00 0.00 H new ATOM 0 HH TYR A 98 -1.203 0.354 9.444 1.00 0.00 H new ATOM 1550 N TRP A 99 -3.572 4.880 2.166 1.00 0.00 N ATOM 1551 CA TRP A 99 -4.170 5.924 1.296 1.00 0.00 C ATOM 1552 C TRP A 99 -5.363 6.501 2.054 1.00 0.00 C ATOM 1553 O TRP A 99 -6.085 5.780 2.709 1.00 0.00 O ATOM 1554 CB TRP A 99 -4.666 5.309 -0.016 1.00 0.00 C ATOM 1555 CG TRP A 99 -3.519 5.036 -0.932 1.00 0.00 C ATOM 1556 CD1 TRP A 99 -3.023 5.908 -1.839 1.00 0.00 C ATOM 1557 CD2 TRP A 99 -2.730 3.821 -1.057 1.00 0.00 C ATOM 1558 NE1 TRP A 99 -1.979 5.304 -2.513 1.00 0.00 N ATOM 1559 CE2 TRP A 99 -1.757 4.016 -2.065 1.00 0.00 C ATOM 1560 CE3 TRP A 99 -2.761 2.580 -0.397 1.00 0.00 C ATOM 1561 CZ2 TRP A 99 -0.851 3.015 -2.408 1.00 0.00 C ATOM 1562 CZ3 TRP A 99 -1.849 1.571 -0.740 1.00 0.00 C ATOM 1563 CH2 TRP A 99 -0.898 1.788 -1.743 1.00 0.00 C ATOM 0 H TRP A 99 -4.171 4.072 2.338 1.00 0.00 H new ATOM 0 HA TRP A 99 -3.431 6.689 1.058 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -5.203 4.383 0.190 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -5.371 5.986 -0.498 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -3.384 6.912 -2.009 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -1.438 5.754 -3.251 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -3.491 2.403 0.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -0.118 3.187 -3.182 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -1.881 0.621 -0.227 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -0.200 1.006 -2.003 1.00 0.00 H new ATOM 1574 N LEU A 100 -5.593 7.777 1.985 1.00 0.00 N ATOM 1575 CA LEU A 100 -6.759 8.330 2.724 1.00 0.00 C ATOM 1576 C LEU A 100 -8.018 7.992 1.932 1.00 0.00 C ATOM 1577 O LEU A 100 -8.057 8.135 0.727 1.00 0.00 O ATOM 1578 CB LEU A 100 -6.620 9.845 2.864 1.00 0.00 C ATOM 1579 CG LEU A 100 -5.140 10.222 2.873 1.00 0.00 C ATOM 1580 CD1 LEU A 100 -4.987 11.691 3.258 1.00 0.00 C ATOM 1581 CD2 LEU A 100 -4.394 9.353 3.889 1.00 0.00 C ATOM 0 H LEU A 100 -5.037 8.452 1.460 1.00 0.00 H new ATOM 0 HA LEU A 100 -6.813 7.899 3.724 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.129 10.345 2.040 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.097 10.181 3.784 1.00 0.00 H new ATOM 0 HG LEU A 100 -4.723 10.060 1.879 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.930 11.957 3.264 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.514 12.313 2.535 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.407 11.853 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -3.338 9.624 3.894 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -4.814 9.513 4.882 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -4.498 8.303 3.616 1.00 0.00 H new ATOM 1593 N ALA A 101 -9.042 7.522 2.589 1.00 0.00 N ATOM 1594 CA ALA A 101 -10.280 7.158 1.849 1.00 0.00 C ATOM 1595 C ALA A 101 -11.506 7.705 2.574 1.00 0.00 C ATOM 1596 O ALA A 101 -11.503 7.892 3.774 1.00 0.00 O ATOM 1597 CB ALA A 101 -10.384 5.634 1.756 1.00 0.00 C ATOM 0 H ALA A 101 -9.075 7.376 3.598 1.00 0.00 H new ATOM 0 HA ALA A 101 -10.237 7.589 0.849 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -11.290 5.364 1.214 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -9.515 5.242 1.228 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -10.421 5.210 2.759 1.00 0.00 H new ATOM 1603 N GLU A 102 -12.558 7.961 1.846 1.00 0.00 N ATOM 1604 CA GLU A 102 -13.793 8.497 2.477 1.00 0.00 C ATOM 1605 C GLU A 102 -14.982 7.616 2.089 1.00 0.00 C ATOM 1606 O GLU A 102 -15.281 7.451 0.925 1.00 0.00 O ATOM 1607 CB GLU A 102 -14.034 9.922 1.971 1.00 0.00 C ATOM 1608 CG GLU A 102 -15.249 10.525 2.674 1.00 0.00 C ATOM 1609 CD GLU A 102 -15.560 11.891 2.061 1.00 0.00 C ATOM 1610 OE1 GLU A 102 -16.486 12.532 2.532 1.00 0.00 O ATOM 1611 OE2 GLU A 102 -14.870 12.271 1.131 1.00 0.00 O ATOM 0 H GLU A 102 -12.614 7.821 0.837 1.00 0.00 H new ATOM 0 HA GLU A 102 -13.681 8.503 3.561 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -13.153 10.537 2.157 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -14.194 9.912 0.893 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -16.109 9.863 2.571 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -15.052 10.629 3.741 1.00 0.00 H new ATOM 1619 N VAL A 103 -15.667 7.054 3.049 1.00 0.00 N ATOM 1620 CA VAL A 103 -16.835 6.192 2.713 1.00 0.00 C ATOM 1621 C VAL A 103 -18.017 7.083 2.318 1.00 0.00 C ATOM 1622 O VAL A 103 -18.333 8.059 2.971 1.00 0.00 O ATOM 1623 CB VAL A 103 -17.176 5.300 3.906 1.00 0.00 C ATOM 1624 CG1 VAL A 103 -15.900 4.640 4.400 1.00 0.00 C ATOM 1625 CG2 VAL A 103 -17.769 6.126 5.042 1.00 0.00 C ATOM 0 H VAL A 103 -15.469 7.154 4.045 1.00 0.00 H new ATOM 0 HA VAL A 103 -16.598 5.543 1.870 1.00 0.00 H new ATOM 0 HB VAL A 103 -17.905 4.553 3.593 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -16.128 4.000 5.252 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -15.468 4.039 3.600 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -15.187 5.407 4.703 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -18.005 5.473 5.882 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -17.048 6.879 5.359 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -18.679 6.618 4.698 1.00 0.00 H new ATOM 1635 N LYS A 104 -18.642 6.762 1.221 1.00 0.00 N ATOM 1636 CA LYS A 104 -19.778 7.584 0.708 1.00 0.00 C ATOM 1637 C LYS A 104 -20.911 7.678 1.734 1.00 0.00 C ATOM 1638 O LYS A 104 -21.514 8.719 1.902 1.00 0.00 O ATOM 1639 CB LYS A 104 -20.318 6.904 -0.547 1.00 0.00 C ATOM 1640 CG LYS A 104 -19.202 6.786 -1.583 1.00 0.00 C ATOM 1641 CD LYS A 104 -19.695 5.932 -2.747 1.00 0.00 C ATOM 1642 CE LYS A 104 -18.516 5.560 -3.649 1.00 0.00 C ATOM 1643 NZ LYS A 104 -19.016 5.276 -5.024 1.00 0.00 N ATOM 0 H LYS A 104 -18.411 5.951 0.647 1.00 0.00 H new ATOM 0 HA LYS A 104 -19.419 8.592 0.502 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -20.705 5.916 -0.300 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -21.149 7.479 -0.956 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -18.911 7.775 -1.938 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -18.317 6.336 -1.134 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -20.176 5.029 -2.370 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -20.445 6.478 -3.319 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -17.792 6.374 -3.674 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -18.000 4.687 -3.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -18.374 5.703 -5.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -19.056 4.248 -5.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -19.968 5.679 -5.137 1.00 0.00 H new ATOM 1657 N ASP A 105 -21.235 6.602 2.392 1.00 0.00 N ATOM 1658 CA ASP A 105 -22.365 6.653 3.368 1.00 0.00 C ATOM 1659 C ASP A 105 -21.860 6.840 4.793 1.00 0.00 C ATOM 1660 O ASP A 105 -20.992 6.134 5.257 1.00 0.00 O ATOM 1661 CB ASP A 105 -23.162 5.356 3.298 1.00 0.00 C ATOM 1662 CG ASP A 105 -24.573 5.647 2.789 1.00 0.00 C ATOM 1663 OD1 ASP A 105 -25.081 4.849 2.016 1.00 0.00 O ATOM 1664 OD2 ASP A 105 -25.127 6.660 3.182 1.00 0.00 O ATOM 0 H ASP A 105 -20.774 5.697 2.301 1.00 0.00 H new ATOM 0 HA ASP A 105 -22.995 7.503 3.105 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.665 4.647 2.636 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.209 4.893 4.283 1.00 0.00 H new ATOM 1670 N TYR A 106 -22.429 7.776 5.499 1.00 0.00 N ATOM 1671 CA TYR A 106 -22.017 8.001 6.913 1.00 0.00 C ATOM 1672 C TYR A 106 -22.350 6.739 7.709 1.00 0.00 C ATOM 1673 O TYR A 106 -21.590 6.292 8.545 1.00 0.00 O ATOM 1674 CB TYR A 106 -22.781 9.197 7.487 1.00 0.00 C ATOM 1675 CG TYR A 106 -22.256 9.524 8.867 1.00 0.00 C ATOM 1676 CD1 TYR A 106 -21.048 10.219 9.006 1.00 0.00 C ATOM 1677 CD2 TYR A 106 -22.979 9.143 10.004 1.00 0.00 C ATOM 1678 CE1 TYR A 106 -20.563 10.532 10.282 1.00 0.00 C ATOM 1679 CE2 TYR A 106 -22.493 9.455 11.280 1.00 0.00 C ATOM 1680 CZ TYR A 106 -21.285 10.149 11.418 1.00 0.00 C ATOM 1681 OH TYR A 106 -20.807 10.458 12.675 1.00 0.00 O ATOM 0 H TYR A 106 -23.163 8.396 5.158 1.00 0.00 H new ATOM 0 HA TYR A 106 -20.949 8.211 6.970 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -22.669 10.060 6.831 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -23.846 8.970 7.537 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -20.490 10.514 8.129 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -23.911 8.609 9.897 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -19.632 11.069 10.389 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -23.050 9.160 12.157 1.00 0.00 H new ATOM 0 HH TYR A 106 -21.429 10.121 13.353 1.00 0.00 H new ATOM 1691 N ASP A 107 -23.485 6.152 7.430 1.00 0.00 N ATOM 1692 CA ASP A 107 -23.888 4.904 8.135 1.00 0.00 C ATOM 1693 C ASP A 107 -23.492 3.712 7.263 1.00 0.00 C ATOM 1694 O ASP A 107 -23.990 2.613 7.427 1.00 0.00 O ATOM 1695 CB ASP A 107 -25.403 4.901 8.353 1.00 0.00 C ATOM 1696 CG ASP A 107 -25.805 3.653 9.144 1.00 0.00 C ATOM 1697 OD1 ASP A 107 -26.996 3.405 9.254 1.00 0.00 O ATOM 1698 OD2 ASP A 107 -24.918 2.971 9.625 1.00 0.00 O ATOM 0 H ASP A 107 -24.154 6.489 6.738 1.00 0.00 H new ATOM 0 HA ASP A 107 -23.393 4.843 9.104 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -25.705 5.799 8.892 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -25.919 4.917 7.393 1.00 0.00 H new ATOM 1704 N VAL A 108 -22.601 3.930 6.333 1.00 0.00 N ATOM 1705 CA VAL A 108 -22.162 2.828 5.431 1.00 0.00 C ATOM 1706 C VAL A 108 -22.043 1.533 6.233 1.00 0.00 C ATOM 1707 O VAL A 108 -21.731 1.542 7.408 1.00 0.00 O ATOM 1708 CB VAL A 108 -20.807 3.192 4.824 1.00 0.00 C ATOM 1709 CG1 VAL A 108 -19.840 3.570 5.940 1.00 0.00 C ATOM 1710 CG2 VAL A 108 -20.242 2.003 4.048 1.00 0.00 C ATOM 0 H VAL A 108 -22.156 4.831 6.159 1.00 0.00 H new ATOM 0 HA VAL A 108 -22.891 2.686 4.633 1.00 0.00 H new ATOM 0 HB VAL A 108 -20.936 4.034 4.143 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -18.873 3.830 5.511 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -20.235 4.425 6.490 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -19.720 2.726 6.619 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -19.277 2.273 3.620 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -20.115 1.156 4.722 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -20.930 1.731 3.248 1.00 0.00 H new ATOM 1720 N GLU A 109 -22.307 0.420 5.610 1.00 0.00 N ATOM 1721 CA GLU A 109 -22.232 -0.872 6.335 1.00 0.00 C ATOM 1722 C GLU A 109 -20.798 -1.158 6.756 1.00 0.00 C ATOM 1723 O GLU A 109 -19.846 -0.819 6.080 1.00 0.00 O ATOM 1724 CB GLU A 109 -22.735 -2.005 5.441 1.00 0.00 C ATOM 1725 CG GLU A 109 -21.582 -2.954 5.102 1.00 0.00 C ATOM 1726 CD GLU A 109 -22.067 -4.022 4.121 1.00 0.00 C ATOM 1727 OE1 GLU A 109 -22.858 -4.858 4.530 1.00 0.00 O ATOM 1728 OE2 GLU A 109 -21.639 -3.989 2.979 1.00 0.00 O ATOM 0 H GLU A 109 -22.572 0.352 4.627 1.00 0.00 H new ATOM 0 HA GLU A 109 -22.860 -0.807 7.224 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -23.531 -2.552 5.946 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -23.161 -1.595 4.525 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -20.754 -2.395 4.666 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -21.206 -3.424 6.011 1.00 0.00 H new ATOM 1736 N ILE A 110 -20.654 -1.802 7.870 1.00 0.00 N ATOM 1737 CA ILE A 110 -19.301 -2.163 8.376 1.00 0.00 C ATOM 1738 C ILE A 110 -19.217 -3.681 8.561 1.00 0.00 C ATOM 1739 O ILE A 110 -19.832 -4.242 9.447 1.00 0.00 O ATOM 1740 CB ILE A 110 -19.049 -1.458 9.713 1.00 0.00 C ATOM 1741 CG1 ILE A 110 -18.941 0.054 9.487 1.00 0.00 C ATOM 1742 CG2 ILE A 110 -17.749 -1.976 10.329 1.00 0.00 C ATOM 1743 CD1 ILE A 110 -17.778 0.355 8.536 1.00 0.00 C ATOM 0 H ILE A 110 -21.426 -2.101 8.465 1.00 0.00 H new ATOM 0 HA ILE A 110 -18.544 -1.846 7.659 1.00 0.00 H new ATOM 0 HB ILE A 110 -19.878 -1.664 10.390 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -19.873 0.436 9.069 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -18.786 0.563 10.438 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -17.571 -1.473 11.280 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -17.828 -3.050 10.496 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -16.919 -1.774 9.651 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -17.706 1.431 8.379 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -16.848 -0.011 8.971 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -17.952 -0.140 7.581 1.00 0.00 H new ATOM 1755 N ARG A 111 -18.450 -4.351 7.742 1.00 0.00 N ATOM 1756 CA ARG A 111 -18.322 -5.832 7.884 1.00 0.00 C ATOM 1757 C ARG A 111 -16.961 -6.143 8.487 1.00 0.00 C ATOM 1758 O ARG A 111 -15.929 -5.855 7.914 1.00 0.00 O ATOM 1759 CB ARG A 111 -18.447 -6.498 6.513 1.00 0.00 C ATOM 1760 CG ARG A 111 -19.873 -6.308 6.003 1.00 0.00 C ATOM 1761 CD ARG A 111 -19.966 -6.722 4.533 1.00 0.00 C ATOM 1762 NE ARG A 111 -19.892 -8.204 4.424 1.00 0.00 N ATOM 1763 CZ ARG A 111 -19.622 -8.762 3.274 1.00 0.00 C ATOM 1764 NH1 ARG A 111 -19.398 -8.017 2.226 1.00 0.00 N ATOM 1765 NH2 ARG A 111 -19.581 -10.060 3.174 1.00 0.00 N ATOM 0 H ARG A 111 -17.908 -3.939 6.983 1.00 0.00 H new ATOM 0 HA ARG A 111 -19.112 -6.214 8.530 1.00 0.00 H new ATOM 0 HB2 ARG A 111 -17.735 -6.060 5.814 1.00 0.00 H new ATOM 0 HB3 ARG A 111 -18.210 -7.560 6.586 1.00 0.00 H new ATOM 0 HG2 ARG A 111 -20.563 -6.903 6.601 1.00 0.00 H new ATOM 0 HG3 ARG A 111 -20.171 -5.266 6.115 1.00 0.00 H new ATOM 0 HD2 ARG A 111 -20.900 -6.362 4.102 1.00 0.00 H new ATOM 0 HD3 ARG A 111 -19.156 -6.265 3.964 1.00 0.00 H new ATOM 0 HE ARG A 111 -20.052 -8.784 5.247 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -19.434 -7.001 2.306 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -19.187 -8.451 1.327 1.00 0.00 H new ATOM 0 HH21 ARG A 111 -19.760 -10.641 3.993 1.00 0.00 H new ATOM 0 HH22 ARG A 111 -19.370 -10.496 2.276 1.00 0.00 H new ATOM 1779 N LEU A 112 -16.954 -6.709 9.653 1.00 0.00 N ATOM 1780 CA LEU A 112 -15.664 -7.020 10.318 1.00 0.00 C ATOM 1781 C LEU A 112 -15.331 -8.506 10.162 1.00 0.00 C ATOM 1782 O LEU A 112 -16.186 -9.361 10.279 1.00 0.00 O ATOM 1783 CB LEU A 112 -15.773 -6.679 11.803 1.00 0.00 C ATOM 1784 CG LEU A 112 -16.398 -5.293 11.974 1.00 0.00 C ATOM 1785 CD1 LEU A 112 -16.255 -4.853 13.431 1.00 0.00 C ATOM 1786 CD2 LEU A 112 -15.694 -4.282 11.060 1.00 0.00 C ATOM 0 H LEU A 112 -17.788 -6.972 10.178 1.00 0.00 H new ATOM 0 HA LEU A 112 -14.872 -6.431 9.856 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -16.380 -7.427 12.313 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -14.785 -6.702 12.264 1.00 0.00 H new ATOM 0 HG LEU A 112 -17.453 -5.338 11.704 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -16.699 -3.866 13.558 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -16.765 -5.566 14.078 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -15.199 -4.813 13.697 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -16.146 -3.299 11.189 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -14.636 -4.232 11.319 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -15.799 -4.596 10.021 1.00 0.00 H new ATOM 1798 N SER A 113 -14.088 -8.818 9.917 1.00 0.00 N ATOM 1799 CA SER A 113 -13.692 -10.245 9.774 1.00 0.00 C ATOM 1800 C SER A 113 -13.343 -10.800 11.156 1.00 0.00 C ATOM 1801 O SER A 113 -13.344 -10.085 12.139 1.00 0.00 O ATOM 1802 CB SER A 113 -12.473 -10.352 8.857 1.00 0.00 C ATOM 1803 OG SER A 113 -11.327 -9.865 9.541 1.00 0.00 O ATOM 0 H SER A 113 -13.330 -8.145 9.810 1.00 0.00 H new ATOM 0 HA SER A 113 -14.514 -10.815 9.341 1.00 0.00 H new ATOM 0 HB2 SER A 113 -12.319 -11.389 8.557 1.00 0.00 H new ATOM 0 HB3 SER A 113 -12.638 -9.778 7.945 1.00 0.00 H new ATOM 0 HG SER A 113 -10.543 -9.934 8.957 1.00 0.00 H new ATOM 1809 N HIS A 114 -13.046 -12.066 11.243 1.00 0.00 N ATOM 1810 CA HIS A 114 -12.700 -12.657 12.567 1.00 0.00 C ATOM 1811 C HIS A 114 -11.620 -11.805 13.239 1.00 0.00 C ATOM 1812 O HIS A 114 -11.611 -11.627 14.440 1.00 0.00 O ATOM 1813 CB HIS A 114 -12.175 -14.080 12.367 1.00 0.00 C ATOM 1814 CG HIS A 114 -11.911 -14.713 13.707 1.00 0.00 C ATOM 1815 ND1 HIS A 114 -10.695 -14.575 14.363 1.00 0.00 N ATOM 1816 CD2 HIS A 114 -12.693 -15.495 14.522 1.00 0.00 C ATOM 1817 CE1 HIS A 114 -10.781 -15.260 15.521 1.00 0.00 C ATOM 1818 NE2 HIS A 114 -11.976 -15.837 15.662 1.00 0.00 N ATOM 0 H HIS A 114 -13.028 -12.716 10.457 1.00 0.00 H new ATOM 0 HA HIS A 114 -13.588 -12.682 13.198 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -12.902 -14.672 11.811 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -11.260 -14.061 11.776 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -13.708 -15.797 14.310 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -9.982 -15.333 16.244 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -12.296 -16.409 16.443 1.00 0.00 H new ATOM 1827 N GLU A 115 -10.704 -11.282 12.469 1.00 0.00 N ATOM 1828 CA GLU A 115 -9.617 -10.445 13.057 1.00 0.00 C ATOM 1829 C GLU A 115 -10.216 -9.238 13.793 1.00 0.00 C ATOM 1830 O GLU A 115 -9.649 -8.751 14.751 1.00 0.00 O ATOM 1831 CB GLU A 115 -8.697 -9.955 11.938 1.00 0.00 C ATOM 1832 CG GLU A 115 -7.512 -9.199 12.544 1.00 0.00 C ATOM 1833 CD GLU A 115 -6.632 -8.646 11.421 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -5.634 -8.018 11.733 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -6.970 -8.865 10.270 1.00 0.00 O ATOM 0 H GLU A 115 -10.661 -11.398 11.457 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.049 -11.045 13.768 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.340 -10.801 11.350 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -9.248 -9.304 11.259 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -7.870 -8.385 13.174 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -6.930 -9.864 13.182 1.00 0.00 H new ATOM 1843 N HIS A 116 -11.345 -8.746 13.353 1.00 0.00 N ATOM 1844 CA HIS A 116 -11.958 -7.566 14.033 1.00 0.00 C ATOM 1845 C HIS A 116 -13.348 -7.930 14.559 1.00 0.00 C ATOM 1846 O HIS A 116 -14.094 -8.649 13.922 1.00 0.00 O ATOM 1847 CB HIS A 116 -12.071 -6.409 13.037 1.00 0.00 C ATOM 1848 CG HIS A 116 -10.694 -5.965 12.622 1.00 0.00 C ATOM 1849 ND1 HIS A 116 -9.914 -5.130 13.412 1.00 0.00 N ATOM 1850 CD2 HIS A 116 -9.945 -6.231 11.502 1.00 0.00 C ATOM 1851 CE1 HIS A 116 -8.754 -4.927 12.760 1.00 0.00 C ATOM 1852 NE2 HIS A 116 -8.723 -5.576 11.595 1.00 0.00 N ATOM 0 H HIS A 116 -11.867 -9.108 12.555 1.00 0.00 H new ATOM 0 HA HIS A 116 -11.329 -7.267 14.871 1.00 0.00 H new ATOM 0 HB2 HIS A 116 -12.642 -6.722 12.163 1.00 0.00 H new ATOM 0 HB3 HIS A 116 -12.611 -5.578 13.489 1.00 0.00 H new ATOM 0 HD1 HIS A 116 -10.173 -4.742 14.319 1.00 0.00 H new ATOM 0 HD2 HIS A 116 -10.258 -6.853 10.676 1.00 0.00 H new ATOM 0 HE1 HIS A 116 -7.947 -4.314 13.134 1.00 0.00 H new ATOM 1861 N GLN A 117 -13.703 -7.445 15.722 1.00 0.00 N ATOM 1862 CA GLN A 117 -15.043 -7.768 16.292 1.00 0.00 C ATOM 1863 C GLN A 117 -15.873 -6.489 16.450 1.00 0.00 C ATOM 1864 O GLN A 117 -17.088 -6.531 16.466 1.00 0.00 O ATOM 1865 CB GLN A 117 -14.875 -8.430 17.662 1.00 0.00 C ATOM 1866 CG GLN A 117 -14.352 -7.405 18.671 1.00 0.00 C ATOM 1867 CD GLN A 117 -14.031 -8.110 19.988 1.00 0.00 C ATOM 1868 OE1 GLN A 117 -13.582 -9.239 19.995 1.00 0.00 O ATOM 1869 NE2 GLN A 117 -14.241 -7.488 21.115 1.00 0.00 N ATOM 0 H GLN A 117 -13.121 -6.839 16.301 1.00 0.00 H new ATOM 0 HA GLN A 117 -15.557 -8.449 15.614 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -15.829 -8.834 18.001 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -14.182 -9.268 17.589 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -13.460 -6.916 18.280 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -15.097 -6.626 18.834 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -14.618 -6.540 21.112 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -14.028 -7.949 21.999 1.00 0.00 H new ATOM 1878 N ALA A 118 -15.240 -5.354 16.576 1.00 0.00 N ATOM 1879 CA ALA A 118 -16.019 -4.092 16.741 1.00 0.00 C ATOM 1880 C ALA A 118 -15.280 -2.923 16.085 1.00 0.00 C ATOM 1881 O ALA A 118 -14.075 -2.940 15.931 1.00 0.00 O ATOM 1882 CB ALA A 118 -16.199 -3.799 18.231 1.00 0.00 C ATOM 0 H ALA A 118 -14.226 -5.245 16.572 1.00 0.00 H new ATOM 0 HA ALA A 118 -16.992 -4.212 16.264 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -16.768 -2.877 18.354 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -16.736 -4.623 18.702 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -15.222 -3.688 18.701 1.00 0.00 H new ATOM 1888 N TYR A 119 -16.001 -1.903 15.707 1.00 0.00 N ATOM 1889 CA TYR A 119 -15.358 -0.719 15.066 1.00 0.00 C ATOM 1890 C TYR A 119 -15.959 0.563 15.649 1.00 0.00 C ATOM 1891 O TYR A 119 -17.049 0.559 16.186 1.00 0.00 O ATOM 1892 CB TYR A 119 -15.611 -0.753 13.558 1.00 0.00 C ATOM 1893 CG TYR A 119 -17.071 -0.488 13.292 1.00 0.00 C ATOM 1894 CD1 TYR A 119 -17.977 -1.551 13.268 1.00 0.00 C ATOM 1895 CD2 TYR A 119 -17.518 0.820 13.077 1.00 0.00 C ATOM 1896 CE1 TYR A 119 -19.334 -1.312 13.027 1.00 0.00 C ATOM 1897 CE2 TYR A 119 -18.874 1.063 12.835 1.00 0.00 C ATOM 1898 CZ TYR A 119 -19.784 -0.002 12.809 1.00 0.00 C ATOM 1899 OH TYR A 119 -21.122 0.238 12.569 1.00 0.00 O ATOM 0 H TYR A 119 -17.013 -1.838 15.815 1.00 0.00 H new ATOM 0 HA TYR A 119 -14.285 -0.742 15.257 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -14.997 -0.005 13.058 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -15.326 -1.723 13.151 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -17.629 -2.560 13.436 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -16.817 1.641 13.098 1.00 0.00 H new ATOM 0 HE1 TYR A 119 -20.034 -2.135 13.009 1.00 0.00 H new ATOM 0 HE2 TYR A 119 -19.220 2.072 12.668 1.00 0.00 H new ATOM 0 HH TYR A 119 -21.264 1.199 12.440 1.00 0.00 H new ATOM 1909 N ARG A 120 -15.261 1.661 15.547 1.00 0.00 N ATOM 1910 CA ARG A 120 -15.801 2.937 16.096 1.00 0.00 C ATOM 1911 C ARG A 120 -15.434 4.106 15.181 1.00 0.00 C ATOM 1912 O ARG A 120 -14.387 4.126 14.563 1.00 0.00 O ATOM 1913 CB ARG A 120 -15.200 3.196 17.480 1.00 0.00 C ATOM 1914 CG ARG A 120 -15.643 2.107 18.458 1.00 0.00 C ATOM 1915 CD ARG A 120 -15.136 2.453 19.861 1.00 0.00 C ATOM 1916 NE ARG A 120 -15.390 1.313 20.784 1.00 0.00 N ATOM 1917 CZ ARG A 120 -15.001 1.387 22.029 1.00 0.00 C ATOM 1918 NH1 ARG A 120 -14.393 2.459 22.457 1.00 0.00 N ATOM 1919 NH2 ARG A 120 -15.220 0.389 22.843 1.00 0.00 N ATOM 0 H ARG A 120 -14.343 1.730 15.108 1.00 0.00 H new ATOM 0 HA ARG A 120 -16.886 2.853 16.164 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -14.112 3.216 17.415 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -15.516 4.173 17.845 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -16.730 2.025 18.461 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -15.251 1.139 18.145 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -14.069 2.675 19.828 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -15.637 3.349 20.228 1.00 0.00 H new ATOM 0 HE ARG A 120 -15.866 0.477 20.446 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -14.222 3.237 21.820 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -14.088 2.519 23.429 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -15.695 -0.449 22.507 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -14.916 0.447 23.815 1.00 0.00 H new ATOM 1933 N TRP A 121 -16.275 5.100 15.126 1.00 0.00 N ATOM 1934 CA TRP A 121 -15.972 6.298 14.295 1.00 0.00 C ATOM 1935 C TRP A 121 -15.632 7.445 15.245 1.00 0.00 C ATOM 1936 O TRP A 121 -16.490 7.964 15.930 1.00 0.00 O ATOM 1937 CB TRP A 121 -17.197 6.672 13.455 1.00 0.00 C ATOM 1938 CG TRP A 121 -17.314 5.743 12.288 1.00 0.00 C ATOM 1939 CD1 TRP A 121 -18.044 4.605 12.268 1.00 0.00 C ATOM 1940 CD2 TRP A 121 -16.700 5.860 10.973 1.00 0.00 C ATOM 1941 NE1 TRP A 121 -17.915 4.013 11.023 1.00 0.00 N ATOM 1942 CE2 TRP A 121 -17.097 4.751 10.189 1.00 0.00 C ATOM 1943 CE3 TRP A 121 -15.845 6.813 10.389 1.00 0.00 C ATOM 1944 CZ2 TRP A 121 -16.660 4.594 8.873 1.00 0.00 C ATOM 1945 CZ3 TRP A 121 -15.403 6.657 9.067 1.00 0.00 C ATOM 1946 CH2 TRP A 121 -15.811 5.551 8.309 1.00 0.00 C ATOM 0 H TRP A 121 -17.165 5.134 15.624 1.00 0.00 H new ATOM 0 HA TRP A 121 -15.139 6.095 13.622 1.00 0.00 H new ATOM 0 HB2 TRP A 121 -18.098 6.619 14.066 1.00 0.00 H new ATOM 0 HB3 TRP A 121 -17.109 7.701 13.105 1.00 0.00 H new ATOM 0 HD1 TRP A 121 -18.631 4.221 13.089 1.00 0.00 H new ATOM 0 HE1 TRP A 121 -18.368 3.139 10.754 1.00 0.00 H new ATOM 0 HE3 TRP A 121 -15.527 7.671 10.963 1.00 0.00 H new ATOM 0 HZ2 TRP A 121 -16.976 3.739 8.294 1.00 0.00 H new ATOM 0 HZ3 TRP A 121 -14.744 7.393 8.631 1.00 0.00 H new ATOM 0 HH2 TRP A 121 -15.470 5.438 7.290 1.00 0.00 H new ATOM 1957 N LEU A 122 -14.385 7.824 15.321 1.00 0.00 N ATOM 1958 CA LEU A 122 -14.000 8.911 16.265 1.00 0.00 C ATOM 1959 C LEU A 122 -13.188 9.982 15.536 1.00 0.00 C ATOM 1960 O LEU A 122 -12.840 9.840 14.380 1.00 0.00 O ATOM 1961 CB LEU A 122 -13.154 8.331 17.403 1.00 0.00 C ATOM 1962 CG LEU A 122 -13.496 6.848 17.617 1.00 0.00 C ATOM 1963 CD1 LEU A 122 -12.365 5.985 17.061 1.00 0.00 C ATOM 1964 CD2 LEU A 122 -13.670 6.564 19.113 1.00 0.00 C ATOM 0 H LEU A 122 -13.620 7.430 14.773 1.00 0.00 H new ATOM 0 HA LEU A 122 -14.908 9.359 16.669 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.095 8.437 17.169 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.335 8.890 18.321 1.00 0.00 H new ATOM 0 HG LEU A 122 -14.426 6.613 17.099 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -12.603 4.932 17.211 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -12.247 6.182 15.996 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.436 6.224 17.579 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -13.912 5.511 19.258 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.744 6.799 19.638 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -14.478 7.180 19.509 1.00 0.00 H new ATOM 1976 N GLY A 123 -12.884 11.054 16.216 1.00 0.00 N ATOM 1977 CA GLY A 123 -12.094 12.144 15.585 1.00 0.00 C ATOM 1978 C GLY A 123 -10.607 11.788 15.624 1.00 0.00 C ATOM 1979 O GLY A 123 -10.224 10.717 16.053 1.00 0.00 O ATOM 0 H GLY A 123 -13.151 11.220 17.186 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -12.416 12.291 14.554 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -12.267 13.083 16.110 1.00 0.00 H new ATOM 1983 N LEU A 124 -9.770 12.679 15.173 1.00 0.00 N ATOM 1984 CA LEU A 124 -8.305 12.403 15.170 1.00 0.00 C ATOM 1985 C LEU A 124 -7.801 12.160 16.596 1.00 0.00 C ATOM 1986 O LEU A 124 -6.974 11.302 16.829 1.00 0.00 O ATOM 1987 CB LEU A 124 -7.580 13.608 14.568 1.00 0.00 C ATOM 1988 CG LEU A 124 -6.067 13.398 14.645 1.00 0.00 C ATOM 1989 CD1 LEU A 124 -5.702 12.047 14.033 1.00 0.00 C ATOM 1990 CD2 LEU A 124 -5.366 14.508 13.864 1.00 0.00 C ATOM 0 H LEU A 124 -10.038 13.591 14.804 1.00 0.00 H new ATOM 0 HA LEU A 124 -8.108 11.509 14.578 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -7.884 13.745 13.530 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -7.858 14.515 15.104 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.751 13.420 15.688 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.623 11.901 14.090 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -6.205 11.251 14.582 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -6.017 12.023 12.990 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.287 14.363 13.915 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -5.687 14.479 12.823 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -5.623 15.475 14.296 1.00 0.00 H new ATOM 2002 N GLU A 125 -8.278 12.914 17.547 1.00 0.00 N ATOM 2003 CA GLU A 125 -7.809 12.728 18.954 1.00 0.00 C ATOM 2004 C GLU A 125 -8.117 11.309 19.433 1.00 0.00 C ATOM 2005 O GLU A 125 -7.242 10.592 19.878 1.00 0.00 O ATOM 2006 CB GLU A 125 -8.515 13.737 19.865 1.00 0.00 C ATOM 2007 CG GLU A 125 -10.012 13.409 19.949 1.00 0.00 C ATOM 2008 CD GLU A 125 -10.738 14.524 20.704 1.00 0.00 C ATOM 2009 OE1 GLU A 125 -10.060 15.353 21.290 1.00 0.00 O ATOM 2010 OE2 GLU A 125 -11.958 14.529 20.683 1.00 0.00 O ATOM 0 H GLU A 125 -8.971 13.650 17.414 1.00 0.00 H new ATOM 0 HA GLU A 125 -6.731 12.888 18.991 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -8.072 13.713 20.861 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -8.376 14.747 19.479 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -10.428 13.303 18.947 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -10.158 12.456 20.458 1.00 0.00 H new ATOM 2018 N GLU A 126 -9.349 10.896 19.350 1.00 0.00 N ATOM 2019 CA GLU A 126 -9.701 9.523 19.802 1.00 0.00 C ATOM 2020 C GLU A 126 -9.107 8.513 18.830 1.00 0.00 C ATOM 2021 O GLU A 126 -8.547 7.513 19.224 1.00 0.00 O ATOM 2022 CB GLU A 126 -11.216 9.371 19.817 1.00 0.00 C ATOM 2023 CG GLU A 126 -11.740 9.443 21.252 1.00 0.00 C ATOM 2024 CD GLU A 126 -11.044 10.571 22.017 1.00 0.00 C ATOM 2025 OE1 GLU A 126 -10.048 10.295 22.667 1.00 0.00 O ATOM 2026 OE2 GLU A 126 -11.527 11.688 21.952 1.00 0.00 O ATOM 0 H GLU A 126 -10.127 11.449 18.989 1.00 0.00 H new ATOM 0 HA GLU A 126 -9.306 9.352 20.803 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -11.674 10.156 19.215 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -11.498 8.419 19.367 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -12.817 9.610 21.245 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -11.568 8.492 21.757 1.00 0.00 H new ATOM 2034 N ALA A 127 -9.203 8.770 17.560 1.00 0.00 N ATOM 2035 CA ALA A 127 -8.617 7.818 16.591 1.00 0.00 C ATOM 2036 C ALA A 127 -7.143 7.669 16.944 1.00 0.00 C ATOM 2037 O ALA A 127 -6.551 6.621 16.787 1.00 0.00 O ATOM 2038 CB ALA A 127 -8.770 8.366 15.176 1.00 0.00 C ATOM 0 H ALA A 127 -9.657 9.589 17.156 1.00 0.00 H new ATOM 0 HA ALA A 127 -9.120 6.852 16.635 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -8.337 7.663 14.465 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.828 8.504 14.952 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -8.254 9.323 15.099 1.00 0.00 H new ATOM 2044 N CYS A 128 -6.560 8.719 17.452 1.00 0.00 N ATOM 2045 CA CYS A 128 -5.134 8.664 17.859 1.00 0.00 C ATOM 2046 C CYS A 128 -5.037 7.998 19.236 1.00 0.00 C ATOM 2047 O CYS A 128 -4.152 7.209 19.492 1.00 0.00 O ATOM 2048 CB CYS A 128 -4.576 10.084 17.934 1.00 0.00 C ATOM 2049 SG CYS A 128 -3.972 10.583 16.304 1.00 0.00 S ATOM 0 H CYS A 128 -7.017 9.619 17.603 1.00 0.00 H new ATOM 0 HA CYS A 128 -4.559 8.090 17.132 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.350 10.773 18.273 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.767 10.130 18.663 1.00 0.00 H new ATOM 0 HG CYS A 128 -3.499 11.792 16.368 1.00 0.00 H new ATOM 2055 N GLN A 129 -5.944 8.314 20.127 1.00 0.00 N ATOM 2056 CA GLN A 129 -5.899 7.697 21.484 1.00 0.00 C ATOM 2057 C GLN A 129 -6.071 6.182 21.356 1.00 0.00 C ATOM 2058 O GLN A 129 -5.320 5.413 21.919 1.00 0.00 O ATOM 2059 CB GLN A 129 -7.002 8.306 22.364 1.00 0.00 C ATOM 2060 CG GLN A 129 -8.284 7.470 22.319 1.00 0.00 C ATOM 2061 CD GLN A 129 -8.124 6.226 23.197 1.00 0.00 C ATOM 2062 OE1 GLN A 129 -7.042 5.932 23.664 1.00 0.00 O ATOM 2063 NE2 GLN A 129 -9.168 5.485 23.453 1.00 0.00 N ATOM 0 H GLN A 129 -6.710 8.970 19.972 1.00 0.00 H new ATOM 0 HA GLN A 129 -4.937 7.898 21.955 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.649 8.378 23.393 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.217 9.321 22.029 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.129 8.065 22.666 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.501 7.176 21.292 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.077 5.732 23.061 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.075 4.660 24.045 1.00 0.00 H new ATOM 2072 N LEU A 130 -7.035 5.749 20.598 1.00 0.00 N ATOM 2073 CA LEU A 130 -7.231 4.284 20.411 1.00 0.00 C ATOM 2074 C LEU A 130 -6.045 3.741 19.614 1.00 0.00 C ATOM 2075 O LEU A 130 -5.506 2.695 19.910 1.00 0.00 O ATOM 2076 CB LEU A 130 -8.521 4.035 19.634 1.00 0.00 C ATOM 2077 CG LEU A 130 -9.720 4.489 20.464 1.00 0.00 C ATOM 2078 CD1 LEU A 130 -10.778 5.080 19.540 1.00 0.00 C ATOM 2079 CD2 LEU A 130 -10.319 3.289 21.197 1.00 0.00 C ATOM 0 H LEU A 130 -7.697 6.344 20.099 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.298 3.787 21.379 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -8.497 4.575 18.688 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -8.613 2.976 19.394 1.00 0.00 H new ATOM 0 HG LEU A 130 -9.395 5.238 21.187 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -11.635 5.405 20.129 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -10.360 5.934 19.007 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -11.097 4.325 18.822 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -11.175 3.614 21.789 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -10.643 2.543 20.471 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -9.568 2.852 21.855 1.00 0.00 H new ATOM 2091 N ALA A 131 -5.625 4.469 18.612 1.00 0.00 N ATOM 2092 CA ALA A 131 -4.460 4.026 17.798 1.00 0.00 C ATOM 2093 C ALA A 131 -3.186 4.385 18.554 1.00 0.00 C ATOM 2094 O ALA A 131 -2.254 4.937 18.002 1.00 0.00 O ATOM 2095 CB ALA A 131 -4.476 4.736 16.446 1.00 0.00 C ATOM 0 H ALA A 131 -6.042 5.354 18.323 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.506 2.950 17.628 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -3.622 4.409 15.853 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -5.398 4.493 15.918 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.419 5.814 16.600 1.00 0.00 H new ATOM 2101 N GLN A 132 -3.155 4.087 19.822 1.00 0.00 N ATOM 2102 CA GLN A 132 -1.960 4.417 20.650 1.00 0.00 C ATOM 2103 C GLN A 132 -0.695 4.214 19.826 1.00 0.00 C ATOM 2104 O GLN A 132 0.323 4.826 20.078 1.00 0.00 O ATOM 2105 CB GLN A 132 -1.900 3.507 21.883 1.00 0.00 C ATOM 2106 CG GLN A 132 -2.751 2.254 21.662 1.00 0.00 C ATOM 2107 CD GLN A 132 -2.938 1.529 22.995 1.00 0.00 C ATOM 2108 OE1 GLN A 132 -2.367 2.008 24.067 1.00 0.00 O flip ATOM 2109 NE2 GLN A 132 -3.610 0.521 23.063 1.00 0.00 N flip ATOM 0 H GLN A 132 -3.912 3.625 20.325 1.00 0.00 H new ATOM 0 HA GLN A 132 -2.035 5.456 20.970 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -0.867 3.222 22.083 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.257 4.047 22.760 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -3.720 2.527 21.245 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.268 1.595 20.941 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -4.056 0.148 22.225 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -3.729 0.047 23.958 1.00 0.00 H new ATOM 2118 N PHE A 133 -0.745 3.366 18.844 1.00 0.00 N ATOM 2119 CA PHE A 133 0.465 3.140 18.016 1.00 0.00 C ATOM 2120 C PHE A 133 0.927 4.486 17.451 1.00 0.00 C ATOM 2121 O PHE A 133 0.213 5.149 16.727 1.00 0.00 O ATOM 2122 CB PHE A 133 0.140 2.166 16.883 1.00 0.00 C ATOM 2123 CG PHE A 133 0.171 0.752 17.421 1.00 0.00 C ATOM 2124 CD1 PHE A 133 -0.458 0.453 18.635 1.00 0.00 C ATOM 2125 CD2 PHE A 133 0.836 -0.255 16.711 1.00 0.00 C ATOM 2126 CE1 PHE A 133 -0.427 -0.850 19.139 1.00 0.00 C ATOM 2127 CE2 PHE A 133 0.869 -1.562 17.218 1.00 0.00 C ATOM 2128 CZ PHE A 133 0.238 -1.859 18.432 1.00 0.00 C ATOM 0 H PHE A 133 -1.566 2.822 18.579 1.00 0.00 H new ATOM 0 HA PHE A 133 1.262 2.707 18.621 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -0.842 2.388 16.466 1.00 0.00 H new ATOM 0 HB3 PHE A 133 0.862 2.276 16.074 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -0.968 1.231 19.183 1.00 0.00 H new ATOM 0 HD2 PHE A 133 1.323 -0.026 15.775 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -0.916 -1.079 20.074 1.00 0.00 H new ATOM 0 HE2 PHE A 133 1.381 -2.340 16.672 1.00 0.00 H new ATOM 0 HZ PHE A 133 0.264 -2.866 18.823 1.00 0.00 H new ATOM 2138 N LYS A 134 2.117 4.894 17.797 1.00 0.00 N ATOM 2139 CA LYS A 134 2.637 6.204 17.313 1.00 0.00 C ATOM 2140 C LYS A 134 2.569 6.281 15.787 1.00 0.00 C ATOM 2141 O LYS A 134 2.256 7.312 15.226 1.00 0.00 O ATOM 2142 CB LYS A 134 4.096 6.345 17.753 1.00 0.00 C ATOM 2143 CG LYS A 134 4.647 7.707 17.318 1.00 0.00 C ATOM 2144 CD LYS A 134 6.127 7.565 16.958 1.00 0.00 C ATOM 2145 CE LYS A 134 6.940 7.257 18.218 1.00 0.00 C ATOM 2146 NZ LYS A 134 8.078 6.361 17.869 1.00 0.00 N ATOM 0 H LYS A 134 2.755 4.373 18.398 1.00 0.00 H new ATOM 0 HA LYS A 134 2.028 7.005 17.732 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.169 6.243 18.836 1.00 0.00 H new ATOM 0 HB3 LYS A 134 4.695 5.545 17.317 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.087 8.081 16.461 1.00 0.00 H new ATOM 0 HG3 LYS A 134 4.525 8.434 18.121 1.00 0.00 H new ATOM 0 HD2 LYS A 134 6.258 6.768 16.226 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.488 8.484 16.497 1.00 0.00 H new ATOM 0 HE2 LYS A 134 7.313 8.182 18.658 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.305 6.782 18.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 8.630 6.152 18.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 7.711 5.474 17.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 8.688 6.831 17.170 1.00 0.00 H new ATOM 2160 N GLU A 135 2.876 5.214 15.111 1.00 0.00 N ATOM 2161 CA GLU A 135 2.846 5.256 13.623 1.00 0.00 C ATOM 2162 C GLU A 135 1.448 5.644 13.147 1.00 0.00 C ATOM 2163 O GLU A 135 1.288 6.409 12.218 1.00 0.00 O ATOM 2164 CB GLU A 135 3.191 3.877 13.070 1.00 0.00 C ATOM 2165 CG GLU A 135 4.278 3.244 13.941 1.00 0.00 C ATOM 2166 CD GLU A 135 3.636 2.318 14.979 1.00 0.00 C ATOM 2167 OE1 GLU A 135 2.580 1.778 14.693 1.00 0.00 O ATOM 2168 OE2 GLU A 135 4.210 2.169 16.045 1.00 0.00 O ATOM 0 H GLU A 135 3.145 4.319 15.519 1.00 0.00 H new ATOM 0 HA GLU A 135 3.571 5.990 13.271 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.304 3.244 13.058 1.00 0.00 H new ATOM 0 HB3 GLU A 135 3.537 3.961 12.040 1.00 0.00 H new ATOM 0 HG2 GLU A 135 4.974 2.681 13.319 1.00 0.00 H new ATOM 0 HG3 GLU A 135 4.855 4.022 14.441 1.00 0.00 H new ATOM 2176 N MET A 136 0.434 5.115 13.768 1.00 0.00 N ATOM 2177 CA MET A 136 -0.947 5.446 13.337 1.00 0.00 C ATOM 2178 C MET A 136 -1.306 6.857 13.791 1.00 0.00 C ATOM 2179 O MET A 136 -1.953 7.597 13.076 1.00 0.00 O ATOM 2180 CB MET A 136 -1.909 4.431 13.940 1.00 0.00 C ATOM 2181 CG MET A 136 -1.443 3.018 13.574 1.00 0.00 C ATOM 2182 SD MET A 136 -1.029 2.943 11.812 1.00 0.00 S ATOM 2183 CE MET A 136 -2.629 3.484 11.166 1.00 0.00 C ATOM 0 H MET A 136 0.503 4.469 14.554 1.00 0.00 H new ATOM 0 HA MET A 136 -1.017 5.407 12.250 1.00 0.00 H new ATOM 0 HB2 MET A 136 -1.946 4.546 15.023 1.00 0.00 H new ATOM 0 HB3 MET A 136 -2.919 4.602 13.567 1.00 0.00 H new ATOM 0 HG2 MET A 136 -0.574 2.746 14.173 1.00 0.00 H new ATOM 0 HG3 MET A 136 -2.227 2.296 13.803 1.00 0.00 H new ATOM 0 HE1 MET A 136 -2.783 3.060 10.174 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.423 3.147 11.832 1.00 0.00 H new ATOM 0 HE3 MET A 136 -2.647 4.572 11.102 1.00 0.00 H new ATOM 2193 N LYS A 137 -0.885 7.256 14.959 1.00 0.00 N ATOM 2194 CA LYS A 137 -1.211 8.636 15.400 1.00 0.00 C ATOM 2195 C LYS A 137 -0.680 9.597 14.346 1.00 0.00 C ATOM 2196 O LYS A 137 -1.313 10.577 14.015 1.00 0.00 O ATOM 2197 CB LYS A 137 -0.551 8.941 16.753 1.00 0.00 C ATOM 2198 CG LYS A 137 -1.524 8.621 17.898 1.00 0.00 C ATOM 2199 CD LYS A 137 -1.032 7.410 18.695 1.00 0.00 C ATOM 2200 CE LYS A 137 -0.215 7.882 19.897 1.00 0.00 C ATOM 2201 NZ LYS A 137 0.550 9.107 19.529 1.00 0.00 N ATOM 0 H LYS A 137 -0.340 6.697 15.615 1.00 0.00 H new ATOM 0 HA LYS A 137 -2.289 8.743 15.517 1.00 0.00 H new ATOM 0 HB2 LYS A 137 0.359 8.352 16.863 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -0.259 9.990 16.796 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -1.617 9.484 18.557 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -2.516 8.420 17.495 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -1.881 6.815 19.031 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -0.423 6.767 18.059 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -0.875 8.092 20.739 1.00 0.00 H new ATOM 0 HE3 LYS A 137 0.469 7.096 20.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 1.299 9.273 20.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 0.979 8.980 18.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -0.093 9.924 19.508 1.00 0.00 H new ATOM 2215 N ALA A 138 0.471 9.308 13.799 1.00 0.00 N ATOM 2216 CA ALA A 138 1.038 10.189 12.746 1.00 0.00 C ATOM 2217 C ALA A 138 0.270 9.969 11.442 1.00 0.00 C ATOM 2218 O ALA A 138 -0.100 10.905 10.760 1.00 0.00 O ATOM 2219 CB ALA A 138 2.506 9.852 12.524 1.00 0.00 C ATOM 0 H ALA A 138 1.041 8.497 14.039 1.00 0.00 H new ATOM 0 HA ALA A 138 0.951 11.229 13.060 1.00 0.00 H new ATOM 0 HB1 ALA A 138 2.916 10.502 11.751 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.058 10.000 13.452 1.00 0.00 H new ATOM 0 HB3 ALA A 138 2.597 8.812 12.210 1.00 0.00 H new ATOM 2225 N ALA A 139 0.021 8.734 11.093 1.00 0.00 N ATOM 2226 CA ALA A 139 -0.729 8.456 9.837 1.00 0.00 C ATOM 2227 C ALA A 139 -2.085 9.148 9.921 1.00 0.00 C ATOM 2228 O ALA A 139 -2.485 9.873 9.032 1.00 0.00 O ATOM 2229 CB ALA A 139 -0.936 6.948 9.689 1.00 0.00 C ATOM 0 H ALA A 139 0.304 7.910 11.623 1.00 0.00 H new ATOM 0 HA ALA A 139 -0.170 8.826 8.977 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -1.485 6.745 8.770 1.00 0.00 H new ATOM 0 HB2 ALA A 139 0.033 6.450 9.651 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -1.503 6.573 10.541 1.00 0.00 H new ATOM 2235 N LEU A 140 -2.781 8.949 11.001 1.00 0.00 N ATOM 2236 CA LEU A 140 -4.096 9.615 11.169 1.00 0.00 C ATOM 2237 C LEU A 140 -3.849 11.121 11.240 1.00 0.00 C ATOM 2238 O LEU A 140 -4.665 11.924 10.833 1.00 0.00 O ATOM 2239 CB LEU A 140 -4.740 9.133 12.475 1.00 0.00 C ATOM 2240 CG LEU A 140 -4.850 7.604 12.461 1.00 0.00 C ATOM 2241 CD1 LEU A 140 -4.829 7.076 13.897 1.00 0.00 C ATOM 2242 CD2 LEU A 140 -6.163 7.188 11.796 1.00 0.00 C ATOM 0 H LEU A 140 -2.494 8.352 11.777 1.00 0.00 H new ATOM 0 HA LEU A 140 -4.761 9.379 10.338 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -4.143 9.457 13.328 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.728 9.578 12.591 1.00 0.00 H new ATOM 0 HG LEU A 140 -4.010 7.191 11.903 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -4.907 5.989 13.886 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -3.896 7.368 14.378 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -5.669 7.495 14.451 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -6.238 6.101 11.788 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -7.001 7.605 12.354 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -6.186 7.561 10.772 1.00 0.00 H new ATOM 2254 N GLN A 141 -2.716 11.500 11.769 1.00 0.00 N ATOM 2255 CA GLN A 141 -2.376 12.945 11.897 1.00 0.00 C ATOM 2256 C GLN A 141 -2.054 13.546 10.529 1.00 0.00 C ATOM 2257 O GLN A 141 -2.602 14.560 10.144 1.00 0.00 O ATOM 2258 CB GLN A 141 -1.144 13.073 12.790 1.00 0.00 C ATOM 2259 CG GLN A 141 -1.569 13.490 14.198 1.00 0.00 C ATOM 2260 CD GLN A 141 -1.849 14.994 14.220 1.00 0.00 C ATOM 2261 OE1 GLN A 141 -1.801 15.671 13.105 1.00 0.00 O flip ATOM 2262 NE2 GLN A 141 -2.113 15.560 15.263 1.00 0.00 N flip ATOM 0 H GLN A 141 -2.004 10.861 12.122 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.227 13.476 12.324 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.610 12.124 12.827 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.456 13.810 12.374 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -2.460 12.939 14.499 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.785 13.244 14.914 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -2.151 15.032 16.135 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -2.297 16.563 15.266 1.00 0.00 H new ATOM 2271 N GLU A 142 -1.161 12.942 9.797 1.00 0.00 N ATOM 2272 CA GLU A 142 -0.804 13.503 8.466 1.00 0.00 C ATOM 2273 C GLU A 142 -2.008 13.400 7.532 1.00 0.00 C ATOM 2274 O GLU A 142 -2.259 14.279 6.736 1.00 0.00 O ATOM 2275 CB GLU A 142 0.379 12.728 7.880 1.00 0.00 C ATOM 2276 CG GLU A 142 1.594 12.871 8.799 1.00 0.00 C ATOM 2277 CD GLU A 142 2.806 12.198 8.152 1.00 0.00 C ATOM 2278 OE1 GLU A 142 3.900 12.378 8.662 1.00 0.00 O ATOM 2279 OE2 GLU A 142 2.619 11.516 7.159 1.00 0.00 O ATOM 0 H GLU A 142 -0.666 12.090 10.061 1.00 0.00 H new ATOM 0 HA GLU A 142 -0.523 14.550 8.576 1.00 0.00 H new ATOM 0 HB2 GLU A 142 0.117 11.676 7.768 1.00 0.00 H new ATOM 0 HB3 GLU A 142 0.617 13.105 6.885 1.00 0.00 H new ATOM 0 HG2 GLU A 142 1.804 13.925 8.980 1.00 0.00 H new ATOM 0 HG3 GLU A 142 1.386 12.416 9.768 1.00 0.00 H new ATOM 2287 N GLY A 143 -2.767 12.341 7.631 1.00 0.00 N ATOM 2288 CA GLY A 143 -3.958 12.211 6.748 1.00 0.00 C ATOM 2289 C GLY A 143 -4.857 13.425 6.973 1.00 0.00 C ATOM 2290 O GLY A 143 -5.327 14.047 6.042 1.00 0.00 O ATOM 0 H GLY A 143 -2.615 11.568 8.279 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.652 12.154 5.703 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.499 11.291 6.973 1.00 0.00 H new ATOM 2294 N HIS A 144 -5.082 13.775 8.209 1.00 0.00 N ATOM 2295 CA HIS A 144 -5.928 14.961 8.510 1.00 0.00 C ATOM 2296 C HIS A 144 -5.225 16.216 7.996 1.00 0.00 C ATOM 2297 O HIS A 144 -5.832 17.092 7.414 1.00 0.00 O ATOM 2298 CB HIS A 144 -6.119 15.074 10.024 1.00 0.00 C ATOM 2299 CG HIS A 144 -6.931 16.298 10.339 1.00 0.00 C ATOM 2300 ND1 HIS A 144 -8.287 16.516 10.369 1.00 0.00 N flip ATOM 2301 CD2 HIS A 144 -6.345 17.508 10.679 1.00 0.00 C flip ATOM 2302 CE1 HIS A 144 -8.536 17.836 10.724 1.00 0.00 C flip ATOM 2303 NE2 HIS A 144 -7.337 18.392 10.900 1.00 0.00 N flip ATOM 0 H HIS A 144 -4.714 13.288 9.026 1.00 0.00 H new ATOM 0 HA HIS A 144 -6.899 14.856 8.026 1.00 0.00 H new ATOM 0 HB2 HIS A 144 -6.621 14.184 10.405 1.00 0.00 H new ATOM 0 HB3 HIS A 144 -5.150 15.130 10.520 1.00 0.00 H new ATOM 0 HD2 HIS A 144 -5.286 17.706 10.753 1.00 0.00 H new ATOM 0 HE1 HIS A 144 -9.499 18.312 10.834 1.00 0.00 H new ATOM 0 HE2 HIS A 144 -7.189 19.365 11.168 1.00 0.00 H new ATOM 2312 N GLN A 145 -3.943 16.305 8.220 1.00 0.00 N ATOM 2313 CA GLN A 145 -3.177 17.498 7.766 1.00 0.00 C ATOM 2314 C GLN A 145 -3.240 17.623 6.242 1.00 0.00 C ATOM 2315 O GLN A 145 -3.388 18.702 5.703 1.00 0.00 O ATOM 2316 CB GLN A 145 -1.715 17.337 8.191 1.00 0.00 C ATOM 2317 CG GLN A 145 -0.955 18.634 7.910 1.00 0.00 C ATOM 2318 CD GLN A 145 -1.379 19.707 8.915 1.00 0.00 C ATOM 2319 OE1 GLN A 145 -1.274 19.511 10.109 1.00 0.00 O ATOM 2320 NE2 GLN A 145 -1.856 20.839 8.480 1.00 0.00 N ATOM 0 H GLN A 145 -3.390 15.596 8.702 1.00 0.00 H new ATOM 0 HA GLN A 145 -3.610 18.392 8.214 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -1.659 17.093 9.252 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -1.257 16.510 7.649 1.00 0.00 H new ATOM 0 HG2 GLN A 145 0.119 18.460 7.980 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -1.158 18.973 6.894 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -1.944 21.004 7.477 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -2.141 21.560 9.142 1.00 0.00 H new ATOM 2329 N PHE A 146 -3.108 16.534 5.537 1.00 0.00 N ATOM 2330 CA PHE A 146 -3.137 16.605 4.048 1.00 0.00 C ATOM 2331 C PHE A 146 -4.551 16.922 3.549 1.00 0.00 C ATOM 2332 O PHE A 146 -4.758 17.860 2.803 1.00 0.00 O ATOM 2333 CB PHE A 146 -2.689 15.266 3.465 1.00 0.00 C ATOM 2334 CG PHE A 146 -2.605 15.384 1.963 1.00 0.00 C ATOM 2335 CD1 PHE A 146 -3.776 15.376 1.198 1.00 0.00 C ATOM 2336 CD2 PHE A 146 -1.361 15.509 1.335 1.00 0.00 C ATOM 2337 CE1 PHE A 146 -3.706 15.491 -0.193 1.00 0.00 C ATOM 2338 CE2 PHE A 146 -1.289 15.624 -0.059 1.00 0.00 C ATOM 2339 CZ PHE A 146 -2.463 15.616 -0.823 1.00 0.00 C ATOM 0 H PHE A 146 -2.982 15.600 5.926 1.00 0.00 H new ATOM 0 HA PHE A 146 -2.463 17.398 3.726 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -1.719 14.983 3.875 1.00 0.00 H new ATOM 0 HB3 PHE A 146 -3.393 14.481 3.742 1.00 0.00 H new ATOM 0 HD1 PHE A 146 -4.736 15.281 1.683 1.00 0.00 H new ATOM 0 HD2 PHE A 146 -0.456 15.517 1.925 1.00 0.00 H new ATOM 0 HE1 PHE A 146 -4.611 15.483 -0.782 1.00 0.00 H new ATOM 0 HE2 PHE A 146 -0.329 15.719 -0.545 1.00 0.00 H new ATOM 0 HZ PHE A 146 -2.409 15.706 -1.898 1.00 0.00 H new ATOM 2349 N LEU A 147 -5.522 16.140 3.931 1.00 0.00 N ATOM 2350 CA LEU A 147 -6.914 16.391 3.452 1.00 0.00 C ATOM 2351 C LEU A 147 -7.333 17.817 3.799 1.00 0.00 C ATOM 2352 O LEU A 147 -7.991 18.484 3.025 1.00 0.00 O ATOM 2353 CB LEU A 147 -7.872 15.397 4.110 1.00 0.00 C ATOM 2354 CG LEU A 147 -7.465 13.975 3.721 1.00 0.00 C ATOM 2355 CD1 LEU A 147 -8.427 12.972 4.354 1.00 0.00 C ATOM 2356 CD2 LEU A 147 -7.521 13.823 2.202 1.00 0.00 C ATOM 0 H LEU A 147 -5.414 15.339 4.553 1.00 0.00 H new ATOM 0 HA LEU A 147 -6.948 16.262 2.370 1.00 0.00 H new ATOM 0 HB2 LEU A 147 -7.847 15.512 5.194 1.00 0.00 H new ATOM 0 HB3 LEU A 147 -8.896 15.595 3.792 1.00 0.00 H new ATOM 0 HG LEU A 147 -6.451 13.786 4.075 1.00 0.00 H new ATOM 0 HD11 LEU A 147 -8.134 11.960 4.074 1.00 0.00 H new ATOM 0 HD12 LEU A 147 -8.395 13.072 5.439 1.00 0.00 H new ATOM 0 HD13 LEU A 147 -9.440 13.167 4.001 1.00 0.00 H new ATOM 0 HD21 LEU A 147 -7.231 12.809 1.927 1.00 0.00 H new ATOM 0 HD22 LEU A 147 -8.536 14.017 1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 147 -6.837 14.534 1.740 1.00 0.00 H new ATOM 2368 N CYS A 148 -6.952 18.298 4.947 1.00 0.00 N ATOM 2369 CA CYS A 148 -7.326 19.688 5.326 1.00 0.00 C ATOM 2370 C CYS A 148 -6.582 20.663 4.410 1.00 0.00 C ATOM 2371 O CYS A 148 -6.881 21.840 4.361 1.00 0.00 O ATOM 2372 CB CYS A 148 -6.932 19.947 6.781 1.00 0.00 C ATOM 2373 SG CYS A 148 -7.968 18.947 7.877 1.00 0.00 S ATOM 0 H CYS A 148 -6.399 17.791 5.638 1.00 0.00 H new ATOM 0 HA CYS A 148 -8.402 19.826 5.220 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -5.881 19.701 6.933 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -7.050 21.005 7.018 1.00 0.00 H new ATOM 0 HG CYS A 148 -7.483 18.981 9.083 1.00 0.00 H new ATOM 2379 N SER A 149 -5.606 20.177 3.695 1.00 0.00 N ATOM 2380 CA SER A 149 -4.822 21.059 2.783 1.00 0.00 C ATOM 2381 C SER A 149 -5.484 21.125 1.405 1.00 0.00 C ATOM 2382 O SER A 149 -5.139 21.954 0.585 1.00 0.00 O ATOM 2383 CB SER A 149 -3.415 20.491 2.629 1.00 0.00 C ATOM 2384 OG SER A 149 -2.464 21.468 3.035 1.00 0.00 O ATOM 0 H SER A 149 -5.315 19.199 3.703 1.00 0.00 H new ATOM 0 HA SER A 149 -4.783 22.062 3.208 1.00 0.00 H new ATOM 0 HB2 SER A 149 -3.307 19.590 3.232 1.00 0.00 H new ATOM 0 HB3 SER A 149 -3.238 20.204 1.592 1.00 0.00 H new ATOM 0 HG SER A 149 -1.559 21.104 2.938 1.00 0.00 H new ATOM 2390 N ILE A 150 -6.420 20.259 1.130 1.00 0.00 N ATOM 2391 CA ILE A 150 -7.078 20.283 -0.205 1.00 0.00 C ATOM 2392 C ILE A 150 -8.120 21.401 -0.234 1.00 0.00 C ATOM 2393 O ILE A 150 -7.834 22.543 0.068 1.00 0.00 O ATOM 2394 CB ILE A 150 -7.761 18.936 -0.473 1.00 0.00 C ATOM 2395 CG1 ILE A 150 -6.939 17.793 0.129 1.00 0.00 C ATOM 2396 CG2 ILE A 150 -7.866 18.721 -1.981 1.00 0.00 C ATOM 2397 CD1 ILE A 150 -7.736 16.491 0.028 1.00 0.00 C ATOM 0 H ILE A 150 -6.756 19.539 1.769 1.00 0.00 H new ATOM 0 HA ILE A 150 -6.328 20.461 -0.975 1.00 0.00 H new ATOM 0 HB ILE A 150 -8.751 18.946 -0.018 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -5.990 17.694 -0.399 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -6.703 18.009 1.171 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -8.351 17.765 -2.179 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -8.455 19.525 -2.423 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -6.868 18.719 -2.419 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -7.154 15.674 0.456 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -8.673 16.595 0.575 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -7.949 16.275 -1.019 1.00 0.00 H new ATOM 2409 N GLU A 151 -9.327 21.076 -0.596 1.00 0.00 N ATOM 2410 CA GLU A 151 -10.403 22.106 -0.651 1.00 0.00 C ATOM 2411 C GLU A 151 -11.460 21.794 0.414 1.00 0.00 C ATOM 2412 O GLU A 151 -11.353 22.210 1.550 1.00 0.00 O ATOM 2413 CB GLU A 151 -11.054 22.089 -2.038 1.00 0.00 C ATOM 2414 CG GLU A 151 -10.028 22.511 -3.091 1.00 0.00 C ATOM 2415 CD GLU A 151 -9.604 23.962 -2.845 1.00 0.00 C ATOM 2416 OE1 GLU A 151 -10.310 24.652 -2.128 1.00 0.00 O ATOM 2417 OE2 GLU A 151 -8.577 24.355 -3.377 1.00 0.00 O ATOM 0 H GLU A 151 -9.618 20.134 -0.858 1.00 0.00 H new ATOM 0 HA GLU A 151 -9.976 23.091 -0.462 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -11.431 21.091 -2.262 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -11.909 22.764 -2.058 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -9.158 21.855 -3.049 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -10.454 22.411 -4.089 1.00 0.00 H new ATOM 2425 N ALA A 152 -12.478 21.063 0.054 1.00 0.00 N ATOM 2426 CA ALA A 152 -13.542 20.722 1.041 1.00 0.00 C ATOM 2427 C ALA A 152 -14.502 19.705 0.423 1.00 0.00 C ATOM 2428 O ALA A 152 -15.701 19.774 0.612 1.00 0.00 O ATOM 2429 CB ALA A 152 -14.313 21.989 1.418 1.00 0.00 C ATOM 0 H ALA A 152 -12.620 20.686 -0.883 1.00 0.00 H new ATOM 0 HA ALA A 152 -13.086 20.295 1.935 1.00 0.00 H new ATOM 0 HB1 ALA A 152 -15.091 21.740 2.140 1.00 0.00 H new ATOM 0 HB2 ALA A 152 -13.628 22.714 1.858 1.00 0.00 H new ATOM 0 HB3 ALA A 152 -14.769 22.416 0.525 1.00 0.00 H new ATOM 2435 N LEU A 153 -13.985 18.763 -0.316 1.00 0.00 N ATOM 2436 CA LEU A 153 -14.862 17.738 -0.948 1.00 0.00 C ATOM 2437 C LEU A 153 -14.583 16.372 -0.318 1.00 0.00 C ATOM 2438 O LEU A 153 -13.752 16.252 0.579 1.00 0.00 O ATOM 2439 CB LEU A 153 -14.573 17.679 -2.449 1.00 0.00 C ATOM 2440 CG LEU A 153 -15.513 16.670 -3.116 1.00 0.00 C ATOM 2441 CD1 LEU A 153 -16.953 17.179 -3.036 1.00 0.00 C ATOM 2442 CD2 LEU A 153 -15.118 16.495 -4.584 1.00 0.00 C ATOM 0 H LEU A 153 -12.989 18.659 -0.510 1.00 0.00 H new ATOM 0 HA LEU A 153 -15.907 18.003 -0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -14.707 18.665 -2.894 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -13.535 17.391 -2.618 1.00 0.00 H new ATOM 0 HG LEU A 153 -15.437 15.712 -2.601 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -17.620 16.460 -3.511 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -17.238 17.303 -1.991 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -17.029 18.138 -3.549 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -15.787 15.777 -5.058 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -15.192 17.454 -5.097 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -14.093 16.130 -4.644 1.00 0.00 H new TER 2454 LEU A 153