USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1306 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: B 57 MET CE :methyl -155:sc= -0.102 (180deg=-0.695) USER MOD Set 1.2: B 68 CYS SG : rot 180:sc= -0.458 USER MOD Set 2.1: B 33 LYS NZ :NH3+ -169:sc= 0.66 (180deg=-0.262) USER MOD Set 2.2: B 37 ASN : amide:sc= -0.436 K(o=0.22,f=-3.9) USER MOD Set 3.1: B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 28 LYS NZ :NH3+ -166:sc= 0.181 (180deg=-0.0528) USER MOD Set 4.1: A 78 SER OG : rot 28:sc= 0.43 USER MOD Set 4.2: A 81 THR OG1 : rot -100:sc= -0.968 USER MOD Set 4.3: B 7 MET CE :methyl -179:sc= 0 (180deg=-0.00116) USER MOD Set 4.4: B 74 MET CE :methyl 152:sc= -0.625 (180deg=-2.86!) USER MOD Set 5.1: A 7 MET CE :methyl -166:sc= -0.0253 (180deg=-0.0251) USER MOD Set 5.2: A 74 MET CE :methyl 153:sc= -0.567 (180deg=-2.99!) USER MOD Set 5.3: B 78 SER OG : rot 25:sc= 0.386 USER MOD Set 5.4: B 81 THR OG1 : rot -102:sc= -1.25! USER MOD Set 6.1: A 57 MET CE :methyl -127:sc= -0.088 (180deg=-0.627) USER MOD Set 6.2: A 68 CYS SG : rot 180:sc= -0.4 USER MOD Set 7.1: A 33 LYS NZ :NH3+ -168:sc= 0.679 (180deg=-0.267) USER MOD Set 7.2: A 37 ASN : amide:sc= -0.479 K(o=0.2,f=-3.6) USER MOD Set 8.1: A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.2: A 28 LYS NZ :NH3+ -167:sc= 0.161 (180deg=-0.012) USER MOD Single : A 1 SER N :NH3+ -124:sc= 0.0809 (180deg=-0.192) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -0.0403 X(o=-0.04,f=-0.42) USER MOD Single : A 16 GLN : amide:sc= -0.164 K(o=-0.16,f=-0.95) USER MOD Single : A 17 TYR OH : rot 12:sc= -3.84! USER MOD Single : A 18 SER OG : rot -55:sc= 1.11 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -2.3! C(o=-2.3!,f=-4.6!) USER MOD Single : A 29 LYS NZ :NH3+ 160:sc= 1.09 (180deg=-0.23) USER MOD Single : A 30 SER OG : rot 180:sc=-0.00123 USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 LYS NZ :NH3+ -156:sc= -0.168 (180deg=-0.947) USER MOD Single : A 50 GLN : amide:sc= -2.49! C(o=-2.5!,f=-2.4!) USER MOD Single : A 55 LYS NZ :NH3+ -152:sc= -0.273 (180deg=-1.35!) USER MOD Single : A 59 THR OG1 : rot 82:sc= 0.0771 USER MOD Single : A 71 GLN : amide:sc= -2.46! C(o=-2.5!,f=-3.5!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot -65:sc= 0.562 USER MOD Single : A 84 CYS SG : rot 112:sc= 0.403 USER MOD Single : B 1 SER N :NH3+ -126:sc= 0.0983 (180deg=-0.203) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= -0.0526 K(o=-0.053,f=-0.55) USER MOD Single : B 16 GLN : amide:sc= -0.161 K(o=-0.16,f=-0.91) USER MOD Single : B 17 TYR OH : rot 7:sc= -3.8! USER MOD Single : B 18 SER OG : rot -66:sc= 1.08 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -2.35! C(o=-2.3!,f=-4.6!) USER MOD Single : B 29 LYS NZ :NH3+ -113:sc= 0.934 (180deg=-0.00662!) USER MOD Single : B 30 SER OG : rot 180:sc= -0.011 USER MOD Single : B 38 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 48 LYS NZ :NH3+ -159:sc= -0.107 (180deg=-0.851) USER MOD Single : B 50 GLN : amide:sc= -2.37! C(o=-2.4!,f=-2.3!) USER MOD Single : B 55 LYS NZ :NH3+ -135:sc= -0.303 (180deg=-1.35!) USER MOD Single : B 59 THR OG1 : rot 82:sc= 0.0575 USER MOD Single : B 71 GLN : amide:sc= -2.37! C(o=-2.4!,f=-3.5!) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 82 THR OG1 : rot -68:sc= 0.376 USER MOD Single : B 84 CYS SG : rot 112:sc= 0.368 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 67.679 12.951 -10.138 1.00 0.00 N ATOM 2 CA SER A 1 68.338 12.001 -11.076 1.00 0.00 C ATOM 3 C SER A 1 67.737 10.606 -10.896 1.00 0.00 C ATOM 4 O SER A 1 67.039 10.338 -9.938 1.00 0.00 O ATOM 5 CB SER A 1 69.836 11.950 -10.786 1.00 0.00 C ATOM 6 OG SER A 1 70.405 13.229 -11.032 1.00 0.00 O ATOM 0 H1 SER A 1 67.280 13.748 -10.674 1.00 0.00 H new ATOM 0 H2 SER A 1 66.917 12.461 -9.626 1.00 0.00 H new ATOM 0 H3 SER A 1 68.379 13.309 -9.457 1.00 0.00 H new ATOM 0 HA SER A 1 68.179 12.337 -12.101 1.00 0.00 H new ATOM 0 HB2 SER A 1 70.008 11.656 -9.751 1.00 0.00 H new ATOM 0 HB3 SER A 1 70.315 11.199 -11.415 1.00 0.00 H new ATOM 0 HG SER A 1 71.367 13.201 -10.845 1.00 0.00 H new ATOM 14 N GLU A 2 67.990 9.723 -11.820 1.00 0.00 N ATOM 15 CA GLU A 2 67.428 8.348 -11.727 1.00 0.00 C ATOM 16 C GLU A 2 67.910 7.658 -10.442 1.00 0.00 C ATOM 17 O GLU A 2 67.166 6.940 -9.801 1.00 0.00 O ATOM 18 CB GLU A 2 67.877 7.542 -12.953 1.00 0.00 C ATOM 19 CG GLU A 2 67.198 6.169 -12.961 1.00 0.00 C ATOM 20 CD GLU A 2 65.687 6.342 -13.125 1.00 0.00 C ATOM 21 OE1 GLU A 2 65.279 7.390 -13.598 1.00 0.00 O ATOM 22 OE2 GLU A 2 64.965 5.426 -12.771 1.00 0.00 O ATOM 0 H GLU A 2 68.567 9.897 -12.643 1.00 0.00 H new ATOM 0 HA GLU A 2 66.340 8.404 -11.699 1.00 0.00 H new ATOM 0 HB2 GLU A 2 67.628 8.084 -13.865 1.00 0.00 H new ATOM 0 HB3 GLU A 2 68.960 7.420 -12.940 1.00 0.00 H new ATOM 0 HG2 GLU A 2 67.595 5.561 -13.774 1.00 0.00 H new ATOM 0 HG3 GLU A 2 67.415 5.640 -12.033 1.00 0.00 H new ATOM 29 N LEU A 3 69.137 7.875 -10.046 1.00 0.00 N ATOM 30 CA LEU A 3 69.635 7.237 -8.791 1.00 0.00 C ATOM 31 C LEU A 3 68.947 7.876 -7.583 1.00 0.00 C ATOM 32 O LEU A 3 68.702 7.229 -6.584 1.00 0.00 O ATOM 33 CB LEU A 3 71.159 7.423 -8.677 1.00 0.00 C ATOM 34 CG LEU A 3 71.692 6.767 -7.366 1.00 0.00 C ATOM 35 CD1 LEU A 3 73.043 6.087 -7.624 1.00 0.00 C ATOM 36 CD2 LEU A 3 71.892 7.831 -6.273 1.00 0.00 C ATOM 0 H LEU A 3 69.813 8.463 -10.534 1.00 0.00 H new ATOM 0 HA LEU A 3 69.407 6.171 -8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.652 6.976 -9.541 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.403 8.485 -8.685 1.00 0.00 H new ATOM 0 HG LEU A 3 70.957 6.032 -7.038 1.00 0.00 H new ATOM 0 HD11 LEU A 3 73.404 5.633 -6.701 1.00 0.00 H new ATOM 0 HD12 LEU A 3 72.923 5.316 -8.385 1.00 0.00 H new ATOM 0 HD13 LEU A 3 73.763 6.828 -7.970 1.00 0.00 H new ATOM 0 HD21 LEU A 3 72.264 7.355 -5.366 1.00 0.00 H new ATOM 0 HD22 LEU A 3 72.613 8.573 -6.615 1.00 0.00 H new ATOM 0 HD23 LEU A 3 70.941 8.320 -6.062 1.00 0.00 H new ATOM 48 N GLU A 4 68.626 9.140 -7.667 1.00 0.00 N ATOM 49 CA GLU A 4 67.946 9.816 -6.523 1.00 0.00 C ATOM 50 C GLU A 4 66.606 9.133 -6.255 1.00 0.00 C ATOM 51 O GLU A 4 66.218 8.916 -5.125 1.00 0.00 O ATOM 52 CB GLU A 4 67.706 11.287 -6.880 1.00 0.00 C ATOM 53 CG GLU A 4 67.008 12.005 -5.718 1.00 0.00 C ATOM 54 CD GLU A 4 66.776 13.471 -6.091 1.00 0.00 C ATOM 55 OE1 GLU A 4 65.732 13.760 -6.652 1.00 0.00 O ATOM 56 OE2 GLU A 4 67.642 14.279 -5.803 1.00 0.00 O ATOM 0 H GLU A 4 68.805 9.733 -8.477 1.00 0.00 H new ATOM 0 HA GLU A 4 68.571 9.751 -5.632 1.00 0.00 H new ATOM 0 HB2 GLU A 4 68.655 11.775 -7.101 1.00 0.00 H new ATOM 0 HB3 GLU A 4 67.095 11.356 -7.780 1.00 0.00 H new ATOM 0 HG2 GLU A 4 66.057 11.520 -5.495 1.00 0.00 H new ATOM 0 HG3 GLU A 4 67.618 11.940 -4.817 1.00 0.00 H new ATOM 63 N LYS A 5 65.894 8.807 -7.294 1.00 0.00 N ATOM 64 CA LYS A 5 64.568 8.151 -7.128 1.00 0.00 C ATOM 65 C LYS A 5 64.728 6.829 -6.384 1.00 0.00 C ATOM 66 O LYS A 5 63.913 6.466 -5.559 1.00 0.00 O ATOM 67 CB LYS A 5 63.957 7.894 -8.504 1.00 0.00 C ATOM 68 CG LYS A 5 63.575 9.232 -9.135 1.00 0.00 C ATOM 69 CD LYS A 5 62.964 8.989 -10.512 1.00 0.00 C ATOM 70 CE LYS A 5 62.582 10.328 -11.141 1.00 0.00 C ATOM 71 NZ LYS A 5 62.214 10.114 -12.568 1.00 0.00 N ATOM 0 H LYS A 5 66.176 8.968 -8.261 1.00 0.00 H new ATOM 0 HA LYS A 5 63.913 8.804 -6.551 1.00 0.00 H new ATOM 0 HB2 LYS A 5 64.669 7.367 -9.140 1.00 0.00 H new ATOM 0 HB3 LYS A 5 63.078 7.256 -8.413 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.864 9.757 -8.497 1.00 0.00 H new ATOM 0 HG3 LYS A 5 64.455 9.869 -9.223 1.00 0.00 H new ATOM 0 HD2 LYS A 5 63.675 8.465 -11.150 1.00 0.00 H new ATOM 0 HD3 LYS A 5 62.084 8.352 -10.424 1.00 0.00 H new ATOM 0 HE2 LYS A 5 61.746 10.771 -10.600 1.00 0.00 H new ATOM 0 HE3 LYS A 5 63.415 11.027 -11.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 61.953 11.024 -12.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 63.024 9.708 -13.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 61.407 9.460 -12.624 1.00 0.00 H new ATOM 85 N ALA A 6 65.769 6.102 -6.671 1.00 0.00 N ATOM 86 CA ALA A 6 65.965 4.801 -5.980 1.00 0.00 C ATOM 87 C ALA A 6 66.073 5.049 -4.474 1.00 0.00 C ATOM 88 O ALA A 6 65.491 4.339 -3.676 1.00 0.00 O ATOM 89 CB ALA A 6 67.256 4.154 -6.487 1.00 0.00 C ATOM 0 H ALA A 6 66.488 6.351 -7.350 1.00 0.00 H new ATOM 0 HA ALA A 6 65.123 4.139 -6.182 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.406 3.199 -5.984 1.00 0.00 H new ATOM 0 HB2 ALA A 6 67.183 3.990 -7.562 1.00 0.00 H new ATOM 0 HB3 ALA A 6 68.100 4.811 -6.276 1.00 0.00 H new ATOM 95 N MET A 7 66.796 6.061 -4.077 1.00 0.00 N ATOM 96 CA MET A 7 66.918 6.362 -2.623 1.00 0.00 C ATOM 97 C MET A 7 65.534 6.681 -2.049 1.00 0.00 C ATOM 98 O MET A 7 65.135 6.162 -1.024 1.00 0.00 O ATOM 99 CB MET A 7 67.828 7.580 -2.442 1.00 0.00 C ATOM 100 CG MET A 7 68.145 7.783 -0.958 1.00 0.00 C ATOM 101 SD MET A 7 69.424 6.607 -0.458 1.00 0.00 S ATOM 102 CE MET A 7 70.852 7.624 -0.907 1.00 0.00 C ATOM 0 H MET A 7 67.306 6.691 -4.696 1.00 0.00 H new ATOM 0 HA MET A 7 67.338 5.501 -2.104 1.00 0.00 H new ATOM 0 HB2 MET A 7 68.752 7.440 -3.004 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.342 8.470 -2.843 1.00 0.00 H new ATOM 0 HG2 MET A 7 68.484 8.804 -0.782 1.00 0.00 H new ATOM 0 HG3 MET A 7 67.246 7.638 -0.359 1.00 0.00 H new ATOM 0 HE1 MET A 7 71.750 7.006 -0.917 1.00 0.00 H new ATOM 0 HE2 MET A 7 70.696 8.053 -1.897 1.00 0.00 H new ATOM 0 HE3 MET A 7 70.971 8.426 -0.178 1.00 0.00 H new ATOM 112 N VAL A 8 64.816 7.563 -2.692 1.00 0.00 N ATOM 113 CA VAL A 8 63.472 7.966 -2.184 1.00 0.00 C ATOM 114 C VAL A 8 62.547 6.751 -2.112 1.00 0.00 C ATOM 115 O VAL A 8 61.782 6.603 -1.178 1.00 0.00 O ATOM 116 CB VAL A 8 62.876 9.010 -3.139 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.408 9.278 -2.787 1.00 0.00 C ATOM 118 CG2 VAL A 8 63.671 10.312 -3.021 1.00 0.00 C ATOM 0 H VAL A 8 65.105 8.025 -3.554 1.00 0.00 H new ATOM 0 HA VAL A 8 63.573 8.387 -1.184 1.00 0.00 H new ATOM 0 HB VAL A 8 62.931 8.630 -4.159 1.00 0.00 H new ATOM 0 HG11 VAL A 8 60.999 10.020 -3.473 1.00 0.00 H new ATOM 0 HG12 VAL A 8 60.839 8.352 -2.872 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.341 9.652 -1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 8 63.252 11.057 -3.697 1.00 0.00 H new ATOM 0 HG22 VAL A 8 63.616 10.680 -1.997 1.00 0.00 H new ATOM 0 HG23 VAL A 8 64.712 10.128 -3.285 1.00 0.00 H new ATOM 128 N ALA A 9 62.598 5.881 -3.077 1.00 0.00 N ATOM 129 CA ALA A 9 61.703 4.695 -3.029 1.00 0.00 C ATOM 130 C ALA A 9 62.006 3.888 -1.766 1.00 0.00 C ATOM 131 O ALA A 9 61.114 3.390 -1.107 1.00 0.00 O ATOM 132 CB ALA A 9 61.932 3.828 -4.270 1.00 0.00 C ATOM 0 H ALA A 9 63.213 5.937 -3.889 1.00 0.00 H new ATOM 0 HA ALA A 9 60.663 5.019 -3.011 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.275 2.959 -4.233 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.714 4.410 -5.166 1.00 0.00 H new ATOM 0 HB3 ALA A 9 62.970 3.497 -4.296 1.00 0.00 H new ATOM 138 N LEU A 10 63.257 3.737 -1.436 1.00 0.00 N ATOM 139 CA LEU A 10 63.622 2.944 -0.227 1.00 0.00 C ATOM 140 C LEU A 10 62.990 3.572 1.027 1.00 0.00 C ATOM 141 O LEU A 10 62.401 2.884 1.838 1.00 0.00 O ATOM 142 CB LEU A 10 65.153 2.914 -0.087 1.00 0.00 C ATOM 143 CG LEU A 10 65.576 2.095 1.144 1.00 0.00 C ATOM 144 CD1 LEU A 10 65.146 0.628 0.971 1.00 0.00 C ATOM 145 CD2 LEU A 10 67.102 2.162 1.289 1.00 0.00 C ATOM 0 H LEU A 10 64.045 4.129 -1.951 1.00 0.00 H new ATOM 0 HA LEU A 10 63.246 1.926 -0.333 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.596 2.483 -0.985 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.534 3.931 -0.000 1.00 0.00 H new ATOM 0 HG LEU A 10 65.098 2.505 2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 10 65.449 0.054 1.847 1.00 0.00 H new ATOM 0 HD12 LEU A 10 64.063 0.577 0.861 1.00 0.00 H new ATOM 0 HD13 LEU A 10 65.621 0.212 0.083 1.00 0.00 H new ATOM 0 HD21 LEU A 10 67.410 1.584 2.160 1.00 0.00 H new ATOM 0 HD22 LEU A 10 67.571 1.750 0.395 1.00 0.00 H new ATOM 0 HD23 LEU A 10 67.410 3.200 1.415 1.00 0.00 H new ATOM 157 N ILE A 11 63.119 4.863 1.208 1.00 0.00 N ATOM 158 CA ILE A 11 62.532 5.501 2.429 1.00 0.00 C ATOM 159 C ILE A 11 61.018 5.273 2.460 1.00 0.00 C ATOM 160 O ILE A 11 60.469 4.822 3.446 1.00 0.00 O ATOM 161 CB ILE A 11 62.816 7.008 2.394 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.317 7.246 2.576 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.043 7.714 3.517 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.642 8.712 2.278 1.00 0.00 C ATOM 0 H ILE A 11 63.600 5.498 0.571 1.00 0.00 H new ATOM 0 HA ILE A 11 62.980 5.058 3.319 1.00 0.00 H new ATOM 0 HB ILE A 11 62.495 7.412 1.434 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.615 6.996 3.594 1.00 0.00 H new ATOM 0 HG13 ILE A 11 64.883 6.594 1.910 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.250 8.784 3.485 1.00 0.00 H new ATOM 0 HG22 ILE A 11 60.974 7.547 3.383 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.355 7.313 4.481 1.00 0.00 H new ATOM 0 HD11 ILE A 11 65.711 8.881 2.408 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.359 8.946 1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.087 9.354 2.962 1.00 0.00 H new ATOM 176 N ASP A 12 60.339 5.600 1.398 1.00 0.00 N ATOM 177 CA ASP A 12 58.862 5.417 1.391 1.00 0.00 C ATOM 178 C ASP A 12 58.539 3.938 1.612 1.00 0.00 C ATOM 179 O ASP A 12 57.617 3.595 2.326 1.00 0.00 O ATOM 180 CB ASP A 12 58.294 5.868 0.042 1.00 0.00 C ATOM 181 CG ASP A 12 56.776 5.679 0.042 1.00 0.00 C ATOM 182 OD1 ASP A 12 56.268 5.123 1.001 1.00 0.00 O ATOM 183 OD2 ASP A 12 56.148 6.088 -0.921 1.00 0.00 O ATOM 0 H ASP A 12 60.738 5.983 0.541 1.00 0.00 H new ATOM 0 HA ASP A 12 58.416 6.014 2.186 1.00 0.00 H new ATOM 0 HB2 ASP A 12 58.541 6.914 -0.138 1.00 0.00 H new ATOM 0 HB3 ASP A 12 58.744 5.291 -0.766 1.00 0.00 H new ATOM 188 N VAL A 13 59.295 3.059 1.016 1.00 0.00 N ATOM 189 CA VAL A 13 59.026 1.607 1.204 1.00 0.00 C ATOM 190 C VAL A 13 59.383 1.199 2.641 1.00 0.00 C ATOM 191 O VAL A 13 58.676 0.437 3.269 1.00 0.00 O ATOM 192 CB VAL A 13 59.858 0.792 0.204 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.759 -0.700 0.545 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.325 1.025 -1.216 1.00 0.00 C ATOM 0 H VAL A 13 60.084 3.282 0.409 1.00 0.00 H new ATOM 0 HA VAL A 13 57.968 1.409 1.029 1.00 0.00 H new ATOM 0 HB VAL A 13 60.899 1.109 0.260 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.351 -1.276 -0.167 1.00 0.00 H new ATOM 0 HG12 VAL A 13 60.138 -0.869 1.553 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.718 -1.017 0.491 1.00 0.00 H new ATOM 0 HG21 VAL A 13 59.916 0.446 -1.926 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.283 0.710 -1.270 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.397 2.084 -1.462 1.00 0.00 H new ATOM 204 N PHE A 14 60.479 1.688 3.165 1.00 0.00 N ATOM 205 CA PHE A 14 60.871 1.309 4.558 1.00 0.00 C ATOM 206 C PHE A 14 59.814 1.785 5.556 1.00 0.00 C ATOM 207 O PHE A 14 59.302 1.018 6.347 1.00 0.00 O ATOM 208 CB PHE A 14 62.214 1.970 4.908 1.00 0.00 C ATOM 209 CG PHE A 14 62.574 1.672 6.350 1.00 0.00 C ATOM 210 CD1 PHE A 14 63.321 0.529 6.667 1.00 0.00 C ATOM 211 CD2 PHE A 14 62.169 2.546 7.369 1.00 0.00 C ATOM 212 CE1 PHE A 14 63.659 0.260 8.001 1.00 0.00 C ATOM 213 CE2 PHE A 14 62.509 2.274 8.701 1.00 0.00 C ATOM 214 CZ PHE A 14 63.253 1.132 9.016 1.00 0.00 C ATOM 0 H PHE A 14 61.116 2.329 2.692 1.00 0.00 H new ATOM 0 HA PHE A 14 60.958 0.224 4.614 1.00 0.00 H new ATOM 0 HB2 PHE A 14 62.996 1.600 4.245 1.00 0.00 H new ATOM 0 HB3 PHE A 14 62.150 3.047 4.755 1.00 0.00 H new ATOM 0 HD1 PHE A 14 63.636 -0.144 5.884 1.00 0.00 H new ATOM 0 HD2 PHE A 14 61.595 3.428 7.127 1.00 0.00 H new ATOM 0 HE1 PHE A 14 64.233 -0.621 8.245 1.00 0.00 H new ATOM 0 HE2 PHE A 14 62.196 2.947 9.486 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.514 0.924 10.043 1.00 0.00 H new ATOM 224 N HIS A 15 59.534 3.057 5.561 1.00 0.00 N ATOM 225 CA HIS A 15 58.570 3.621 6.544 1.00 0.00 C ATOM 226 C HIS A 15 57.181 2.995 6.414 1.00 0.00 C ATOM 227 O HIS A 15 56.550 2.688 7.407 1.00 0.00 O ATOM 228 CB HIS A 15 58.464 5.125 6.298 1.00 0.00 C ATOM 229 CG HIS A 15 57.497 5.734 7.273 1.00 0.00 C ATOM 230 ND1 HIS A 15 56.154 5.915 6.970 1.00 0.00 N ATOM 231 CD2 HIS A 15 57.662 6.217 8.546 1.00 0.00 C ATOM 232 CE1 HIS A 15 55.570 6.485 8.039 1.00 0.00 C ATOM 233 NE2 HIS A 15 56.446 6.689 9.024 1.00 0.00 N ATOM 0 H HIS A 15 59.937 3.738 4.918 1.00 0.00 H new ATOM 0 HA HIS A 15 58.935 3.404 7.548 1.00 0.00 H new ATOM 0 HB2 HIS A 15 59.444 5.590 6.405 1.00 0.00 H new ATOM 0 HB3 HIS A 15 58.132 5.313 5.277 1.00 0.00 H new ATOM 0 HD2 HIS A 15 58.593 6.229 9.092 1.00 0.00 H new ATOM 0 HE1 HIS A 15 54.523 6.745 8.093 1.00 0.00 H new ATOM 0 HE2 HIS A 15 56.262 7.105 9.937 1.00 0.00 H new ATOM 242 N GLN A 16 56.676 2.802 5.229 1.00 0.00 N ATOM 243 CA GLN A 16 55.314 2.201 5.112 1.00 0.00 C ATOM 244 C GLN A 16 55.350 0.733 5.526 1.00 0.00 C ATOM 245 O GLN A 16 54.465 0.242 6.200 1.00 0.00 O ATOM 246 CB GLN A 16 54.846 2.301 3.661 1.00 0.00 C ATOM 247 CG GLN A 16 54.675 3.770 3.287 1.00 0.00 C ATOM 248 CD GLN A 16 53.479 4.347 4.046 1.00 0.00 C ATOM 249 OE1 GLN A 16 52.459 3.698 4.179 1.00 0.00 O ATOM 250 NE2 GLN A 16 53.565 5.542 4.560 1.00 0.00 N ATOM 0 H GLN A 16 57.136 3.029 4.348 1.00 0.00 H new ATOM 0 HA GLN A 16 54.628 2.740 5.766 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.571 1.827 2.999 1.00 0.00 H new ATOM 0 HB3 GLN A 16 53.903 1.769 3.533 1.00 0.00 H new ATOM 0 HG2 GLN A 16 55.579 4.327 3.532 1.00 0.00 H new ATOM 0 HG3 GLN A 16 54.521 3.868 2.212 1.00 0.00 H new ATOM 0 HE21 GLN A 16 54.421 6.085 4.448 1.00 0.00 H new ATOM 0 HE22 GLN A 16 52.776 5.934 5.075 1.00 0.00 H new ATOM 259 N TYR A 17 56.368 0.032 5.127 1.00 0.00 N ATOM 260 CA TYR A 17 56.468 -1.404 5.492 1.00 0.00 C ATOM 261 C TYR A 17 56.791 -1.535 6.981 1.00 0.00 C ATOM 262 O TYR A 17 56.169 -2.288 7.703 1.00 0.00 O ATOM 263 CB TYR A 17 57.577 -2.067 4.682 1.00 0.00 C ATOM 264 CG TYR A 17 57.649 -3.521 5.066 1.00 0.00 C ATOM 265 CD1 TYR A 17 58.451 -3.918 6.140 1.00 0.00 C ATOM 266 CD2 TYR A 17 56.894 -4.467 4.364 1.00 0.00 C ATOM 267 CE1 TYR A 17 58.504 -5.265 6.510 1.00 0.00 C ATOM 268 CE2 TYR A 17 56.945 -5.814 4.735 1.00 0.00 C ATOM 269 CZ TYR A 17 57.750 -6.213 5.809 1.00 0.00 C ATOM 270 OH TYR A 17 57.798 -7.538 6.178 1.00 0.00 O ATOM 0 H TYR A 17 57.138 0.392 4.562 1.00 0.00 H new ATOM 0 HA TYR A 17 55.517 -1.891 5.277 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.378 -1.967 3.615 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.531 -1.577 4.875 1.00 0.00 H new ATOM 0 HD1 TYR A 17 59.029 -3.185 6.683 1.00 0.00 H new ATOM 0 HD2 TYR A 17 56.273 -4.157 3.537 1.00 0.00 H new ATOM 0 HE1 TYR A 17 59.127 -5.574 7.337 1.00 0.00 H new ATOM 0 HE2 TYR A 17 56.364 -6.546 4.194 1.00 0.00 H new ATOM 0 HH TYR A 17 58.243 -7.620 7.047 1.00 0.00 H new ATOM 280 N SER A 18 57.773 -0.808 7.439 1.00 0.00 N ATOM 281 CA SER A 18 58.163 -0.881 8.873 1.00 0.00 C ATOM 282 C SER A 18 57.083 -0.242 9.748 1.00 0.00 C ATOM 283 O SER A 18 57.008 -0.493 10.934 1.00 0.00 O ATOM 284 CB SER A 18 59.486 -0.139 9.072 1.00 0.00 C ATOM 285 OG SER A 18 59.291 1.246 8.826 1.00 0.00 O ATOM 0 H SER A 18 58.325 -0.162 6.875 1.00 0.00 H new ATOM 0 HA SER A 18 58.276 -1.926 9.160 1.00 0.00 H new ATOM 0 HB2 SER A 18 59.852 -0.291 10.087 1.00 0.00 H new ATOM 0 HB3 SER A 18 60.244 -0.536 8.397 1.00 0.00 H new ATOM 0 HG SER A 18 58.903 1.368 7.935 1.00 0.00 H new ATOM 291 N GLY A 19 56.252 0.587 9.179 1.00 0.00 N ATOM 292 CA GLY A 19 55.182 1.251 9.981 1.00 0.00 C ATOM 293 C GLY A 19 53.925 0.378 10.014 1.00 0.00 C ATOM 294 O GLY A 19 52.844 0.852 10.304 1.00 0.00 O ATOM 0 H GLY A 19 56.267 0.835 8.190 1.00 0.00 H new ATOM 0 HA2 GLY A 19 55.536 1.429 10.996 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.946 2.224 9.551 1.00 0.00 H new ATOM 298 N ARG A 20 54.047 -0.895 9.738 1.00 0.00 N ATOM 299 CA ARG A 20 52.848 -1.781 9.778 1.00 0.00 C ATOM 300 C ARG A 20 52.646 -2.280 11.209 1.00 0.00 C ATOM 301 O ARG A 20 51.574 -2.176 11.773 1.00 0.00 O ATOM 302 CB ARG A 20 53.065 -2.977 8.848 1.00 0.00 C ATOM 303 CG ARG A 20 53.034 -2.506 7.394 1.00 0.00 C ATOM 304 CD ARG A 20 53.250 -3.699 6.464 1.00 0.00 C ATOM 305 NE ARG A 20 52.125 -4.665 6.623 1.00 0.00 N ATOM 306 CZ ARG A 20 50.981 -4.442 6.034 1.00 0.00 C ATOM 307 NH1 ARG A 20 50.808 -3.356 5.332 1.00 0.00 N ATOM 308 NH2 ARG A 20 50.008 -5.303 6.154 1.00 0.00 N ATOM 0 H ARG A 20 54.922 -1.357 9.488 1.00 0.00 H new ATOM 0 HA ARG A 20 51.969 -1.226 9.452 1.00 0.00 H new ATOM 0 HB2 ARG A 20 54.021 -3.452 9.067 1.00 0.00 H new ATOM 0 HB3 ARG A 20 52.291 -3.726 9.015 1.00 0.00 H new ATOM 0 HG2 ARG A 20 52.078 -2.030 7.176 1.00 0.00 H new ATOM 0 HG3 ARG A 20 53.808 -1.757 7.227 1.00 0.00 H new ATOM 0 HD2 ARG A 20 53.309 -3.361 5.429 1.00 0.00 H new ATOM 0 HD3 ARG A 20 54.197 -4.187 6.695 1.00 0.00 H new ATOM 0 HE ARG A 20 52.249 -5.502 7.193 1.00 0.00 H new ATOM 0 HH11 ARG A 20 51.567 -2.680 5.243 1.00 0.00 H new ATOM 0 HH12 ARG A 20 49.914 -3.183 4.872 1.00 0.00 H new ATOM 0 HH21 ARG A 20 50.141 -6.149 6.707 1.00 0.00 H new ATOM 0 HH22 ARG A 20 49.114 -5.130 5.694 1.00 0.00 H new ATOM 322 N GLU A 21 53.682 -2.819 11.798 1.00 0.00 N ATOM 323 CA GLU A 21 53.596 -3.334 13.196 1.00 0.00 C ATOM 324 C GLU A 21 54.896 -2.986 13.926 1.00 0.00 C ATOM 325 O GLU A 21 55.953 -2.925 13.329 1.00 0.00 O ATOM 326 CB GLU A 21 53.402 -4.856 13.168 1.00 0.00 C ATOM 327 CG GLU A 21 53.310 -5.406 14.598 1.00 0.00 C ATOM 328 CD GLU A 21 52.086 -4.815 15.303 1.00 0.00 C ATOM 329 OE1 GLU A 21 51.175 -4.392 14.611 1.00 0.00 O ATOM 330 OE2 GLU A 21 52.080 -4.803 16.523 1.00 0.00 O ATOM 0 H GLU A 21 54.598 -2.925 11.362 1.00 0.00 H new ATOM 0 HA GLU A 21 52.751 -2.880 13.714 1.00 0.00 H new ATOM 0 HB2 GLU A 21 52.495 -5.104 12.616 1.00 0.00 H new ATOM 0 HB3 GLU A 21 54.233 -5.326 12.643 1.00 0.00 H new ATOM 0 HG2 GLU A 21 53.238 -6.493 14.575 1.00 0.00 H new ATOM 0 HG3 GLU A 21 54.215 -5.158 15.152 1.00 0.00 H new ATOM 337 N GLY A 22 54.825 -2.751 15.213 1.00 0.00 N ATOM 338 CA GLY A 22 56.053 -2.398 15.999 1.00 0.00 C ATOM 339 C GLY A 22 55.971 -0.932 16.426 1.00 0.00 C ATOM 340 O GLY A 22 55.014 -0.245 16.126 1.00 0.00 O ATOM 0 H GLY A 22 53.964 -2.788 15.759 1.00 0.00 H new ATOM 0 HA2 GLY A 22 56.136 -3.041 16.876 1.00 0.00 H new ATOM 0 HA3 GLY A 22 56.946 -2.564 15.396 1.00 0.00 H new ATOM 344 N ASP A 23 56.956 -0.441 17.129 1.00 0.00 N ATOM 345 CA ASP A 23 56.905 0.982 17.568 1.00 0.00 C ATOM 346 C ASP A 23 56.878 1.895 16.339 1.00 0.00 C ATOM 347 O ASP A 23 55.938 2.637 16.139 1.00 0.00 O ATOM 348 CB ASP A 23 58.133 1.304 18.422 1.00 0.00 C ATOM 349 CG ASP A 23 57.966 2.687 19.053 1.00 0.00 C ATOM 350 OD1 ASP A 23 57.117 3.430 18.590 1.00 0.00 O ATOM 351 OD2 ASP A 23 58.689 2.980 19.991 1.00 0.00 O ATOM 0 H ASP A 23 57.787 -0.959 17.416 1.00 0.00 H new ATOM 0 HA ASP A 23 56.005 1.145 18.160 1.00 0.00 H new ATOM 0 HB2 ASP A 23 58.256 0.550 19.200 1.00 0.00 H new ATOM 0 HB3 ASP A 23 59.033 1.279 17.808 1.00 0.00 H new ATOM 356 N LYS A 24 57.884 1.834 15.499 1.00 0.00 N ATOM 357 CA LYS A 24 57.875 2.699 14.279 1.00 0.00 C ATOM 358 C LYS A 24 59.031 2.334 13.333 1.00 0.00 C ATOM 359 O LYS A 24 58.804 1.896 12.222 1.00 0.00 O ATOM 360 CB LYS A 24 57.996 4.174 14.673 1.00 0.00 C ATOM 361 CG LYS A 24 57.756 5.041 13.433 1.00 0.00 C ATOM 362 CD LYS A 24 57.844 6.529 13.801 1.00 0.00 C ATOM 363 CE LYS A 24 56.645 6.939 14.670 1.00 0.00 C ATOM 364 NZ LYS A 24 56.448 8.413 14.572 1.00 0.00 N ATOM 0 H LYS A 24 58.700 1.231 15.604 1.00 0.00 H new ATOM 0 HA LYS A 24 56.930 2.533 13.762 1.00 0.00 H new ATOM 0 HB2 LYS A 24 57.270 4.417 15.449 1.00 0.00 H new ATOM 0 HB3 LYS A 24 58.984 4.374 15.087 1.00 0.00 H new ATOM 0 HG2 LYS A 24 58.494 4.804 12.666 1.00 0.00 H new ATOM 0 HG3 LYS A 24 56.776 4.821 13.011 1.00 0.00 H new ATOM 0 HD2 LYS A 24 58.773 6.723 14.337 1.00 0.00 H new ATOM 0 HD3 LYS A 24 57.867 7.133 12.894 1.00 0.00 H new ATOM 0 HE2 LYS A 24 55.747 6.418 14.340 1.00 0.00 H new ATOM 0 HE3 LYS A 24 56.817 6.652 15.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 55.637 8.695 15.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 57.304 8.901 14.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 56.266 8.674 13.582 1.00 0.00 H new ATOM 378 N HIS A 25 60.267 2.530 13.748 1.00 0.00 N ATOM 379 CA HIS A 25 61.434 2.216 12.854 1.00 0.00 C ATOM 380 C HIS A 25 62.217 1.009 13.375 1.00 0.00 C ATOM 381 O HIS A 25 63.342 0.787 12.976 1.00 0.00 O ATOM 382 CB HIS A 25 62.373 3.424 12.801 1.00 0.00 C ATOM 383 CG HIS A 25 62.843 3.759 14.190 1.00 0.00 C ATOM 384 ND1 HIS A 25 63.449 2.820 15.016 1.00 0.00 N ATOM 385 CD2 HIS A 25 62.801 4.924 14.915 1.00 0.00 C ATOM 386 CE1 HIS A 25 63.742 3.432 16.178 1.00 0.00 C ATOM 387 NE2 HIS A 25 63.369 4.714 16.166 1.00 0.00 N ATOM 0 H HIS A 25 60.516 2.894 14.668 1.00 0.00 H new ATOM 0 HA HIS A 25 61.049 1.985 11.861 1.00 0.00 H new ATOM 0 HB2 HIS A 25 63.227 3.206 12.160 1.00 0.00 H new ATOM 0 HB3 HIS A 25 61.857 4.279 12.364 1.00 0.00 H new ATOM 0 HD2 HIS A 25 62.390 5.860 14.567 1.00 0.00 H new ATOM 0 HE1 HIS A 25 64.220 2.947 17.016 1.00 0.00 H new ATOM 0 HE2 HIS A 25 63.478 5.396 16.917 1.00 0.00 H new ATOM 396 N LYS A 26 61.642 0.225 14.249 1.00 0.00 N ATOM 397 CA LYS A 26 62.368 -0.976 14.781 1.00 0.00 C ATOM 398 C LYS A 26 61.745 -2.241 14.188 1.00 0.00 C ATOM 399 O LYS A 26 60.544 -2.421 14.207 1.00 0.00 O ATOM 400 CB LYS A 26 62.262 -1.002 16.307 1.00 0.00 C ATOM 401 CG LYS A 26 60.819 -1.272 16.729 1.00 0.00 C ATOM 402 CD LYS A 26 60.674 -0.991 18.225 1.00 0.00 C ATOM 403 CE LYS A 26 61.656 -1.865 19.015 1.00 0.00 C ATOM 404 NZ LYS A 26 61.163 -2.018 20.411 1.00 0.00 N ATOM 0 H LYS A 26 60.702 0.361 14.620 1.00 0.00 H new ATOM 0 HA LYS A 26 63.420 -0.928 14.501 1.00 0.00 H new ATOM 0 HB2 LYS A 26 62.918 -1.773 16.712 1.00 0.00 H new ATOM 0 HB3 LYS A 26 62.597 -0.050 16.719 1.00 0.00 H new ATOM 0 HG2 LYS A 26 60.137 -0.641 16.160 1.00 0.00 H new ATOM 0 HG3 LYS A 26 60.551 -2.306 16.513 1.00 0.00 H new ATOM 0 HD2 LYS A 26 60.867 0.063 18.427 1.00 0.00 H new ATOM 0 HD3 LYS A 26 59.652 -1.195 18.545 1.00 0.00 H new ATOM 0 HE2 LYS A 26 61.753 -2.842 18.542 1.00 0.00 H new ATOM 0 HE3 LYS A 26 62.647 -1.411 19.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 61.826 -2.610 20.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 61.092 -1.082 20.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 60.226 -2.469 20.401 1.00 0.00 H new ATOM 418 N LEU A 27 62.556 -3.110 13.639 1.00 0.00 N ATOM 419 CA LEU A 27 62.018 -4.362 13.020 1.00 0.00 C ATOM 420 C LEU A 27 62.243 -5.547 13.963 1.00 0.00 C ATOM 421 O LEU A 27 63.343 -5.799 14.415 1.00 0.00 O ATOM 422 CB LEU A 27 62.756 -4.618 11.706 1.00 0.00 C ATOM 423 CG LEU A 27 62.604 -3.412 10.773 1.00 0.00 C ATOM 424 CD1 LEU A 27 63.448 -3.644 9.518 1.00 0.00 C ATOM 425 CD2 LEU A 27 61.128 -3.231 10.374 1.00 0.00 C ATOM 0 H LEU A 27 63.570 -3.007 13.592 1.00 0.00 H new ATOM 0 HA LEU A 27 60.950 -4.249 12.836 1.00 0.00 H new ATOM 0 HB2 LEU A 27 63.812 -4.804 11.903 1.00 0.00 H new ATOM 0 HB3 LEU A 27 62.359 -5.512 11.225 1.00 0.00 H new ATOM 0 HG LEU A 27 62.941 -2.513 11.288 1.00 0.00 H new ATOM 0 HD11 LEU A 27 63.346 -2.790 8.848 1.00 0.00 H new ATOM 0 HD12 LEU A 27 64.494 -3.761 9.800 1.00 0.00 H new ATOM 0 HD13 LEU A 27 63.106 -4.546 9.011 1.00 0.00 H new ATOM 0 HD21 LEU A 27 61.033 -2.371 9.711 1.00 0.00 H new ATOM 0 HD22 LEU A 27 60.778 -4.126 9.860 1.00 0.00 H new ATOM 0 HD23 LEU A 27 60.527 -3.068 11.268 1.00 0.00 H new ATOM 437 N LYS A 28 61.200 -6.280 14.256 1.00 0.00 N ATOM 438 CA LYS A 28 61.321 -7.463 15.165 1.00 0.00 C ATOM 439 C LYS A 28 61.504 -8.729 14.319 1.00 0.00 C ATOM 440 O LYS A 28 61.334 -8.709 13.116 1.00 0.00 O ATOM 441 CB LYS A 28 60.058 -7.571 16.023 1.00 0.00 C ATOM 442 CG LYS A 28 59.994 -6.369 16.971 1.00 0.00 C ATOM 443 CD LYS A 28 58.739 -6.454 17.840 1.00 0.00 C ATOM 444 CE LYS A 28 58.681 -5.244 18.777 1.00 0.00 C ATOM 445 NZ LYS A 28 59.732 -5.363 19.827 1.00 0.00 N ATOM 0 H LYS A 28 60.259 -6.109 13.901 1.00 0.00 H new ATOM 0 HA LYS A 28 62.184 -7.347 15.821 1.00 0.00 H new ATOM 0 HB2 LYS A 28 59.173 -7.597 15.388 1.00 0.00 H new ATOM 0 HB3 LYS A 28 60.069 -8.500 16.593 1.00 0.00 H new ATOM 0 HG2 LYS A 28 60.882 -6.346 17.602 1.00 0.00 H new ATOM 0 HG3 LYS A 28 59.987 -5.443 16.397 1.00 0.00 H new ATOM 0 HD2 LYS A 28 57.850 -6.482 17.210 1.00 0.00 H new ATOM 0 HD3 LYS A 28 58.748 -7.376 18.421 1.00 0.00 H new ATOM 0 HE2 LYS A 28 58.826 -4.326 18.208 1.00 0.00 H new ATOM 0 HE3 LYS A 28 57.697 -5.180 19.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 59.552 -4.668 20.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 59.713 -6.322 20.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 60.666 -5.183 19.406 1.00 0.00 H new ATOM 459 N LYS A 29 61.883 -9.825 14.926 1.00 0.00 N ATOM 460 CA LYS A 29 62.111 -11.071 14.134 1.00 0.00 C ATOM 461 C LYS A 29 60.847 -11.437 13.351 1.00 0.00 C ATOM 462 O LYS A 29 60.916 -11.823 12.200 1.00 0.00 O ATOM 463 CB LYS A 29 62.469 -12.219 15.086 1.00 0.00 C ATOM 464 CG LYS A 29 62.902 -13.440 14.273 1.00 0.00 C ATOM 465 CD LYS A 29 63.496 -14.504 15.205 1.00 0.00 C ATOM 466 CE LYS A 29 62.439 -14.975 16.208 1.00 0.00 C ATOM 467 NZ LYS A 29 62.853 -16.288 16.781 1.00 0.00 N ATOM 0 H LYS A 29 62.044 -9.911 15.930 1.00 0.00 H new ATOM 0 HA LYS A 29 62.928 -10.903 13.432 1.00 0.00 H new ATOM 0 HB2 LYS A 29 63.272 -11.912 15.757 1.00 0.00 H new ATOM 0 HB3 LYS A 29 61.611 -12.470 15.709 1.00 0.00 H new ATOM 0 HG2 LYS A 29 62.048 -13.851 13.735 1.00 0.00 H new ATOM 0 HG3 LYS A 29 63.639 -13.147 13.525 1.00 0.00 H new ATOM 0 HD2 LYS A 29 63.856 -15.350 14.620 1.00 0.00 H new ATOM 0 HD3 LYS A 29 64.355 -14.095 15.736 1.00 0.00 H new ATOM 0 HE2 LYS A 29 62.322 -14.239 17.003 1.00 0.00 H new ATOM 0 HE3 LYS A 29 61.471 -15.069 15.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 62.349 -16.451 17.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 62.621 -17.048 16.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 63.878 -16.282 16.957 1.00 0.00 H new ATOM 481 N SER A 30 59.696 -11.305 13.944 1.00 0.00 N ATOM 482 CA SER A 30 58.444 -11.633 13.203 1.00 0.00 C ATOM 483 C SER A 30 58.299 -10.665 12.026 1.00 0.00 C ATOM 484 O SER A 30 57.830 -11.022 10.964 1.00 0.00 O ATOM 485 CB SER A 30 57.244 -11.496 14.139 1.00 0.00 C ATOM 486 OG SER A 30 57.133 -10.146 14.567 1.00 0.00 O ATOM 0 H SER A 30 59.565 -10.986 14.904 1.00 0.00 H new ATOM 0 HA SER A 30 58.488 -12.657 12.833 1.00 0.00 H new ATOM 0 HB2 SER A 30 56.332 -11.803 13.627 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.363 -12.154 15.000 1.00 0.00 H new ATOM 0 HG SER A 30 56.363 -10.055 15.166 1.00 0.00 H new ATOM 492 N GLU A 31 58.716 -9.444 12.213 1.00 0.00 N ATOM 493 CA GLU A 31 58.629 -8.438 11.115 1.00 0.00 C ATOM 494 C GLU A 31 59.638 -8.797 10.020 1.00 0.00 C ATOM 495 O GLU A 31 59.418 -8.549 8.852 1.00 0.00 O ATOM 496 CB GLU A 31 58.947 -7.045 11.664 1.00 0.00 C ATOM 497 CG GLU A 31 57.810 -6.575 12.575 1.00 0.00 C ATOM 498 CD GLU A 31 58.153 -5.201 13.154 1.00 0.00 C ATOM 499 OE1 GLU A 31 58.051 -4.229 12.422 1.00 0.00 O ATOM 500 OE2 GLU A 31 58.513 -5.144 14.320 1.00 0.00 O ATOM 0 H GLU A 31 59.116 -9.096 13.085 1.00 0.00 H new ATOM 0 HA GLU A 31 57.621 -8.439 10.701 1.00 0.00 H new ATOM 0 HB2 GLU A 31 59.884 -7.068 12.220 1.00 0.00 H new ATOM 0 HB3 GLU A 31 59.081 -6.342 10.842 1.00 0.00 H new ATOM 0 HG2 GLU A 31 56.878 -6.522 12.013 1.00 0.00 H new ATOM 0 HG3 GLU A 31 57.656 -7.292 13.381 1.00 0.00 H new ATOM 507 N LEU A 32 60.743 -9.382 10.395 1.00 0.00 N ATOM 508 CA LEU A 32 61.768 -9.759 9.379 1.00 0.00 C ATOM 509 C LEU A 32 61.244 -10.915 8.520 1.00 0.00 C ATOM 510 O LEU A 32 61.436 -10.945 7.320 1.00 0.00 O ATOM 511 CB LEU A 32 63.053 -10.175 10.105 1.00 0.00 C ATOM 512 CG LEU A 32 64.138 -10.585 9.098 1.00 0.00 C ATOM 513 CD1 LEU A 32 64.448 -9.421 8.142 1.00 0.00 C ATOM 514 CD2 LEU A 32 65.406 -10.968 9.871 1.00 0.00 C ATOM 0 H LEU A 32 60.981 -9.615 11.359 1.00 0.00 H new ATOM 0 HA LEU A 32 61.978 -8.911 8.727 1.00 0.00 H new ATOM 0 HB2 LEU A 32 63.413 -9.349 10.719 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.843 -11.006 10.779 1.00 0.00 H new ATOM 0 HG LEU A 32 63.786 -11.432 8.509 1.00 0.00 H new ATOM 0 HD11 LEU A 32 65.219 -9.727 7.434 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.544 -9.146 7.598 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.801 -8.564 8.715 1.00 0.00 H new ATOM 0 HD21 LEU A 32 66.186 -11.262 9.168 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.747 -10.114 10.456 1.00 0.00 H new ATOM 0 HD23 LEU A 32 65.187 -11.801 10.539 1.00 0.00 H new ATOM 526 N LYS A 33 60.586 -11.863 9.123 1.00 0.00 N ATOM 527 CA LYS A 33 60.050 -13.016 8.343 1.00 0.00 C ATOM 528 C LYS A 33 59.037 -12.520 7.305 1.00 0.00 C ATOM 529 O LYS A 33 58.997 -12.993 6.187 1.00 0.00 O ATOM 530 CB LYS A 33 59.366 -13.999 9.298 1.00 0.00 C ATOM 531 CG LYS A 33 58.879 -15.226 8.520 1.00 0.00 C ATOM 532 CD LYS A 33 58.216 -16.212 9.483 1.00 0.00 C ATOM 533 CE LYS A 33 57.815 -17.477 8.722 1.00 0.00 C ATOM 534 NZ LYS A 33 56.721 -17.153 7.764 1.00 0.00 N ATOM 0 H LYS A 33 60.395 -11.891 10.124 1.00 0.00 H new ATOM 0 HA LYS A 33 60.871 -13.515 7.828 1.00 0.00 H new ATOM 0 HB2 LYS A 33 60.062 -14.305 10.079 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.525 -13.514 9.793 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.171 -14.923 7.749 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.717 -15.704 8.013 1.00 0.00 H new ATOM 0 HD2 LYS A 33 58.902 -16.464 10.292 1.00 0.00 H new ATOM 0 HD3 LYS A 33 57.338 -15.756 9.940 1.00 0.00 H new ATOM 0 HE2 LYS A 33 58.675 -17.880 8.187 1.00 0.00 H new ATOM 0 HE3 LYS A 33 57.485 -18.246 9.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 56.309 -18.034 7.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 55.984 -16.604 8.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 57.105 -16.594 6.975 1.00 0.00 H new ATOM 548 N GLU A 34 58.215 -11.574 7.670 1.00 0.00 N ATOM 549 CA GLU A 34 57.202 -11.053 6.707 1.00 0.00 C ATOM 550 C GLU A 34 57.903 -10.425 5.502 1.00 0.00 C ATOM 551 O GLU A 34 57.544 -10.660 4.365 1.00 0.00 O ATOM 552 CB GLU A 34 56.345 -9.990 7.402 1.00 0.00 C ATOM 553 CG GLU A 34 55.449 -10.660 8.445 1.00 0.00 C ATOM 554 CD GLU A 34 54.592 -9.601 9.141 1.00 0.00 C ATOM 555 OE1 GLU A 34 54.764 -8.432 8.837 1.00 0.00 O ATOM 556 OE2 GLU A 34 53.777 -9.977 9.968 1.00 0.00 O ATOM 0 H GLU A 34 58.201 -11.139 8.593 1.00 0.00 H new ATOM 0 HA GLU A 34 56.572 -11.876 6.368 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.984 -9.247 7.879 1.00 0.00 H new ATOM 0 HB3 GLU A 34 55.736 -9.462 6.668 1.00 0.00 H new ATOM 0 HG2 GLU A 34 54.810 -11.403 7.967 1.00 0.00 H new ATOM 0 HG3 GLU A 34 56.059 -11.188 9.178 1.00 0.00 H new ATOM 563 N LEU A 35 58.897 -9.620 5.751 1.00 0.00 N ATOM 564 CA LEU A 35 59.632 -8.956 4.638 1.00 0.00 C ATOM 565 C LEU A 35 60.256 -10.013 3.724 1.00 0.00 C ATOM 566 O LEU A 35 60.167 -9.932 2.515 1.00 0.00 O ATOM 567 CB LEU A 35 60.723 -8.060 5.236 1.00 0.00 C ATOM 568 CG LEU A 35 61.514 -7.350 4.130 1.00 0.00 C ATOM 569 CD1 LEU A 35 60.583 -6.440 3.308 1.00 0.00 C ATOM 570 CD2 LEU A 35 62.615 -6.507 4.782 1.00 0.00 C ATOM 0 H LEU A 35 59.235 -9.391 6.686 1.00 0.00 H new ATOM 0 HA LEU A 35 58.945 -8.351 4.046 1.00 0.00 H new ATOM 0 HB2 LEU A 35 60.271 -7.321 5.897 1.00 0.00 H new ATOM 0 HB3 LEU A 35 61.399 -8.660 5.845 1.00 0.00 H new ATOM 0 HG LEU A 35 61.953 -8.091 3.461 1.00 0.00 H new ATOM 0 HD11 LEU A 35 61.158 -5.942 2.527 1.00 0.00 H new ATOM 0 HD12 LEU A 35 59.796 -7.041 2.853 1.00 0.00 H new ATOM 0 HD13 LEU A 35 60.136 -5.691 3.962 1.00 0.00 H new ATOM 0 HD21 LEU A 35 63.187 -5.995 4.008 1.00 0.00 H new ATOM 0 HD22 LEU A 35 62.164 -5.771 5.447 1.00 0.00 H new ATOM 0 HD23 LEU A 35 63.278 -7.155 5.355 1.00 0.00 H new ATOM 582 N ILE A 36 60.898 -11.001 4.289 1.00 0.00 N ATOM 583 CA ILE A 36 61.529 -12.052 3.443 1.00 0.00 C ATOM 584 C ILE A 36 60.452 -12.760 2.619 1.00 0.00 C ATOM 585 O ILE A 36 60.633 -13.042 1.456 1.00 0.00 O ATOM 586 CB ILE A 36 62.254 -13.073 4.332 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.440 -12.391 5.022 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.760 -14.241 3.470 1.00 0.00 C ATOM 589 CD1 ILE A 36 64.019 -13.319 6.095 1.00 0.00 C ATOM 0 H ILE A 36 61.012 -11.124 5.295 1.00 0.00 H new ATOM 0 HA ILE A 36 62.252 -11.587 2.773 1.00 0.00 H new ATOM 0 HB ILE A 36 61.565 -13.455 5.085 1.00 0.00 H new ATOM 0 HG12 ILE A 36 64.207 -12.145 4.288 1.00 0.00 H new ATOM 0 HG13 ILE A 36 63.119 -11.453 5.474 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.274 -14.964 4.103 1.00 0.00 H new ATOM 0 HG22 ILE A 36 61.915 -14.724 2.980 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.450 -13.864 2.715 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.862 -12.830 6.583 1.00 0.00 H new ATOM 0 HD12 ILE A 36 63.251 -13.543 6.836 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.356 -14.246 5.631 1.00 0.00 H new ATOM 601 N ASN A 37 59.336 -13.060 3.212 1.00 0.00 N ATOM 602 CA ASN A 37 58.259 -13.761 2.458 1.00 0.00 C ATOM 603 C ASN A 37 57.631 -12.837 1.411 1.00 0.00 C ATOM 604 O ASN A 37 57.295 -13.261 0.324 1.00 0.00 O ATOM 605 CB ASN A 37 57.176 -14.219 3.435 1.00 0.00 C ATOM 606 CG ASN A 37 57.719 -15.354 4.303 1.00 0.00 C ATOM 607 OD1 ASN A 37 57.472 -15.397 5.493 1.00 0.00 O ATOM 608 ND2 ASN A 37 58.453 -16.281 3.755 1.00 0.00 N ATOM 0 H ASN A 37 59.120 -12.851 4.187 1.00 0.00 H new ATOM 0 HA ASN A 37 58.697 -14.618 1.947 1.00 0.00 H new ATOM 0 HB2 ASN A 37 56.862 -13.385 4.063 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.296 -14.555 2.887 1.00 0.00 H new ATOM 0 HD21 ASN A 37 58.821 -17.043 4.324 1.00 0.00 H new ATOM 0 HD22 ASN A 37 58.660 -16.244 2.757 1.00 0.00 H new ATOM 615 N ASN A 38 57.427 -11.589 1.736 1.00 0.00 N ATOM 616 CA ASN A 38 56.771 -10.663 0.766 1.00 0.00 C ATOM 617 C ASN A 38 57.720 -10.215 -0.358 1.00 0.00 C ATOM 618 O ASN A 38 57.416 -10.365 -1.524 1.00 0.00 O ATOM 619 CB ASN A 38 56.286 -9.424 1.523 1.00 0.00 C ATOM 620 CG ASN A 38 55.452 -8.546 0.589 1.00 0.00 C ATOM 621 OD1 ASN A 38 54.579 -9.034 -0.100 1.00 0.00 O ATOM 622 ND2 ASN A 38 55.688 -7.264 0.534 1.00 0.00 N ATOM 0 H ASN A 38 57.685 -11.170 2.629 1.00 0.00 H new ATOM 0 HA ASN A 38 55.943 -11.201 0.303 1.00 0.00 H new ATOM 0 HB2 ASN A 38 55.691 -9.723 2.386 1.00 0.00 H new ATOM 0 HB3 ASN A 38 57.138 -8.861 1.903 1.00 0.00 H new ATOM 0 HD21 ASN A 38 55.139 -6.671 -0.088 1.00 0.00 H new ATOM 0 HD22 ASN A 38 56.421 -6.855 1.113 1.00 0.00 H new ATOM 629 N GLU A 39 58.829 -9.606 -0.027 1.00 0.00 N ATOM 630 CA GLU A 39 59.740 -9.083 -1.097 1.00 0.00 C ATOM 631 C GLU A 39 60.698 -10.151 -1.641 1.00 0.00 C ATOM 632 O GLU A 39 60.371 -10.891 -2.548 1.00 0.00 O ATOM 633 CB GLU A 39 60.561 -7.928 -0.524 1.00 0.00 C ATOM 634 CG GLU A 39 59.650 -6.724 -0.283 1.00 0.00 C ATOM 635 CD GLU A 39 60.472 -5.572 0.298 1.00 0.00 C ATOM 636 OE1 GLU A 39 61.651 -5.774 0.537 1.00 0.00 O ATOM 637 OE2 GLU A 39 59.910 -4.507 0.490 1.00 0.00 O ATOM 0 H GLU A 39 59.145 -9.447 0.930 1.00 0.00 H new ATOM 0 HA GLU A 39 59.114 -8.756 -1.927 1.00 0.00 H new ATOM 0 HB2 GLU A 39 61.034 -8.232 0.410 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.361 -7.660 -1.214 1.00 0.00 H new ATOM 0 HG2 GLU A 39 59.182 -6.416 -1.218 1.00 0.00 H new ATOM 0 HG3 GLU A 39 58.846 -6.994 0.402 1.00 0.00 H new ATOM 644 N LEU A 40 61.897 -10.198 -1.126 1.00 0.00 N ATOM 645 CA LEU A 40 62.906 -11.171 -1.642 1.00 0.00 C ATOM 646 C LEU A 40 62.426 -12.610 -1.447 1.00 0.00 C ATOM 647 O LEU A 40 62.036 -13.009 -0.373 1.00 0.00 O ATOM 648 CB LEU A 40 64.226 -10.960 -0.890 1.00 0.00 C ATOM 649 CG LEU A 40 64.769 -9.548 -1.171 1.00 0.00 C ATOM 650 CD1 LEU A 40 65.936 -9.255 -0.224 1.00 0.00 C ATOM 651 CD2 LEU A 40 65.259 -9.441 -2.629 1.00 0.00 C ATOM 0 H LEU A 40 62.224 -9.601 -0.366 1.00 0.00 H new ATOM 0 HA LEU A 40 63.049 -11.003 -2.709 1.00 0.00 H new ATOM 0 HB2 LEU A 40 64.070 -11.093 0.181 1.00 0.00 H new ATOM 0 HB3 LEU A 40 64.955 -11.708 -1.201 1.00 0.00 H new ATOM 0 HG LEU A 40 63.969 -8.825 -1.012 1.00 0.00 H new ATOM 0 HD11 LEU A 40 66.322 -8.255 -0.421 1.00 0.00 H new ATOM 0 HD12 LEU A 40 65.590 -9.313 0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 40 66.727 -9.988 -0.384 1.00 0.00 H new ATOM 0 HD21 LEU A 40 65.640 -8.436 -2.812 1.00 0.00 H new ATOM 0 HD22 LEU A 40 66.054 -10.167 -2.800 1.00 0.00 H new ATOM 0 HD23 LEU A 40 64.430 -9.644 -3.307 1.00 0.00 H new ATOM 663 N SER A 41 62.469 -13.398 -2.491 1.00 0.00 N ATOM 664 CA SER A 41 62.029 -14.821 -2.388 1.00 0.00 C ATOM 665 C SER A 41 62.861 -15.675 -3.349 1.00 0.00 C ATOM 666 O SER A 41 63.406 -16.696 -2.980 1.00 0.00 O ATOM 667 CB SER A 41 60.550 -14.920 -2.771 1.00 0.00 C ATOM 668 OG SER A 41 59.768 -14.220 -1.813 1.00 0.00 O ATOM 0 H SER A 41 62.792 -13.114 -3.416 1.00 0.00 H new ATOM 0 HA SER A 41 62.167 -15.178 -1.367 1.00 0.00 H new ATOM 0 HB2 SER A 41 60.391 -14.500 -3.764 1.00 0.00 H new ATOM 0 HB3 SER A 41 60.243 -15.965 -2.814 1.00 0.00 H new ATOM 0 HG SER A 41 58.821 -14.280 -2.057 1.00 0.00 H new ATOM 674 N HIS A 42 62.961 -15.256 -4.581 1.00 0.00 N ATOM 675 CA HIS A 42 63.754 -16.026 -5.581 1.00 0.00 C ATOM 676 C HIS A 42 65.251 -15.905 -5.269 1.00 0.00 C ATOM 677 O HIS A 42 66.052 -16.697 -5.721 1.00 0.00 O ATOM 678 CB HIS A 42 63.477 -15.472 -6.981 1.00 0.00 C ATOM 679 CG HIS A 42 62.071 -15.822 -7.392 1.00 0.00 C ATOM 680 ND1 HIS A 42 61.730 -17.077 -7.882 1.00 0.00 N ATOM 681 CD2 HIS A 42 60.907 -15.094 -7.388 1.00 0.00 C ATOM 682 CE1 HIS A 42 60.410 -17.063 -8.150 1.00 0.00 C ATOM 683 NE2 HIS A 42 59.865 -15.879 -7.866 1.00 0.00 N ATOM 0 H HIS A 42 62.524 -14.407 -4.940 1.00 0.00 H new ATOM 0 HA HIS A 42 63.466 -17.076 -5.537 1.00 0.00 H new ATOM 0 HB2 HIS A 42 63.610 -14.390 -6.988 1.00 0.00 H new ATOM 0 HB3 HIS A 42 64.189 -15.886 -7.695 1.00 0.00 H new ATOM 0 HD2 HIS A 42 60.815 -14.068 -7.063 1.00 0.00 H new ATOM 0 HE1 HIS A 42 59.861 -17.905 -8.545 1.00 0.00 H new ATOM 0 HE2 HIS A 42 58.888 -15.607 -7.977 1.00 0.00 H new ATOM 692 N PHE A 43 65.637 -14.903 -4.515 1.00 0.00 N ATOM 693 CA PHE A 43 67.090 -14.711 -4.194 1.00 0.00 C ATOM 694 C PHE A 43 67.401 -15.266 -2.803 1.00 0.00 C ATOM 695 O PHE A 43 68.522 -15.195 -2.339 1.00 0.00 O ATOM 696 CB PHE A 43 67.426 -13.218 -4.218 1.00 0.00 C ATOM 697 CG PHE A 43 67.307 -12.693 -5.627 1.00 0.00 C ATOM 698 CD1 PHE A 43 68.411 -12.741 -6.487 1.00 0.00 C ATOM 699 CD2 PHE A 43 66.095 -12.157 -6.074 1.00 0.00 C ATOM 700 CE1 PHE A 43 68.302 -12.252 -7.795 1.00 0.00 C ATOM 701 CE2 PHE A 43 65.985 -11.668 -7.383 1.00 0.00 C ATOM 702 CZ PHE A 43 67.088 -11.716 -8.243 1.00 0.00 C ATOM 0 H PHE A 43 65.010 -14.209 -4.108 1.00 0.00 H new ATOM 0 HA PHE A 43 67.686 -15.241 -4.937 1.00 0.00 H new ATOM 0 HB2 PHE A 43 66.751 -12.673 -3.558 1.00 0.00 H new ATOM 0 HB3 PHE A 43 68.437 -13.057 -3.844 1.00 0.00 H new ATOM 0 HD1 PHE A 43 69.347 -13.155 -6.142 1.00 0.00 H new ATOM 0 HD2 PHE A 43 65.244 -12.120 -5.410 1.00 0.00 H new ATOM 0 HE1 PHE A 43 69.154 -12.288 -8.458 1.00 0.00 H new ATOM 0 HE2 PHE A 43 65.049 -11.254 -7.728 1.00 0.00 H new ATOM 0 HZ PHE A 43 67.003 -11.340 -9.252 1.00 0.00 H new ATOM 712 N LEU A 44 66.422 -15.820 -2.134 1.00 0.00 N ATOM 713 CA LEU A 44 66.657 -16.389 -0.768 1.00 0.00 C ATOM 714 C LEU A 44 66.026 -17.777 -0.681 1.00 0.00 C ATOM 715 O LEU A 44 65.057 -18.075 -1.349 1.00 0.00 O ATOM 716 CB LEU A 44 66.019 -15.476 0.284 1.00 0.00 C ATOM 717 CG LEU A 44 66.651 -14.075 0.221 1.00 0.00 C ATOM 718 CD1 LEU A 44 65.844 -13.110 1.096 1.00 0.00 C ATOM 719 CD2 LEU A 44 68.101 -14.121 0.739 1.00 0.00 C ATOM 0 H LEU A 44 65.464 -15.904 -2.475 1.00 0.00 H new ATOM 0 HA LEU A 44 67.729 -16.462 -0.585 1.00 0.00 H new ATOM 0 HB2 LEU A 44 64.945 -15.407 0.113 1.00 0.00 H new ATOM 0 HB3 LEU A 44 66.157 -15.901 1.278 1.00 0.00 H new ATOM 0 HG LEU A 44 66.647 -13.735 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 44 66.292 -12.117 1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 44 64.817 -13.062 0.733 1.00 0.00 H new ATOM 0 HD13 LEU A 44 65.848 -13.464 2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 44 68.537 -13.123 0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 44 68.107 -14.469 1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 44 68.686 -14.804 0.123 1.00 0.00 H new ATOM 731 N GLU A 45 66.574 -18.628 0.142 1.00 0.00 N ATOM 732 CA GLU A 45 66.009 -19.996 0.283 1.00 0.00 C ATOM 733 C GLU A 45 64.749 -19.922 1.145 1.00 0.00 C ATOM 734 O GLU A 45 64.668 -19.135 2.068 1.00 0.00 O ATOM 735 CB GLU A 45 67.039 -20.907 0.957 1.00 0.00 C ATOM 736 CG GLU A 45 68.223 -21.133 0.013 1.00 0.00 C ATOM 737 CD GLU A 45 67.771 -21.967 -1.187 1.00 0.00 C ATOM 738 OE1 GLU A 45 66.742 -22.614 -1.078 1.00 0.00 O ATOM 739 OE2 GLU A 45 68.458 -21.942 -2.194 1.00 0.00 O ATOM 0 H GLU A 45 67.390 -18.433 0.723 1.00 0.00 H new ATOM 0 HA GLU A 45 65.762 -20.400 -0.699 1.00 0.00 H new ATOM 0 HB2 GLU A 45 67.384 -20.456 1.887 1.00 0.00 H new ATOM 0 HB3 GLU A 45 66.581 -21.861 1.216 1.00 0.00 H new ATOM 0 HG2 GLU A 45 68.619 -20.176 -0.325 1.00 0.00 H new ATOM 0 HG3 GLU A 45 69.029 -21.643 0.540 1.00 0.00 H new ATOM 746 N GLU A 46 63.762 -20.725 0.859 1.00 0.00 N ATOM 747 CA GLU A 46 62.521 -20.674 1.678 1.00 0.00 C ATOM 748 C GLU A 46 62.850 -21.088 3.114 1.00 0.00 C ATOM 749 O GLU A 46 63.623 -21.995 3.350 1.00 0.00 O ATOM 750 CB GLU A 46 61.470 -21.619 1.082 1.00 0.00 C ATOM 751 CG GLU A 46 62.024 -23.044 1.025 1.00 0.00 C ATOM 752 CD GLU A 46 60.974 -23.974 0.414 1.00 0.00 C ATOM 753 OE1 GLU A 46 59.814 -23.598 0.399 1.00 0.00 O ATOM 754 OE2 GLU A 46 61.349 -25.047 -0.031 1.00 0.00 O ATOM 0 H GLU A 46 63.761 -21.408 0.101 1.00 0.00 H new ATOM 0 HA GLU A 46 62.120 -19.660 1.679 1.00 0.00 H new ATOM 0 HB2 GLU A 46 60.563 -21.596 1.686 1.00 0.00 H new ATOM 0 HB3 GLU A 46 61.195 -21.286 0.081 1.00 0.00 H new ATOM 0 HG2 GLU A 46 62.937 -23.067 0.430 1.00 0.00 H new ATOM 0 HG3 GLU A 46 62.288 -23.384 2.027 1.00 0.00 H new ATOM 761 N ILE A 47 62.275 -20.413 4.074 1.00 0.00 N ATOM 762 CA ILE A 47 62.549 -20.737 5.507 1.00 0.00 C ATOM 763 C ILE A 47 61.431 -21.628 6.054 1.00 0.00 C ATOM 764 O ILE A 47 60.273 -21.262 6.038 1.00 0.00 O ATOM 765 CB ILE A 47 62.607 -19.426 6.294 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.777 -18.583 5.773 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.809 -19.720 7.783 1.00 0.00 C ATOM 768 CD1 ILE A 47 63.712 -17.165 6.354 1.00 0.00 C ATOM 0 H ILE A 47 61.621 -19.644 3.926 1.00 0.00 H new ATOM 0 HA ILE A 47 63.496 -21.268 5.601 1.00 0.00 H new ATOM 0 HB ILE A 47 61.672 -18.881 6.165 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.722 -19.052 6.046 1.00 0.00 H new ATOM 0 HG13 ILE A 47 63.746 -18.539 4.684 1.00 0.00 H new ATOM 0 HG21 ILE A 47 62.849 -18.782 8.337 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.979 -20.323 8.151 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.743 -20.264 7.923 1.00 0.00 H new ATOM 0 HD11 ILE A 47 64.549 -16.578 5.975 1.00 0.00 H new ATOM 0 HD12 ILE A 47 62.775 -16.693 6.059 1.00 0.00 H new ATOM 0 HD13 ILE A 47 63.766 -17.215 7.442 1.00 0.00 H new ATOM 780 N LYS A 48 61.769 -22.807 6.526 1.00 0.00 N ATOM 781 CA LYS A 48 60.725 -23.737 7.065 1.00 0.00 C ATOM 782 C LYS A 48 60.753 -23.731 8.599 1.00 0.00 C ATOM 783 O LYS A 48 59.748 -23.969 9.237 1.00 0.00 O ATOM 784 CB LYS A 48 61.009 -25.157 6.557 1.00 0.00 C ATOM 785 CG LYS A 48 59.825 -26.072 6.887 1.00 0.00 C ATOM 786 CD LYS A 48 60.116 -27.487 6.376 1.00 0.00 C ATOM 787 CE LYS A 48 58.998 -28.434 6.819 1.00 0.00 C ATOM 788 NZ LYS A 48 58.888 -28.409 8.304 1.00 0.00 N ATOM 0 H LYS A 48 62.724 -23.164 6.561 1.00 0.00 H new ATOM 0 HA LYS A 48 59.742 -23.409 6.727 1.00 0.00 H new ATOM 0 HB2 LYS A 48 61.179 -25.141 5.480 1.00 0.00 H new ATOM 0 HB3 LYS A 48 61.918 -25.543 7.018 1.00 0.00 H new ATOM 0 HG2 LYS A 48 59.655 -26.090 7.963 1.00 0.00 H new ATOM 0 HG3 LYS A 48 58.915 -25.687 6.427 1.00 0.00 H new ATOM 0 HD2 LYS A 48 60.193 -27.483 5.289 1.00 0.00 H new ATOM 0 HD3 LYS A 48 61.074 -27.834 6.762 1.00 0.00 H new ATOM 0 HE2 LYS A 48 58.052 -28.134 6.368 1.00 0.00 H new ATOM 0 HE3 LYS A 48 59.207 -29.447 6.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 58.455 -29.295 8.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 59.836 -28.310 8.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 58.296 -27.605 8.595 1.00 0.00 H new ATOM 802 N GLU A 49 61.896 -23.462 9.198 1.00 0.00 N ATOM 803 CA GLU A 49 61.988 -23.446 10.701 1.00 0.00 C ATOM 804 C GLU A 49 62.466 -22.073 11.193 1.00 0.00 C ATOM 805 O GLU A 49 63.414 -21.509 10.683 1.00 0.00 O ATOM 806 CB GLU A 49 62.974 -24.524 11.164 1.00 0.00 C ATOM 807 CG GLU A 49 62.972 -24.590 12.694 1.00 0.00 C ATOM 808 CD GLU A 49 63.921 -25.692 13.168 1.00 0.00 C ATOM 809 OE1 GLU A 49 64.459 -26.390 12.324 1.00 0.00 O ATOM 810 OE2 GLU A 49 64.092 -25.820 14.369 1.00 0.00 O ATOM 0 H GLU A 49 62.768 -23.253 8.712 1.00 0.00 H new ATOM 0 HA GLU A 49 61.000 -23.646 11.116 1.00 0.00 H new ATOM 0 HB2 GLU A 49 62.695 -25.491 10.747 1.00 0.00 H new ATOM 0 HB3 GLU A 49 63.976 -24.297 10.800 1.00 0.00 H new ATOM 0 HG2 GLU A 49 63.279 -23.630 13.109 1.00 0.00 H new ATOM 0 HG3 GLU A 49 61.963 -24.786 13.057 1.00 0.00 H new ATOM 817 N GLN A 50 61.816 -21.541 12.198 1.00 0.00 N ATOM 818 CA GLN A 50 62.217 -20.213 12.760 1.00 0.00 C ATOM 819 C GLN A 50 63.656 -20.283 13.287 1.00 0.00 C ATOM 820 O GLN A 50 64.428 -19.355 13.151 1.00 0.00 O ATOM 821 CB GLN A 50 61.273 -19.835 13.906 1.00 0.00 C ATOM 822 CG GLN A 50 59.906 -19.436 13.343 1.00 0.00 C ATOM 823 CD GLN A 50 59.201 -20.672 12.781 1.00 0.00 C ATOM 824 OE1 GLN A 50 58.785 -21.539 13.525 1.00 0.00 O ATOM 825 NE2 GLN A 50 59.048 -20.788 11.491 1.00 0.00 N ATOM 0 H GLN A 50 61.016 -21.975 12.658 1.00 0.00 H new ATOM 0 HA GLN A 50 62.158 -19.460 11.974 1.00 0.00 H new ATOM 0 HB2 GLN A 50 61.163 -20.676 14.591 1.00 0.00 H new ATOM 0 HB3 GLN A 50 61.695 -19.010 14.480 1.00 0.00 H new ATOM 0 HG2 GLN A 50 59.298 -18.982 14.125 1.00 0.00 H new ATOM 0 HG3 GLN A 50 60.028 -18.687 12.560 1.00 0.00 H new ATOM 0 HE21 GLN A 50 59.398 -20.060 10.868 1.00 0.00 H new ATOM 0 HE22 GLN A 50 58.579 -21.607 11.105 1.00 0.00 H new ATOM 834 N GLU A 51 64.008 -21.377 13.903 1.00 0.00 N ATOM 835 CA GLU A 51 65.390 -21.519 14.463 1.00 0.00 C ATOM 836 C GLU A 51 66.407 -21.046 13.415 1.00 0.00 C ATOM 837 O GLU A 51 67.444 -20.502 13.742 1.00 0.00 O ATOM 838 CB GLU A 51 65.659 -22.988 14.805 1.00 0.00 C ATOM 839 CG GLU A 51 67.047 -23.126 15.442 1.00 0.00 C ATOM 840 CD GLU A 51 67.312 -24.596 15.773 1.00 0.00 C ATOM 841 OE1 GLU A 51 66.387 -25.384 15.666 1.00 0.00 O ATOM 842 OE2 GLU A 51 68.440 -24.911 16.118 1.00 0.00 O ATOM 0 H GLU A 51 63.400 -22.183 14.045 1.00 0.00 H new ATOM 0 HA GLU A 51 65.482 -20.916 15.367 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.896 -23.357 15.490 1.00 0.00 H new ATOM 0 HB3 GLU A 51 65.600 -23.598 13.903 1.00 0.00 H new ATOM 0 HG2 GLU A 51 67.811 -22.752 14.760 1.00 0.00 H new ATOM 0 HG3 GLU A 51 67.105 -22.522 16.347 1.00 0.00 H new ATOM 849 N VAL A 52 66.105 -21.232 12.161 1.00 0.00 N ATOM 850 CA VAL A 52 67.035 -20.776 11.087 1.00 0.00 C ATOM 851 C VAL A 52 67.085 -19.244 11.095 1.00 0.00 C ATOM 852 O VAL A 52 68.100 -18.640 10.808 1.00 0.00 O ATOM 853 CB VAL A 52 66.533 -21.265 9.724 1.00 0.00 C ATOM 854 CG1 VAL A 52 67.356 -20.614 8.605 1.00 0.00 C ATOM 855 CG2 VAL A 52 66.676 -22.786 9.643 1.00 0.00 C ATOM 0 H VAL A 52 65.251 -21.682 11.831 1.00 0.00 H new ATOM 0 HA VAL A 52 68.031 -21.182 11.265 1.00 0.00 H new ATOM 0 HB VAL A 52 65.485 -20.990 9.607 1.00 0.00 H new ATOM 0 HG11 VAL A 52 66.996 -20.964 7.638 1.00 0.00 H new ATOM 0 HG12 VAL A 52 67.252 -19.530 8.660 1.00 0.00 H new ATOM 0 HG13 VAL A 52 68.406 -20.884 8.721 1.00 0.00 H new ATOM 0 HG21 VAL A 52 66.319 -23.134 8.674 1.00 0.00 H new ATOM 0 HG22 VAL A 52 67.724 -23.060 9.763 1.00 0.00 H new ATOM 0 HG23 VAL A 52 66.087 -23.249 10.434 1.00 0.00 H new ATOM 865 N VAL A 53 65.992 -18.619 11.433 1.00 0.00 N ATOM 866 CA VAL A 53 65.963 -17.129 11.475 1.00 0.00 C ATOM 867 C VAL A 53 66.842 -16.641 12.626 1.00 0.00 C ATOM 868 O VAL A 53 67.555 -15.664 12.509 1.00 0.00 O ATOM 869 CB VAL A 53 64.526 -16.657 11.709 1.00 0.00 C ATOM 870 CG1 VAL A 53 64.485 -15.128 11.800 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.642 -17.123 10.552 1.00 0.00 C ATOM 0 H VAL A 53 65.115 -19.076 11.683 1.00 0.00 H new ATOM 0 HA VAL A 53 66.333 -16.729 10.531 1.00 0.00 H new ATOM 0 HB VAL A 53 64.159 -17.080 12.644 1.00 0.00 H new ATOM 0 HG11 VAL A 53 63.459 -14.801 11.967 1.00 0.00 H new ATOM 0 HG12 VAL A 53 65.111 -14.796 12.628 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.856 -14.698 10.870 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.618 -16.787 10.718 1.00 0.00 H new ATOM 0 HG22 VAL A 53 64.015 -16.703 9.618 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.662 -18.211 10.494 1.00 0.00 H new ATOM 881 N ASP A 54 66.776 -17.305 13.743 1.00 0.00 N ATOM 882 CA ASP A 54 67.586 -16.873 14.914 1.00 0.00 C ATOM 883 C ASP A 54 69.072 -16.912 14.556 1.00 0.00 C ATOM 884 O ASP A 54 69.829 -16.031 14.915 1.00 0.00 O ATOM 885 CB ASP A 54 67.310 -17.820 16.084 1.00 0.00 C ATOM 886 CG ASP A 54 65.887 -17.586 16.594 1.00 0.00 C ATOM 887 OD1 ASP A 54 65.343 -16.532 16.312 1.00 0.00 O ATOM 888 OD2 ASP A 54 65.363 -18.470 17.253 1.00 0.00 O ATOM 0 H ASP A 54 66.196 -18.130 13.897 1.00 0.00 H new ATOM 0 HA ASP A 54 67.317 -15.854 15.194 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.430 -18.856 15.766 1.00 0.00 H new ATOM 0 HB3 ASP A 54 68.029 -17.648 16.885 1.00 0.00 H new ATOM 893 N LYS A 55 69.493 -17.914 13.839 1.00 0.00 N ATOM 894 CA LYS A 55 70.929 -17.987 13.449 1.00 0.00 C ATOM 895 C LYS A 55 71.267 -16.772 12.586 1.00 0.00 C ATOM 896 O LYS A 55 72.310 -16.164 12.723 1.00 0.00 O ATOM 897 CB LYS A 55 71.180 -19.270 12.649 1.00 0.00 C ATOM 898 CG LYS A 55 72.683 -19.410 12.362 1.00 0.00 C ATOM 899 CD LYS A 55 72.956 -20.680 11.539 1.00 0.00 C ATOM 900 CE LYS A 55 73.006 -21.913 12.451 1.00 0.00 C ATOM 901 NZ LYS A 55 74.051 -21.723 13.497 1.00 0.00 N ATOM 0 H LYS A 55 68.910 -18.682 13.507 1.00 0.00 H new ATOM 0 HA LYS A 55 71.555 -17.995 14.341 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.824 -20.135 13.208 1.00 0.00 H new ATOM 0 HB3 LYS A 55 70.621 -19.243 11.713 1.00 0.00 H new ATOM 0 HG2 LYS A 55 73.039 -18.534 11.820 1.00 0.00 H new ATOM 0 HG3 LYS A 55 73.237 -19.451 13.300 1.00 0.00 H new ATOM 0 HD2 LYS A 55 72.177 -20.808 10.788 1.00 0.00 H new ATOM 0 HD3 LYS A 55 73.900 -20.578 11.004 1.00 0.00 H new ATOM 0 HE2 LYS A 55 72.034 -22.071 12.919 1.00 0.00 H new ATOM 0 HE3 LYS A 55 73.225 -22.804 11.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 74.420 -22.650 13.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 74.827 -21.148 13.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.636 -21.238 14.318 1.00 0.00 H new ATOM 915 N VAL A 56 70.390 -16.427 11.685 1.00 0.00 N ATOM 916 CA VAL A 56 70.643 -15.264 10.787 1.00 0.00 C ATOM 917 C VAL A 56 70.598 -13.956 11.585 1.00 0.00 C ATOM 918 O VAL A 56 71.400 -13.066 11.380 1.00 0.00 O ATOM 919 CB VAL A 56 69.564 -15.245 9.698 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.642 -13.939 8.900 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.774 -16.432 8.756 1.00 0.00 C ATOM 0 H VAL A 56 69.502 -16.904 11.531 1.00 0.00 H new ATOM 0 HA VAL A 56 71.631 -15.358 10.336 1.00 0.00 H new ATOM 0 HB VAL A 56 68.583 -15.315 10.167 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.871 -13.937 8.129 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.488 -13.093 9.570 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.623 -13.857 8.432 1.00 0.00 H new ATOM 0 HG21 VAL A 56 69.008 -16.421 7.981 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.759 -16.360 8.294 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.705 -17.362 9.321 1.00 0.00 H new ATOM 931 N MET A 57 69.661 -13.827 12.481 1.00 0.00 N ATOM 932 CA MET A 57 69.558 -12.569 13.278 1.00 0.00 C ATOM 933 C MET A 57 70.817 -12.376 14.120 1.00 0.00 C ATOM 934 O MET A 57 71.343 -11.286 14.230 1.00 0.00 O ATOM 935 CB MET A 57 68.341 -12.659 14.199 1.00 0.00 C ATOM 936 CG MET A 57 67.066 -12.618 13.358 1.00 0.00 C ATOM 937 SD MET A 57 66.854 -10.959 12.659 1.00 0.00 S ATOM 938 CE MET A 57 66.333 -10.103 14.168 1.00 0.00 C ATOM 0 H MET A 57 68.961 -14.537 12.698 1.00 0.00 H new ATOM 0 HA MET A 57 69.451 -11.722 12.600 1.00 0.00 H new ATOM 0 HB2 MET A 57 68.378 -13.581 14.780 1.00 0.00 H new ATOM 0 HB3 MET A 57 68.347 -11.833 14.911 1.00 0.00 H new ATOM 0 HG2 MET A 57 67.122 -13.357 12.558 1.00 0.00 H new ATOM 0 HG3 MET A 57 66.204 -12.878 13.973 1.00 0.00 H new ATOM 0 HE1 MET A 57 65.398 -9.575 13.982 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.187 -10.830 14.967 1.00 0.00 H new ATOM 0 HE3 MET A 57 67.101 -9.388 14.464 1.00 0.00 H new ATOM 948 N GLU A 58 71.309 -13.424 14.712 1.00 0.00 N ATOM 949 CA GLU A 58 72.536 -13.294 15.543 1.00 0.00 C ATOM 950 C GLU A 58 73.676 -12.784 14.664 1.00 0.00 C ATOM 951 O GLU A 58 74.428 -11.906 15.042 1.00 0.00 O ATOM 952 CB GLU A 58 72.904 -14.663 16.122 1.00 0.00 C ATOM 953 CG GLU A 58 74.027 -14.504 17.150 1.00 0.00 C ATOM 954 CD GLU A 58 73.490 -13.780 18.386 1.00 0.00 C ATOM 955 OE1 GLU A 58 72.281 -13.731 18.541 1.00 0.00 O ATOM 956 OE2 GLU A 58 74.297 -13.279 19.153 1.00 0.00 O ATOM 0 H GLU A 58 70.917 -14.364 14.657 1.00 0.00 H new ATOM 0 HA GLU A 58 72.361 -12.594 16.360 1.00 0.00 H new ATOM 0 HB2 GLU A 58 72.031 -15.117 16.590 1.00 0.00 H new ATOM 0 HB3 GLU A 58 73.222 -15.333 15.323 1.00 0.00 H new ATOM 0 HG2 GLU A 58 74.419 -15.482 17.430 1.00 0.00 H new ATOM 0 HG3 GLU A 58 74.854 -13.941 16.717 1.00 0.00 H new ATOM 963 N THR A 59 73.803 -13.328 13.488 1.00 0.00 N ATOM 964 CA THR A 59 74.883 -12.885 12.563 1.00 0.00 C ATOM 965 C THR A 59 74.602 -11.474 12.046 1.00 0.00 C ATOM 966 O THR A 59 75.498 -10.665 11.901 1.00 0.00 O ATOM 967 CB THR A 59 74.955 -13.847 11.375 1.00 0.00 C ATOM 968 OG1 THR A 59 75.238 -15.158 11.842 1.00 0.00 O ATOM 969 CG2 THR A 59 76.049 -13.394 10.406 1.00 0.00 C ATOM 0 H THR A 59 73.201 -14.066 13.124 1.00 0.00 H new ATOM 0 HA THR A 59 75.829 -12.882 13.105 1.00 0.00 H new ATOM 0 HB THR A 59 73.998 -13.849 10.854 1.00 0.00 H new ATOM 0 HG1 THR A 59 74.409 -15.582 12.148 1.00 0.00 H new ATOM 0 HG21 THR A 59 76.096 -14.083 9.562 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.822 -12.391 10.044 1.00 0.00 H new ATOM 0 HG23 THR A 59 77.010 -13.385 10.921 1.00 0.00 H new ATOM 977 N LEU A 60 73.370 -11.176 11.740 1.00 0.00 N ATOM 978 CA LEU A 60 73.039 -9.825 11.201 1.00 0.00 C ATOM 979 C LEU A 60 73.167 -8.740 12.274 1.00 0.00 C ATOM 980 O LEU A 60 73.681 -7.670 12.020 1.00 0.00 O ATOM 981 CB LEU A 60 71.607 -9.842 10.651 1.00 0.00 C ATOM 982 CG LEU A 60 71.194 -8.445 10.161 1.00 0.00 C ATOM 983 CD1 LEU A 60 72.211 -7.912 9.144 1.00 0.00 C ATOM 984 CD2 LEU A 60 69.820 -8.545 9.493 1.00 0.00 C ATOM 0 H LEU A 60 72.577 -11.809 11.840 1.00 0.00 H new ATOM 0 HA LEU A 60 73.748 -9.590 10.407 1.00 0.00 H new ATOM 0 HB2 LEU A 60 71.536 -10.556 9.830 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.919 -10.179 11.426 1.00 0.00 H new ATOM 0 HG LEU A 60 71.157 -7.763 11.010 1.00 0.00 H new ATOM 0 HD11 LEU A 60 71.904 -6.922 8.807 1.00 0.00 H new ATOM 0 HD12 LEU A 60 73.194 -7.848 9.612 1.00 0.00 H new ATOM 0 HD13 LEU A 60 72.259 -8.587 8.290 1.00 0.00 H new ATOM 0 HD21 LEU A 60 69.514 -7.560 9.140 1.00 0.00 H new ATOM 0 HD22 LEU A 60 69.875 -9.232 8.648 1.00 0.00 H new ATOM 0 HD23 LEU A 60 69.091 -8.914 10.214 1.00 0.00 H new ATOM 996 N ASP A 61 72.688 -8.988 13.460 1.00 0.00 N ATOM 997 CA ASP A 61 72.767 -7.940 14.520 1.00 0.00 C ATOM 998 C ASP A 61 74.217 -7.695 14.923 1.00 0.00 C ATOM 999 O ASP A 61 74.816 -8.467 15.644 1.00 0.00 O ATOM 1000 CB ASP A 61 71.971 -8.381 15.751 1.00 0.00 C ATOM 1001 CG ASP A 61 70.474 -8.332 15.441 1.00 0.00 C ATOM 1002 OD1 ASP A 61 70.098 -7.598 14.542 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.728 -9.027 16.111 1.00 0.00 O ATOM 0 H ASP A 61 72.248 -9.864 13.742 1.00 0.00 H new ATOM 0 HA ASP A 61 72.346 -7.017 14.121 1.00 0.00 H new ATOM 0 HB2 ASP A 61 72.260 -9.392 16.040 1.00 0.00 H new ATOM 0 HB3 ASP A 61 72.199 -7.731 16.596 1.00 0.00 H new ATOM 1008 N GLU A 62 74.782 -6.610 14.471 1.00 0.00 N ATOM 1009 CA GLU A 62 76.186 -6.296 14.838 1.00 0.00 C ATOM 1010 C GLU A 62 76.262 -6.080 16.349 1.00 0.00 C ATOM 1011 O GLU A 62 77.202 -6.489 17.001 1.00 0.00 O ATOM 1012 CB GLU A 62 76.624 -5.019 14.115 1.00 0.00 C ATOM 1013 CG GLU A 62 78.076 -4.687 14.470 1.00 0.00 C ATOM 1014 CD GLU A 62 78.497 -3.409 13.741 1.00 0.00 C ATOM 1015 OE1 GLU A 62 77.692 -2.887 12.989 1.00 0.00 O ATOM 1016 OE2 GLU A 62 79.620 -2.977 13.947 1.00 0.00 O ATOM 0 H GLU A 62 74.329 -5.928 13.863 1.00 0.00 H new ATOM 0 HA GLU A 62 76.842 -7.117 14.548 1.00 0.00 H new ATOM 0 HB2 GLU A 62 76.525 -5.150 13.037 1.00 0.00 H new ATOM 0 HB3 GLU A 62 75.974 -4.191 14.397 1.00 0.00 H new ATOM 0 HG2 GLU A 62 78.178 -4.555 15.547 1.00 0.00 H new ATOM 0 HG3 GLU A 62 78.729 -5.512 14.187 1.00 0.00 H new ATOM 1023 N ASP A 63 75.279 -5.422 16.907 1.00 0.00 N ATOM 1024 CA ASP A 63 75.284 -5.154 18.373 1.00 0.00 C ATOM 1025 C ASP A 63 74.605 -6.306 19.123 1.00 0.00 C ATOM 1026 O ASP A 63 74.709 -6.415 20.328 1.00 0.00 O ATOM 1027 CB ASP A 63 74.525 -3.853 18.640 1.00 0.00 C ATOM 1028 CG ASP A 63 73.084 -3.994 18.146 1.00 0.00 C ATOM 1029 OD1 ASP A 63 72.806 -4.969 17.466 1.00 0.00 O ATOM 1030 OD2 ASP A 63 72.284 -3.128 18.456 1.00 0.00 O ATOM 0 H ASP A 63 74.469 -5.057 16.406 1.00 0.00 H new ATOM 0 HA ASP A 63 76.313 -5.066 18.722 1.00 0.00 H new ATOM 0 HB2 ASP A 63 74.535 -3.626 19.706 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.015 -3.022 18.132 1.00 0.00 H new ATOM 1035 N GLY A 64 73.918 -7.171 18.424 1.00 0.00 N ATOM 1036 CA GLY A 64 73.245 -8.317 19.109 1.00 0.00 C ATOM 1037 C GLY A 64 72.004 -7.836 19.874 1.00 0.00 C ATOM 1038 O GLY A 64 71.661 -8.374 20.908 1.00 0.00 O ATOM 0 H GLY A 64 73.793 -7.135 17.412 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.957 -9.069 18.374 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.941 -8.795 19.798 1.00 0.00 H new ATOM 1042 N ASP A 65 71.337 -6.822 19.390 1.00 0.00 N ATOM 1043 CA ASP A 65 70.132 -6.302 20.107 1.00 0.00 C ATOM 1044 C ASP A 65 68.900 -7.173 19.817 1.00 0.00 C ATOM 1045 O ASP A 65 67.842 -6.959 20.374 1.00 0.00 O ATOM 1046 CB ASP A 65 69.852 -4.872 19.647 1.00 0.00 C ATOM 1047 CG ASP A 65 69.506 -4.880 18.157 1.00 0.00 C ATOM 1048 OD1 ASP A 65 69.851 -5.846 17.498 1.00 0.00 O ATOM 1049 OD2 ASP A 65 68.904 -3.922 17.703 1.00 0.00 O ATOM 0 H ASP A 65 71.573 -6.330 18.528 1.00 0.00 H new ATOM 0 HA ASP A 65 70.330 -6.325 21.179 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.028 -4.448 20.221 1.00 0.00 H new ATOM 0 HB3 ASP A 65 70.724 -4.243 19.827 1.00 0.00 H new ATOM 1054 N GLY A 66 69.025 -8.167 18.981 1.00 0.00 N ATOM 1055 CA GLY A 66 67.854 -9.056 18.699 1.00 0.00 C ATOM 1056 C GLY A 66 66.859 -8.383 17.746 1.00 0.00 C ATOM 1057 O GLY A 66 65.800 -8.915 17.475 1.00 0.00 O ATOM 0 H GLY A 66 69.882 -8.404 18.481 1.00 0.00 H new ATOM 0 HA2 GLY A 66 68.202 -9.992 18.262 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.352 -9.307 19.634 1.00 0.00 H new ATOM 1061 N GLU A 67 67.182 -7.229 17.228 1.00 0.00 N ATOM 1062 CA GLU A 67 66.258 -6.524 16.287 1.00 0.00 C ATOM 1063 C GLU A 67 67.101 -5.908 15.171 1.00 0.00 C ATOM 1064 O GLU A 67 68.293 -5.738 15.328 1.00 0.00 O ATOM 1065 CB GLU A 67 65.511 -5.415 17.033 1.00 0.00 C ATOM 1066 CG GLU A 67 64.533 -6.037 18.034 1.00 0.00 C ATOM 1067 CD GLU A 67 63.791 -4.924 18.776 1.00 0.00 C ATOM 1068 OE1 GLU A 67 64.184 -3.778 18.631 1.00 0.00 O ATOM 1069 OE2 GLU A 67 62.846 -5.237 19.478 1.00 0.00 O ATOM 0 H GLU A 67 68.056 -6.738 17.417 1.00 0.00 H new ATOM 0 HA GLU A 67 65.531 -7.224 15.875 1.00 0.00 H new ATOM 0 HB2 GLU A 67 66.220 -4.772 17.554 1.00 0.00 H new ATOM 0 HB3 GLU A 67 64.971 -4.786 16.325 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.822 -6.679 17.514 1.00 0.00 H new ATOM 0 HG3 GLU A 67 65.072 -6.666 18.743 1.00 0.00 H new ATOM 1076 N CYS A 68 66.515 -5.568 14.044 1.00 0.00 N ATOM 1077 CA CYS A 68 67.316 -4.961 12.931 1.00 0.00 C ATOM 1078 C CYS A 68 66.967 -3.476 12.808 1.00 0.00 C ATOM 1079 O CYS A 68 65.883 -3.113 12.392 1.00 0.00 O ATOM 1080 CB CYS A 68 66.970 -5.670 11.620 1.00 0.00 C ATOM 1081 SG CYS A 68 67.345 -7.433 11.772 1.00 0.00 S ATOM 0 H CYS A 68 65.521 -5.684 13.848 1.00 0.00 H new ATOM 0 HA CYS A 68 68.380 -5.071 13.141 1.00 0.00 H new ATOM 0 HB2 CYS A 68 65.915 -5.530 11.386 1.00 0.00 H new ATOM 0 HB3 CYS A 68 67.539 -5.236 10.798 1.00 0.00 H new ATOM 0 HG CYS A 68 67.049 -8.037 10.659 1.00 0.00 H new ATOM 1087 N ASP A 69 67.870 -2.619 13.198 1.00 0.00 N ATOM 1088 CA ASP A 69 67.596 -1.156 13.138 1.00 0.00 C ATOM 1089 C ASP A 69 67.685 -0.644 11.696 1.00 0.00 C ATOM 1090 O ASP A 69 67.928 -1.384 10.764 1.00 0.00 O ATOM 1091 CB ASP A 69 68.594 -0.405 14.026 1.00 0.00 C ATOM 1092 CG ASP A 69 69.994 -0.488 13.419 1.00 0.00 C ATOM 1093 OD1 ASP A 69 70.154 -1.196 12.442 1.00 0.00 O ATOM 1094 OD2 ASP A 69 70.883 0.167 13.940 1.00 0.00 O ATOM 0 H ASP A 69 68.791 -2.871 13.558 1.00 0.00 H new ATOM 0 HA ASP A 69 66.584 -0.977 13.502 1.00 0.00 H new ATOM 0 HB2 ASP A 69 68.293 0.638 14.126 1.00 0.00 H new ATOM 0 HB3 ASP A 69 68.597 -0.833 15.028 1.00 0.00 H new ATOM 1099 N PHE A 70 67.492 0.633 11.530 1.00 0.00 N ATOM 1100 CA PHE A 70 67.561 1.243 10.171 1.00 0.00 C ATOM 1101 C PHE A 70 68.954 1.033 9.568 1.00 0.00 C ATOM 1102 O PHE A 70 69.097 0.636 8.429 1.00 0.00 O ATOM 1103 CB PHE A 70 67.263 2.741 10.253 1.00 0.00 C ATOM 1104 CG PHE A 70 67.246 3.318 8.857 1.00 0.00 C ATOM 1105 CD1 PHE A 70 66.051 3.338 8.130 1.00 0.00 C ATOM 1106 CD2 PHE A 70 68.422 3.819 8.286 1.00 0.00 C ATOM 1107 CE1 PHE A 70 66.028 3.862 6.835 1.00 0.00 C ATOM 1108 CE2 PHE A 70 68.400 4.342 6.987 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.202 4.363 6.263 1.00 0.00 C ATOM 0 H PHE A 70 67.287 1.288 12.284 1.00 0.00 H new ATOM 0 HA PHE A 70 66.818 0.761 9.535 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.302 2.907 10.740 1.00 0.00 H new ATOM 0 HB3 PHE A 70 68.018 3.242 10.858 1.00 0.00 H new ATOM 0 HD1 PHE A 70 65.145 2.948 8.570 1.00 0.00 H new ATOM 0 HD2 PHE A 70 69.345 3.802 8.847 1.00 0.00 H new ATOM 0 HE1 PHE A 70 65.104 3.880 6.276 1.00 0.00 H new ATOM 0 HE2 PHE A 70 69.306 4.729 6.544 1.00 0.00 H new ATOM 0 HZ PHE A 70 67.184 4.767 5.261 1.00 0.00 H new ATOM 1119 N GLN A 71 69.982 1.333 10.310 1.00 0.00 N ATOM 1120 CA GLN A 71 71.360 1.186 9.760 1.00 0.00 C ATOM 1121 C GLN A 71 71.612 -0.272 9.361 1.00 0.00 C ATOM 1122 O GLN A 71 71.948 -0.557 8.229 1.00 0.00 O ATOM 1123 CB GLN A 71 72.376 1.635 10.816 1.00 0.00 C ATOM 1124 CG GLN A 71 73.797 1.566 10.238 1.00 0.00 C ATOM 1125 CD GLN A 71 74.312 0.126 10.288 1.00 0.00 C ATOM 1126 OE1 GLN A 71 74.142 -0.558 11.276 1.00 0.00 O ATOM 1127 NE2 GLN A 71 74.938 -0.366 9.254 1.00 0.00 N ATOM 0 H GLN A 71 69.930 1.673 11.270 1.00 0.00 H new ATOM 0 HA GLN A 71 71.468 1.809 8.872 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.154 2.653 11.137 1.00 0.00 H new ATOM 0 HB3 GLN A 71 72.302 0.999 11.698 1.00 0.00 H new ATOM 0 HG2 GLN A 71 73.798 1.926 9.209 1.00 0.00 H new ATOM 0 HG3 GLN A 71 74.461 2.219 10.805 1.00 0.00 H new ATOM 0 HE21 GLN A 71 75.081 0.209 8.423 1.00 0.00 H new ATOM 0 HE22 GLN A 71 75.284 -1.325 9.276 1.00 0.00 H new ATOM 1136 N GLU A 72 71.462 -1.202 10.265 1.00 0.00 N ATOM 1137 CA GLU A 72 71.708 -2.631 9.892 1.00 0.00 C ATOM 1138 C GLU A 72 70.742 -3.007 8.770 1.00 0.00 C ATOM 1139 O GLU A 72 71.100 -3.661 7.810 1.00 0.00 O ATOM 1140 CB GLU A 72 71.456 -3.533 11.101 1.00 0.00 C ATOM 1141 CG GLU A 72 72.543 -3.294 12.149 1.00 0.00 C ATOM 1142 CD GLU A 72 72.293 -4.196 13.358 1.00 0.00 C ATOM 1143 OE1 GLU A 72 71.259 -4.846 13.384 1.00 0.00 O ATOM 1144 OE2 GLU A 72 73.136 -4.219 14.240 1.00 0.00 O ATOM 0 H GLU A 72 71.184 -1.041 11.233 1.00 0.00 H new ATOM 0 HA GLU A 72 72.740 -2.758 9.564 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.474 -3.324 11.526 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.455 -4.579 10.794 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.525 -3.502 11.724 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.543 -2.248 12.456 1.00 0.00 H new ATOM 1151 N PHE A 73 69.511 -2.603 8.910 1.00 0.00 N ATOM 1152 CA PHE A 73 68.492 -2.936 7.874 1.00 0.00 C ATOM 1153 C PHE A 73 69.091 -2.657 6.492 1.00 0.00 C ATOM 1154 O PHE A 73 68.921 -3.422 5.565 1.00 0.00 O ATOM 1155 CB PHE A 73 67.230 -2.089 8.078 1.00 0.00 C ATOM 1156 CG PHE A 73 66.323 -2.243 6.878 1.00 0.00 C ATOM 1157 CD1 PHE A 73 65.392 -3.284 6.826 1.00 0.00 C ATOM 1158 CD2 PHE A 73 66.430 -1.345 5.810 1.00 0.00 C ATOM 1159 CE1 PHE A 73 64.563 -3.426 5.705 1.00 0.00 C ATOM 1160 CE2 PHE A 73 65.603 -1.486 4.689 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.669 -2.527 4.638 1.00 0.00 C ATOM 0 H PHE A 73 69.165 -2.056 9.698 1.00 0.00 H new ATOM 0 HA PHE A 73 68.216 -3.987 7.955 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.710 -2.403 8.983 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.499 -1.041 8.212 1.00 0.00 H new ATOM 0 HD1 PHE A 73 65.311 -3.979 7.649 1.00 0.00 H new ATOM 0 HD2 PHE A 73 67.151 -0.542 5.851 1.00 0.00 H new ATOM 0 HE1 PHE A 73 63.842 -4.229 5.665 1.00 0.00 H new ATOM 0 HE2 PHE A 73 65.686 -0.793 3.865 1.00 0.00 H new ATOM 0 HZ PHE A 73 64.030 -2.637 3.775 1.00 0.00 H new ATOM 1171 N MET A 74 69.810 -1.581 6.357 1.00 0.00 N ATOM 1172 CA MET A 74 70.438 -1.277 5.045 1.00 0.00 C ATOM 1173 C MET A 74 71.576 -2.274 4.777 1.00 0.00 C ATOM 1174 O MET A 74 71.892 -2.576 3.645 1.00 0.00 O ATOM 1175 CB MET A 74 70.986 0.154 5.030 1.00 0.00 C ATOM 1176 CG MET A 74 69.821 1.149 5.068 1.00 0.00 C ATOM 1177 SD MET A 74 70.424 2.809 4.658 1.00 0.00 S ATOM 1178 CE MET A 74 70.750 2.528 2.895 1.00 0.00 C ATOM 0 H MET A 74 69.990 -0.901 7.096 1.00 0.00 H new ATOM 0 HA MET A 74 69.683 -1.367 4.264 1.00 0.00 H new ATOM 0 HB2 MET A 74 71.641 0.313 5.886 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.587 0.315 4.135 1.00 0.00 H new ATOM 0 HG2 MET A 74 69.049 0.847 4.361 1.00 0.00 H new ATOM 0 HG3 MET A 74 69.364 1.151 6.058 1.00 0.00 H new ATOM 0 HE1 MET A 74 70.665 3.471 2.354 1.00 0.00 H new ATOM 0 HE2 MET A 74 71.756 2.128 2.770 1.00 0.00 H new ATOM 0 HE3 MET A 74 70.025 1.816 2.500 1.00 0.00 H new ATOM 1188 N ALA A 75 72.205 -2.783 5.809 1.00 0.00 N ATOM 1189 CA ALA A 75 73.323 -3.754 5.587 1.00 0.00 C ATOM 1190 C ALA A 75 72.769 -5.006 4.899 1.00 0.00 C ATOM 1191 O ALA A 75 73.172 -5.363 3.808 1.00 0.00 O ATOM 1192 CB ALA A 75 73.933 -4.137 6.939 1.00 0.00 C ATOM 0 H ALA A 75 71.996 -2.571 6.785 1.00 0.00 H new ATOM 0 HA ALA A 75 74.090 -3.302 4.958 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.748 -4.844 6.783 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.317 -3.243 7.431 1.00 0.00 H new ATOM 0 HB3 ALA A 75 73.169 -4.596 7.566 1.00 0.00 H new ATOM 1198 N PHE A 76 71.842 -5.667 5.534 1.00 0.00 N ATOM 1199 CA PHE A 76 71.244 -6.898 4.931 1.00 0.00 C ATOM 1200 C PHE A 76 70.836 -6.565 3.498 1.00 0.00 C ATOM 1201 O PHE A 76 71.034 -7.333 2.577 1.00 0.00 O ATOM 1202 CB PHE A 76 70.006 -7.305 5.732 1.00 0.00 C ATOM 1203 CG PHE A 76 69.354 -8.504 5.089 1.00 0.00 C ATOM 1204 CD1 PHE A 76 68.383 -8.322 4.097 1.00 0.00 C ATOM 1205 CD2 PHE A 76 69.718 -9.797 5.483 1.00 0.00 C ATOM 1206 CE1 PHE A 76 67.775 -9.432 3.500 1.00 0.00 C ATOM 1207 CE2 PHE A 76 69.109 -10.908 4.886 1.00 0.00 C ATOM 1208 CZ PHE A 76 68.137 -10.725 3.895 1.00 0.00 C ATOM 0 H PHE A 76 71.469 -5.409 6.448 1.00 0.00 H new ATOM 0 HA PHE A 76 71.961 -7.719 4.943 1.00 0.00 H new ATOM 0 HB2 PHE A 76 70.287 -7.539 6.759 1.00 0.00 H new ATOM 0 HB3 PHE A 76 69.300 -6.475 5.775 1.00 0.00 H new ATOM 0 HD1 PHE A 76 68.103 -7.324 3.792 1.00 0.00 H new ATOM 0 HD2 PHE A 76 70.468 -9.938 6.247 1.00 0.00 H new ATOM 0 HE1 PHE A 76 67.026 -9.291 2.734 1.00 0.00 H new ATOM 0 HE2 PHE A 76 69.389 -11.906 5.190 1.00 0.00 H new ATOM 0 HZ PHE A 76 67.667 -11.582 3.435 1.00 0.00 H new ATOM 1218 N VAL A 77 70.307 -5.396 3.315 1.00 0.00 N ATOM 1219 CA VAL A 77 69.928 -4.971 1.947 1.00 0.00 C ATOM 1220 C VAL A 77 71.217 -4.934 1.118 1.00 0.00 C ATOM 1221 O VAL A 77 71.245 -5.330 -0.030 1.00 0.00 O ATOM 1222 CB VAL A 77 69.264 -3.590 1.974 1.00 0.00 C ATOM 1223 CG1 VAL A 77 69.079 -3.073 0.545 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.897 -3.700 2.653 1.00 0.00 C ATOM 0 H VAL A 77 70.120 -4.716 4.052 1.00 0.00 H new ATOM 0 HA VAL A 77 69.208 -5.664 1.513 1.00 0.00 H new ATOM 0 HB VAL A 77 69.898 -2.897 2.527 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.607 -2.091 0.572 1.00 0.00 H new ATOM 0 HG12 VAL A 77 70.051 -2.995 0.058 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.448 -3.764 -0.013 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.421 -2.719 2.674 1.00 0.00 H new ATOM 0 HG22 VAL A 77 67.269 -4.396 2.096 1.00 0.00 H new ATOM 0 HG23 VAL A 77 68.025 -4.063 3.673 1.00 0.00 H new ATOM 1234 N SER A 78 72.293 -4.461 1.707 1.00 0.00 N ATOM 1235 CA SER A 78 73.595 -4.394 0.977 1.00 0.00 C ATOM 1236 C SER A 78 74.198 -5.794 0.806 1.00 0.00 C ATOM 1237 O SER A 78 74.617 -6.168 -0.270 1.00 0.00 O ATOM 1238 CB SER A 78 74.569 -3.519 1.772 1.00 0.00 C ATOM 1239 OG SER A 78 75.751 -3.318 1.010 1.00 0.00 O ATOM 0 H SER A 78 72.321 -4.118 2.667 1.00 0.00 H new ATOM 0 HA SER A 78 73.421 -3.968 -0.011 1.00 0.00 H new ATOM 0 HB2 SER A 78 74.106 -2.560 2.006 1.00 0.00 H new ATOM 0 HB3 SER A 78 74.812 -3.996 2.722 1.00 0.00 H new ATOM 0 HG SER A 78 75.538 -3.375 0.055 1.00 0.00 H new ATOM 1245 N MET A 79 74.290 -6.557 1.857 1.00 0.00 N ATOM 1246 CA MET A 79 74.916 -7.910 1.735 1.00 0.00 C ATOM 1247 C MET A 79 74.221 -8.696 0.626 1.00 0.00 C ATOM 1248 O MET A 79 74.854 -9.372 -0.161 1.00 0.00 O ATOM 1249 CB MET A 79 74.773 -8.664 3.061 1.00 0.00 C ATOM 1250 CG MET A 79 75.460 -10.026 2.951 1.00 0.00 C ATOM 1251 SD MET A 79 75.476 -10.827 4.575 1.00 0.00 S ATOM 1252 CE MET A 79 73.890 -11.686 4.427 1.00 0.00 C ATOM 0 H MET A 79 73.963 -6.309 2.791 1.00 0.00 H new ATOM 0 HA MET A 79 75.973 -7.798 1.494 1.00 0.00 H new ATOM 0 HB2 MET A 79 75.218 -8.085 3.870 1.00 0.00 H new ATOM 0 HB3 MET A 79 73.719 -8.795 3.305 1.00 0.00 H new ATOM 0 HG2 MET A 79 74.935 -10.653 2.230 1.00 0.00 H new ATOM 0 HG3 MET A 79 76.479 -9.903 2.584 1.00 0.00 H new ATOM 0 HE1 MET A 79 73.697 -12.254 5.337 1.00 0.00 H new ATOM 0 HE2 MET A 79 73.094 -10.957 4.279 1.00 0.00 H new ATOM 0 HE3 MET A 79 73.922 -12.366 3.576 1.00 0.00 H new ATOM 1262 N VAL A 80 72.931 -8.591 0.539 1.00 0.00 N ATOM 1263 CA VAL A 80 72.195 -9.308 -0.536 1.00 0.00 C ATOM 1264 C VAL A 80 72.522 -8.649 -1.876 1.00 0.00 C ATOM 1265 O VAL A 80 72.495 -9.273 -2.917 1.00 0.00 O ATOM 1266 CB VAL A 80 70.693 -9.218 -0.276 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.932 -9.828 -1.456 1.00 0.00 C ATOM 1268 CG2 VAL A 80 70.355 -9.986 1.003 1.00 0.00 C ATOM 0 H VAL A 80 72.349 -8.037 1.168 1.00 0.00 H new ATOM 0 HA VAL A 80 72.491 -10.357 -0.554 1.00 0.00 H new ATOM 0 HB VAL A 80 70.404 -8.173 -0.162 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.860 -9.764 -1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 80 70.176 -9.282 -2.367 1.00 0.00 H new ATOM 0 HG13 VAL A 80 70.218 -10.873 -1.572 1.00 0.00 H new ATOM 0 HG21 VAL A 80 69.283 -9.924 1.192 1.00 0.00 H new ATOM 0 HG22 VAL A 80 70.643 -11.031 0.887 1.00 0.00 H new ATOM 0 HG23 VAL A 80 70.897 -9.551 1.843 1.00 0.00 H new ATOM 1278 N THR A 81 72.839 -7.383 -1.847 1.00 0.00 N ATOM 1279 CA THR A 81 73.176 -6.671 -3.110 1.00 0.00 C ATOM 1280 C THR A 81 74.507 -7.199 -3.643 1.00 0.00 C ATOM 1281 O THR A 81 74.655 -7.456 -4.822 1.00 0.00 O ATOM 1282 CB THR A 81 73.301 -5.169 -2.840 1.00 0.00 C ATOM 1283 OG1 THR A 81 72.116 -4.704 -2.210 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.497 -4.426 -4.164 1.00 0.00 C ATOM 0 H THR A 81 72.879 -6.812 -1.003 1.00 0.00 H new ATOM 0 HA THR A 81 72.388 -6.841 -3.843 1.00 0.00 H new ATOM 0 HB THR A 81 74.157 -4.986 -2.191 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.538 -4.275 -2.875 1.00 0.00 H new ATOM 0 HG21 THR A 81 73.586 -3.357 -3.972 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.404 -4.784 -4.651 1.00 0.00 H new ATOM 0 HG23 THR A 81 72.641 -4.608 -4.813 1.00 0.00 H new ATOM 1292 N THR A 82 75.478 -7.364 -2.787 1.00 0.00 N ATOM 1293 CA THR A 82 76.793 -7.878 -3.257 1.00 0.00 C ATOM 1294 C THR A 82 76.619 -9.336 -3.683 1.00 0.00 C ATOM 1295 O THR A 82 76.966 -9.722 -4.782 1.00 0.00 O ATOM 1296 CB THR A 82 77.809 -7.781 -2.112 1.00 0.00 C ATOM 1297 OG1 THR A 82 77.836 -6.448 -1.621 1.00 0.00 O ATOM 1298 CG2 THR A 82 79.205 -8.168 -2.610 1.00 0.00 C ATOM 0 H THR A 82 75.417 -7.166 -1.788 1.00 0.00 H new ATOM 0 HA THR A 82 77.154 -7.291 -4.101 1.00 0.00 H new ATOM 0 HB THR A 82 77.515 -8.464 -1.315 1.00 0.00 H new ATOM 0 HG1 THR A 82 78.171 -5.849 -2.320 1.00 0.00 H new ATOM 0 HG21 THR A 82 79.918 -8.095 -1.788 1.00 0.00 H new ATOM 0 HG22 THR A 82 79.187 -9.191 -2.985 1.00 0.00 H new ATOM 0 HG23 THR A 82 79.505 -7.493 -3.412 1.00 0.00 H new ATOM 1306 N ALA A 83 76.095 -10.150 -2.809 1.00 0.00 N ATOM 1307 CA ALA A 83 75.904 -11.591 -3.137 1.00 0.00 C ATOM 1308 C ALA A 83 75.286 -11.722 -4.533 1.00 0.00 C ATOM 1309 O ALA A 83 75.668 -12.573 -5.312 1.00 0.00 O ATOM 1310 CB ALA A 83 74.967 -12.218 -2.102 1.00 0.00 C ATOM 0 H ALA A 83 75.789 -9.877 -1.875 1.00 0.00 H new ATOM 0 HA ALA A 83 76.866 -12.103 -3.121 1.00 0.00 H new ATOM 0 HB1 ALA A 83 74.822 -13.273 -2.335 1.00 0.00 H new ATOM 0 HB2 ALA A 83 75.406 -12.122 -1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 83 74.005 -11.706 -2.124 1.00 0.00 H new ATOM 1316 N CYS A 84 74.337 -10.891 -4.854 1.00 0.00 N ATOM 1317 CA CYS A 84 73.702 -10.978 -6.202 1.00 0.00 C ATOM 1318 C CYS A 84 74.677 -10.443 -7.256 1.00 0.00 C ATOM 1319 O CYS A 84 74.967 -9.264 -7.307 1.00 0.00 O ATOM 1320 CB CYS A 84 72.420 -10.142 -6.218 1.00 0.00 C ATOM 1321 SG CYS A 84 71.504 -10.466 -7.745 1.00 0.00 S ATOM 0 H CYS A 84 73.973 -10.157 -4.246 1.00 0.00 H new ATOM 0 HA CYS A 84 73.458 -12.017 -6.425 1.00 0.00 H new ATOM 0 HB2 CYS A 84 71.803 -10.387 -5.353 1.00 0.00 H new ATOM 0 HB3 CYS A 84 72.664 -9.082 -6.146 1.00 0.00 H new ATOM 0 HG CYS A 84 70.402 -11.095 -7.465 1.00 0.00 H new ATOM 1450 N SER B 1 59.416 -6.927 -7.945 1.00 0.00 N ATOM 1451 CA SER B 1 58.664 -5.940 -7.122 1.00 0.00 C ATOM 1452 C SER B 1 59.278 -4.550 -7.298 1.00 0.00 C ATOM 1453 O SER B 1 60.359 -4.399 -7.830 1.00 0.00 O ATOM 1454 CB SER B 1 58.737 -6.343 -5.649 1.00 0.00 C ATOM 1455 OG SER B 1 58.095 -7.600 -5.475 1.00 0.00 O ATOM 0 H1 SER B 1 58.755 -7.439 -8.563 1.00 0.00 H new ATOM 0 H2 SER B 1 60.120 -6.429 -8.527 1.00 0.00 H new ATOM 0 H3 SER B 1 59.900 -7.603 -7.320 1.00 0.00 H new ATOM 0 HA SER B 1 57.623 -5.921 -7.445 1.00 0.00 H new ATOM 0 HB2 SER B 1 59.777 -6.405 -5.328 1.00 0.00 H new ATOM 0 HB3 SER B 1 58.256 -5.587 -5.029 1.00 0.00 H new ATOM 0 HG SER B 1 58.141 -7.863 -4.532 1.00 0.00 H new ATOM 1463 N GLU B 2 58.584 -3.534 -6.870 1.00 0.00 N ATOM 1464 CA GLU B 2 59.101 -2.146 -7.021 1.00 0.00 C ATOM 1465 C GLU B 2 60.437 -1.988 -6.282 1.00 0.00 C ATOM 1466 O GLU B 2 61.335 -1.320 -6.755 1.00 0.00 O ATOM 1467 CB GLU B 2 58.068 -1.169 -6.446 1.00 0.00 C ATOM 1468 CG GLU B 2 58.503 0.276 -6.713 1.00 0.00 C ATOM 1469 CD GLU B 2 58.511 0.543 -8.220 1.00 0.00 C ATOM 1470 OE1 GLU B 2 57.849 -0.193 -8.935 1.00 0.00 O ATOM 1471 OE2 GLU B 2 59.185 1.473 -8.634 1.00 0.00 O ATOM 0 H GLU B 2 57.673 -3.606 -6.418 1.00 0.00 H new ATOM 0 HA GLU B 2 59.267 -1.934 -8.077 1.00 0.00 H new ATOM 0 HB2 GLU B 2 57.093 -1.352 -6.897 1.00 0.00 H new ATOM 0 HB3 GLU B 2 57.959 -1.332 -5.374 1.00 0.00 H new ATOM 0 HG2 GLU B 2 57.824 0.968 -6.215 1.00 0.00 H new ATOM 0 HG3 GLU B 2 59.496 0.450 -6.298 1.00 0.00 H new ATOM 1478 N LEU B 3 60.592 -2.607 -5.140 1.00 0.00 N ATOM 1479 CA LEU B 3 61.885 -2.492 -4.404 1.00 0.00 C ATOM 1480 C LEU B 3 62.973 -3.254 -5.165 1.00 0.00 C ATOM 1481 O LEU B 3 64.128 -2.876 -5.158 1.00 0.00 O ATOM 1482 CB LEU B 3 61.735 -3.079 -2.988 1.00 0.00 C ATOM 1483 CG LEU B 3 63.077 -2.963 -2.203 1.00 0.00 C ATOM 1484 CD1 LEU B 3 62.798 -2.624 -0.730 1.00 0.00 C ATOM 1485 CD2 LEU B 3 63.856 -4.292 -2.260 1.00 0.00 C ATOM 0 H LEU B 3 59.883 -3.184 -4.688 1.00 0.00 H new ATOM 0 HA LEU B 3 62.163 -1.441 -4.326 1.00 0.00 H new ATOM 0 HB2 LEU B 3 60.946 -2.552 -2.451 1.00 0.00 H new ATOM 0 HB3 LEU B 3 61.433 -4.125 -3.052 1.00 0.00 H new ATOM 0 HG LEU B 3 63.670 -2.173 -2.664 1.00 0.00 H new ATOM 0 HD11 LEU B 3 63.741 -2.545 -0.190 1.00 0.00 H new ATOM 0 HD12 LEU B 3 62.265 -1.675 -0.670 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.190 -3.411 -0.284 1.00 0.00 H new ATOM 0 HD21 LEU B 3 64.789 -4.191 -1.706 1.00 0.00 H new ATOM 0 HD22 LEU B 3 63.255 -5.085 -1.816 1.00 0.00 H new ATOM 0 HD23 LEU B 3 64.075 -4.541 -3.298 1.00 0.00 H new ATOM 1497 N GLU B 4 62.614 -4.322 -5.827 1.00 0.00 N ATOM 1498 CA GLU B 4 63.629 -5.102 -6.595 1.00 0.00 C ATOM 1499 C GLU B 4 64.246 -4.211 -7.672 1.00 0.00 C ATOM 1500 O GLU B 4 65.438 -4.234 -7.907 1.00 0.00 O ATOM 1501 CB GLU B 4 62.945 -6.307 -7.254 1.00 0.00 C ATOM 1502 CG GLU B 4 63.970 -7.124 -8.048 1.00 0.00 C ATOM 1503 CD GLU B 4 63.274 -8.320 -8.700 1.00 0.00 C ATOM 1504 OE1 GLU B 4 62.810 -8.173 -9.819 1.00 0.00 O ATOM 1505 OE2 GLU B 4 63.225 -9.366 -8.074 1.00 0.00 O ATOM 0 H GLU B 4 61.663 -4.688 -5.869 1.00 0.00 H new ATOM 0 HA GLU B 4 64.413 -5.450 -5.922 1.00 0.00 H new ATOM 0 HB2 GLU B 4 62.481 -6.933 -6.492 1.00 0.00 H new ATOM 0 HB3 GLU B 4 62.149 -5.966 -7.916 1.00 0.00 H new ATOM 0 HG2 GLU B 4 64.436 -6.500 -8.811 1.00 0.00 H new ATOM 0 HG3 GLU B 4 64.766 -7.468 -7.388 1.00 0.00 H new ATOM 1512 N LYS B 5 63.436 -3.439 -8.332 1.00 0.00 N ATOM 1513 CA LYS B 5 63.950 -2.552 -9.411 1.00 0.00 C ATOM 1514 C LYS B 5 64.974 -1.579 -8.837 1.00 0.00 C ATOM 1515 O LYS B 5 65.971 -1.273 -9.462 1.00 0.00 O ATOM 1516 CB LYS B 5 62.793 -1.773 -10.027 1.00 0.00 C ATOM 1517 CG LYS B 5 61.878 -2.745 -10.768 1.00 0.00 C ATOM 1518 CD LYS B 5 60.716 -1.977 -11.390 1.00 0.00 C ATOM 1519 CE LYS B 5 59.801 -2.953 -12.130 1.00 0.00 C ATOM 1520 NZ LYS B 5 58.590 -2.229 -12.605 1.00 0.00 N ATOM 0 H LYS B 5 62.430 -3.382 -8.170 1.00 0.00 H new ATOM 0 HA LYS B 5 64.426 -3.161 -10.179 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.236 -1.249 -9.250 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.172 -1.015 -10.713 1.00 0.00 H new ATOM 0 HG2 LYS B 5 62.438 -3.269 -11.543 1.00 0.00 H new ATOM 0 HG3 LYS B 5 61.501 -3.502 -10.080 1.00 0.00 H new ATOM 0 HD2 LYS B 5 60.156 -1.452 -10.616 1.00 0.00 H new ATOM 0 HD3 LYS B 5 61.093 -1.221 -12.079 1.00 0.00 H new ATOM 0 HE2 LYS B 5 60.329 -3.395 -12.975 1.00 0.00 H new ATOM 0 HE3 LYS B 5 59.514 -3.772 -11.470 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 57.965 -2.890 -13.109 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 58.084 -1.827 -11.790 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 58.874 -1.463 -13.248 1.00 0.00 H new ATOM 1534 N ALA B 6 64.739 -1.085 -7.657 1.00 0.00 N ATOM 1535 CA ALA B 6 65.702 -0.123 -7.060 1.00 0.00 C ATOM 1536 C ALA B 6 67.067 -0.805 -6.927 1.00 0.00 C ATOM 1537 O ALA B 6 68.093 -0.224 -7.225 1.00 0.00 O ATOM 1538 CB ALA B 6 65.195 0.300 -5.679 1.00 0.00 C ATOM 0 H ALA B 6 63.926 -1.304 -7.082 1.00 0.00 H new ATOM 0 HA ALA B 6 65.797 0.758 -7.694 1.00 0.00 H new ATOM 0 HB1 ALA B 6 65.896 1.006 -5.234 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.218 0.773 -5.779 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.109 -0.578 -5.039 1.00 0.00 H new ATOM 1544 N MET B 7 67.088 -2.039 -6.499 1.00 0.00 N ATOM 1545 CA MET B 7 68.387 -2.761 -6.370 1.00 0.00 C ATOM 1546 C MET B 7 69.049 -2.872 -7.747 1.00 0.00 C ATOM 1547 O MET B 7 70.216 -2.582 -7.915 1.00 0.00 O ATOM 1548 CB MET B 7 68.128 -4.170 -5.826 1.00 0.00 C ATOM 1549 CG MET B 7 69.455 -4.848 -5.466 1.00 0.00 C ATOM 1550 SD MET B 7 70.039 -4.223 -3.872 1.00 0.00 S ATOM 1551 CE MET B 7 69.163 -5.415 -2.829 1.00 0.00 C ATOM 0 H MET B 7 66.263 -2.577 -6.234 1.00 0.00 H new ATOM 0 HA MET B 7 69.041 -2.214 -5.691 1.00 0.00 H new ATOM 0 HB2 MET B 7 67.488 -4.116 -4.946 1.00 0.00 H new ATOM 0 HB3 MET B 7 67.597 -4.764 -6.570 1.00 0.00 H new ATOM 0 HG2 MET B 7 69.322 -5.929 -5.418 1.00 0.00 H new ATOM 0 HG3 MET B 7 70.197 -4.652 -6.240 1.00 0.00 H new ATOM 0 HE1 MET B 7 69.369 -5.201 -1.780 1.00 0.00 H new ATOM 0 HE2 MET B 7 68.091 -5.339 -3.011 1.00 0.00 H new ATOM 0 HE3 MET B 7 69.501 -6.424 -3.067 1.00 0.00 H new ATOM 1561 N VAL B 8 68.308 -3.326 -8.723 1.00 0.00 N ATOM 1562 CA VAL B 8 68.876 -3.509 -10.092 1.00 0.00 C ATOM 1563 C VAL B 8 69.384 -2.171 -10.635 1.00 0.00 C ATOM 1564 O VAL B 8 70.419 -2.109 -11.270 1.00 0.00 O ATOM 1565 CB VAL B 8 67.779 -4.053 -11.014 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.256 -4.036 -12.470 1.00 0.00 C ATOM 1567 CG2 VAL B 8 67.440 -5.488 -10.605 1.00 0.00 C ATOM 0 H VAL B 8 67.325 -3.580 -8.630 1.00 0.00 H new ATOM 0 HA VAL B 8 69.710 -4.209 -10.049 1.00 0.00 H new ATOM 0 HB VAL B 8 66.893 -3.424 -10.924 1.00 0.00 H new ATOM 0 HG11 VAL B 8 67.468 -4.425 -13.115 1.00 0.00 H new ATOM 0 HG12 VAL B 8 68.494 -3.013 -12.763 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.146 -4.658 -12.569 1.00 0.00 H new ATOM 0 HG21 VAL B 8 66.660 -5.878 -11.259 1.00 0.00 H new ATOM 0 HG22 VAL B 8 68.330 -6.111 -10.691 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.088 -5.499 -9.574 1.00 0.00 H new ATOM 1577 N ALA B 9 68.678 -1.104 -10.405 1.00 0.00 N ATOM 1578 CA ALA B 9 69.149 0.206 -10.927 1.00 0.00 C ATOM 1579 C ALA B 9 70.525 0.520 -10.336 1.00 0.00 C ATOM 1580 O ALA B 9 71.405 1.019 -11.011 1.00 0.00 O ATOM 1581 CB ALA B 9 68.157 1.300 -10.528 1.00 0.00 C ATOM 0 H ALA B 9 67.802 -1.080 -9.883 1.00 0.00 H new ATOM 0 HA ALA B 9 69.221 0.163 -12.014 1.00 0.00 H new ATOM 0 HB1 ALA B 9 68.502 2.261 -10.910 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.177 1.073 -10.947 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.085 1.347 -9.441 1.00 0.00 H new ATOM 1587 N LEU B 10 70.709 0.252 -9.074 1.00 0.00 N ATOM 1588 CA LEU B 10 72.018 0.552 -8.425 1.00 0.00 C ATOM 1589 C LEU B 10 73.143 -0.226 -9.125 1.00 0.00 C ATOM 1590 O LEU B 10 74.175 0.328 -9.451 1.00 0.00 O ATOM 1591 CB LEU B 10 71.940 0.141 -6.949 1.00 0.00 C ATOM 1592 CG LEU B 10 73.263 0.446 -6.229 1.00 0.00 C ATOM 1593 CD1 LEU B 10 73.535 1.962 -6.245 1.00 0.00 C ATOM 1594 CD2 LEU B 10 73.156 -0.047 -4.781 1.00 0.00 C ATOM 0 H LEU B 10 70.008 -0.163 -8.461 1.00 0.00 H new ATOM 0 HA LEU B 10 72.232 1.618 -8.503 1.00 0.00 H new ATOM 0 HB2 LEU B 10 71.124 0.673 -6.461 1.00 0.00 H new ATOM 0 HB3 LEU B 10 71.716 -0.923 -6.874 1.00 0.00 H new ATOM 0 HG LEU B 10 74.085 -0.060 -6.736 1.00 0.00 H new ATOM 0 HD11 LEU B 10 74.475 2.169 -5.732 1.00 0.00 H new ATOM 0 HD12 LEU B 10 73.600 2.309 -7.276 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.723 2.483 -5.738 1.00 0.00 H new ATOM 0 HD21 LEU B 10 74.088 0.162 -4.256 1.00 0.00 H new ATOM 0 HD22 LEU B 10 72.335 0.467 -4.281 1.00 0.00 H new ATOM 0 HD23 LEU B 10 72.969 -1.121 -4.775 1.00 0.00 H new ATOM 1606 N ILE B 11 72.969 -1.506 -9.345 1.00 0.00 N ATOM 1607 CA ILE B 11 74.056 -2.295 -10.002 1.00 0.00 C ATOM 1608 C ILE B 11 74.351 -1.719 -11.391 1.00 0.00 C ATOM 1609 O ILE B 11 75.485 -1.444 -11.729 1.00 0.00 O ATOM 1610 CB ILE B 11 73.595 -3.753 -10.146 1.00 0.00 C ATOM 1611 CG1 ILE B 11 73.514 -4.396 -8.760 1.00 0.00 C ATOM 1612 CG2 ILE B 11 74.590 -4.536 -11.011 1.00 0.00 C ATOM 1613 CD1 ILE B 11 72.739 -5.712 -8.852 1.00 0.00 C ATOM 0 H ILE B 11 72.131 -2.034 -9.101 1.00 0.00 H new ATOM 0 HA ILE B 11 74.960 -2.246 -9.395 1.00 0.00 H new ATOM 0 HB ILE B 11 72.615 -3.773 -10.622 1.00 0.00 H new ATOM 0 HG12 ILE B 11 74.517 -4.578 -8.373 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.021 -3.719 -8.062 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.254 -5.569 -11.107 1.00 0.00 H new ATOM 0 HG22 ILE B 11 74.650 -4.080 -11.999 1.00 0.00 H new ATOM 0 HG23 ILE B 11 75.574 -4.516 -10.542 1.00 0.00 H new ATOM 0 HD11 ILE B 11 72.681 -6.170 -7.865 1.00 0.00 H new ATOM 0 HD12 ILE B 11 71.732 -5.516 -9.221 1.00 0.00 H new ATOM 0 HD13 ILE B 11 73.251 -6.389 -9.536 1.00 0.00 H new ATOM 1625 N ASP B 12 73.346 -1.550 -12.200 1.00 0.00 N ATOM 1626 CA ASP B 12 73.587 -1.011 -13.566 1.00 0.00 C ATOM 1627 C ASP B 12 74.223 0.374 -13.453 1.00 0.00 C ATOM 1628 O ASP B 12 75.119 0.721 -14.197 1.00 0.00 O ATOM 1629 CB ASP B 12 72.262 -0.901 -14.322 1.00 0.00 C ATOM 1630 CG ASP B 12 72.521 -0.351 -15.726 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.652 0.015 -15.997 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.585 -0.302 -16.503 1.00 0.00 O ATOM 0 H ASP B 12 72.373 -1.760 -11.977 1.00 0.00 H new ATOM 0 HA ASP B 12 74.254 -1.682 -14.108 1.00 0.00 H new ATOM 0 HB2 ASP B 12 71.785 -1.879 -14.385 1.00 0.00 H new ATOM 0 HB3 ASP B 12 71.577 -0.246 -13.784 1.00 0.00 H new ATOM 1637 N VAL B 13 73.771 1.166 -12.522 1.00 0.00 N ATOM 1638 CA VAL B 13 74.356 2.526 -12.359 1.00 0.00 C ATOM 1639 C VAL B 13 75.787 2.415 -11.808 1.00 0.00 C ATOM 1640 O VAL B 13 76.679 3.121 -12.235 1.00 0.00 O ATOM 1641 CB VAL B 13 73.491 3.344 -11.393 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.201 4.656 -11.045 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.138 3.651 -12.046 1.00 0.00 C ATOM 0 H VAL B 13 73.024 0.932 -11.868 1.00 0.00 H new ATOM 0 HA VAL B 13 74.385 3.024 -13.328 1.00 0.00 H new ATOM 0 HB VAL B 13 73.331 2.768 -10.481 1.00 0.00 H new ATOM 0 HG11 VAL B 13 73.582 5.234 -10.358 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.159 4.437 -10.574 1.00 0.00 H new ATOM 0 HG13 VAL B 13 74.368 5.232 -11.955 1.00 0.00 H new ATOM 0 HG21 VAL B 13 71.525 4.232 -11.357 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.297 4.222 -12.961 1.00 0.00 H new ATOM 0 HG23 VAL B 13 71.629 2.717 -12.285 1.00 0.00 H new ATOM 1653 N PHE B 14 76.014 1.539 -10.861 1.00 0.00 N ATOM 1654 CA PHE B 14 77.389 1.399 -10.290 1.00 0.00 C ATOM 1655 C PHE B 14 78.369 0.937 -11.370 1.00 0.00 C ATOM 1656 O PHE B 14 79.392 1.550 -11.600 1.00 0.00 O ATOM 1657 CB PHE B 14 77.367 0.358 -9.164 1.00 0.00 C ATOM 1658 CG PHE B 14 78.770 0.129 -8.638 1.00 0.00 C ATOM 1659 CD1 PHE B 14 79.262 0.905 -7.579 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.576 -0.865 -9.209 1.00 0.00 C ATOM 1661 CE1 PHE B 14 80.560 0.687 -7.094 1.00 0.00 C ATOM 1662 CE2 PHE B 14 80.873 -1.080 -8.723 1.00 0.00 C ATOM 1663 CZ PHE B 14 81.363 -0.306 -7.667 1.00 0.00 C ATOM 0 H PHE B 14 75.311 0.918 -10.460 1.00 0.00 H new ATOM 0 HA PHE B 14 77.709 2.367 -9.904 1.00 0.00 H new ATOM 0 HB2 PHE B 14 76.719 0.698 -8.357 1.00 0.00 H new ATOM 0 HB3 PHE B 14 76.951 -0.580 -9.533 1.00 0.00 H new ATOM 0 HD1 PHE B 14 78.642 1.671 -7.137 1.00 0.00 H new ATOM 0 HD2 PHE B 14 79.198 -1.465 -10.023 1.00 0.00 H new ATOM 0 HE1 PHE B 14 80.940 1.285 -6.279 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.495 -1.845 -9.165 1.00 0.00 H new ATOM 0 HZ PHE B 14 82.362 -0.474 -7.293 1.00 0.00 H new ATOM 1673 N HIS B 15 78.089 -0.175 -11.991 1.00 0.00 N ATOM 1674 CA HIS B 15 79.021 -0.735 -13.008 1.00 0.00 C ATOM 1675 C HIS B 15 79.247 0.226 -14.175 1.00 0.00 C ATOM 1676 O HIS B 15 80.362 0.386 -14.631 1.00 0.00 O ATOM 1677 CB HIS B 15 78.420 -2.036 -13.540 1.00 0.00 C ATOM 1678 CG HIS B 15 79.331 -2.633 -14.573 1.00 0.00 C ATOM 1679 ND1 HIS B 15 79.183 -2.372 -15.927 1.00 0.00 N ATOM 1680 CD2 HIS B 15 80.403 -3.484 -14.470 1.00 0.00 C ATOM 1681 CE1 HIS B 15 80.142 -3.053 -16.580 1.00 0.00 C ATOM 1682 NE2 HIS B 15 80.911 -3.746 -15.737 1.00 0.00 N ATOM 0 H HIS B 15 77.244 -0.725 -11.835 1.00 0.00 H new ATOM 0 HA HIS B 15 79.987 -0.906 -12.533 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.273 -2.740 -12.721 1.00 0.00 H new ATOM 0 HB3 HIS B 15 77.439 -1.843 -13.975 1.00 0.00 H new ATOM 0 HD2 HIS B 15 80.792 -3.888 -13.547 1.00 0.00 H new ATOM 0 HE1 HIS B 15 80.273 -3.041 -17.652 1.00 0.00 H new ATOM 0 HE2 HIS B 15 81.704 -4.342 -15.973 1.00 0.00 H new ATOM 1691 N GLN B 16 78.231 0.863 -14.685 1.00 0.00 N ATOM 1692 CA GLN B 16 78.462 1.790 -15.830 1.00 0.00 C ATOM 1693 C GLN B 16 79.226 3.026 -15.365 1.00 0.00 C ATOM 1694 O GLN B 16 80.117 3.512 -16.033 1.00 0.00 O ATOM 1695 CB GLN B 16 77.112 2.222 -16.402 1.00 0.00 C ATOM 1696 CG GLN B 16 76.406 1.010 -17.007 1.00 0.00 C ATOM 1697 CD GLN B 16 77.154 0.567 -18.264 1.00 0.00 C ATOM 1698 OE1 GLN B 16 77.597 1.389 -19.042 1.00 0.00 O ATOM 1699 NE2 GLN B 16 77.317 -0.705 -18.499 1.00 0.00 N ATOM 0 H GLN B 16 77.265 0.785 -14.366 1.00 0.00 H new ATOM 0 HA GLN B 16 79.048 1.276 -16.592 1.00 0.00 H new ATOM 0 HB2 GLN B 16 76.496 2.661 -15.617 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.256 2.990 -17.162 1.00 0.00 H new ATOM 0 HG2 GLN B 16 76.372 0.195 -16.284 1.00 0.00 H new ATOM 0 HG3 GLN B 16 75.374 1.261 -17.253 1.00 0.00 H new ATOM 0 HE21 GLN B 16 76.946 -1.396 -17.847 1.00 0.00 H new ATOM 0 HE22 GLN B 16 77.816 -1.009 -19.335 1.00 0.00 H new ATOM 1708 N TYR B 17 78.882 3.535 -14.220 1.00 0.00 N ATOM 1709 CA TYR B 17 79.584 4.740 -13.706 1.00 0.00 C ATOM 1710 C TYR B 17 80.996 4.361 -13.257 1.00 0.00 C ATOM 1711 O TYR B 17 81.967 5.010 -13.596 1.00 0.00 O ATOM 1712 CB TYR B 17 78.818 5.313 -12.516 1.00 0.00 C ATOM 1713 CG TYR B 17 79.549 6.530 -12.015 1.00 0.00 C ATOM 1714 CD1 TYR B 17 80.564 6.391 -11.062 1.00 0.00 C ATOM 1715 CD2 TYR B 17 79.227 7.794 -12.520 1.00 0.00 C ATOM 1716 CE1 TYR B 17 81.256 7.518 -10.610 1.00 0.00 C ATOM 1717 CE2 TYR B 17 79.921 8.921 -12.070 1.00 0.00 C ATOM 1718 CZ TYR B 17 80.934 8.783 -11.115 1.00 0.00 C ATOM 1719 OH TYR B 17 81.620 9.893 -10.676 1.00 0.00 O ATOM 0 H TYR B 17 78.145 3.170 -13.617 1.00 0.00 H new ATOM 0 HA TYR B 17 79.639 5.485 -14.499 1.00 0.00 H new ATOM 0 HB2 TYR B 17 77.802 5.577 -12.811 1.00 0.00 H new ATOM 0 HB3 TYR B 17 78.737 4.568 -11.724 1.00 0.00 H new ATOM 0 HD1 TYR B 17 80.813 5.413 -10.676 1.00 0.00 H new ATOM 0 HD2 TYR B 17 78.444 7.899 -13.256 1.00 0.00 H new ATOM 0 HE1 TYR B 17 82.038 7.413 -9.872 1.00 0.00 H new ATOM 0 HE2 TYR B 17 79.675 9.898 -12.459 1.00 0.00 H new ATOM 0 HH TYR B 17 82.364 9.612 -10.103 1.00 0.00 H new ATOM 1729 N SER B 18 81.111 3.316 -12.486 1.00 0.00 N ATOM 1730 CA SER B 18 82.446 2.883 -11.992 1.00 0.00 C ATOM 1731 C SER B 18 83.275 2.310 -13.147 1.00 0.00 C ATOM 1732 O SER B 18 84.484 2.228 -13.070 1.00 0.00 O ATOM 1733 CB SER B 18 82.253 1.815 -10.915 1.00 0.00 C ATOM 1734 OG SER B 18 81.730 0.634 -11.512 1.00 0.00 O ATOM 0 H SER B 18 80.330 2.739 -12.175 1.00 0.00 H new ATOM 0 HA SER B 18 82.975 3.739 -11.574 1.00 0.00 H new ATOM 0 HB2 SER B 18 83.203 1.599 -10.426 1.00 0.00 H new ATOM 0 HB3 SER B 18 81.573 2.178 -10.144 1.00 0.00 H new ATOM 0 HG SER B 18 80.826 0.810 -11.848 1.00 0.00 H new ATOM 1740 N GLY B 19 82.636 1.905 -14.212 1.00 0.00 N ATOM 1741 CA GLY B 19 83.390 1.329 -15.367 1.00 0.00 C ATOM 1742 C GLY B 19 83.816 2.442 -16.328 1.00 0.00 C ATOM 1743 O GLY B 19 84.124 2.191 -17.476 1.00 0.00 O ATOM 0 H GLY B 19 81.624 1.948 -14.334 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.268 0.794 -15.007 1.00 0.00 H new ATOM 0 HA3 GLY B 19 82.768 0.604 -15.892 1.00 0.00 H new ATOM 1747 N ARG B 20 83.857 3.669 -15.875 1.00 0.00 N ATOM 1748 CA ARG B 20 84.288 4.781 -16.773 1.00 0.00 C ATOM 1749 C ARG B 20 85.813 4.890 -16.739 1.00 0.00 C ATOM 1750 O ARG B 20 86.474 4.902 -17.759 1.00 0.00 O ATOM 1751 CB ARG B 20 83.670 6.096 -16.293 1.00 0.00 C ATOM 1752 CG ARG B 20 82.163 6.077 -16.552 1.00 0.00 C ATOM 1753 CD ARG B 20 81.543 7.396 -16.088 1.00 0.00 C ATOM 1754 NE ARG B 20 82.102 8.523 -16.889 1.00 0.00 N ATOM 1755 CZ ARG B 20 81.639 8.771 -18.086 1.00 0.00 C ATOM 1756 NH1 ARG B 20 80.723 8.001 -18.606 1.00 0.00 N ATOM 1757 NH2 ARG B 20 82.101 9.785 -18.765 1.00 0.00 N ATOM 0 H ARG B 20 83.611 3.948 -14.925 1.00 0.00 H new ATOM 0 HA ARG B 20 83.957 4.579 -17.792 1.00 0.00 H new ATOM 0 HB2 ARG B 20 83.865 6.235 -15.230 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.128 6.937 -16.814 1.00 0.00 H new ATOM 0 HG2 ARG B 20 81.969 5.927 -17.614 1.00 0.00 H new ATOM 0 HG3 ARG B 20 81.704 5.242 -16.023 1.00 0.00 H new ATOM 0 HD2 ARG B 20 80.459 7.359 -16.201 1.00 0.00 H new ATOM 0 HD3 ARG B 20 81.748 7.553 -15.029 1.00 0.00 H new ATOM 0 HE ARG B 20 82.847 9.102 -16.502 1.00 0.00 H new ATOM 0 HH11 ARG B 20 80.367 7.204 -18.078 1.00 0.00 H new ATOM 0 HH12 ARG B 20 80.363 8.196 -19.540 1.00 0.00 H new ATOM 0 HH21 ARG B 20 82.822 10.383 -18.362 1.00 0.00 H new ATOM 0 HH22 ARG B 20 81.741 9.980 -19.699 1.00 0.00 H new ATOM 1771 N GLU B 21 86.373 4.961 -15.559 1.00 0.00 N ATOM 1772 CA GLU B 21 87.855 5.061 -15.411 1.00 0.00 C ATOM 1773 C GLU B 21 88.282 4.209 -14.213 1.00 0.00 C ATOM 1774 O GLU B 21 87.547 4.061 -13.257 1.00 0.00 O ATOM 1775 CB GLU B 21 88.249 6.527 -15.178 1.00 0.00 C ATOM 1776 CG GLU B 21 89.772 6.650 -15.025 1.00 0.00 C ATOM 1777 CD GLU B 21 90.459 6.208 -16.318 1.00 0.00 C ATOM 1778 OE1 GLU B 21 89.811 6.238 -17.352 1.00 0.00 O ATOM 1779 OE2 GLU B 21 91.623 5.853 -16.255 1.00 0.00 O ATOM 0 H GLU B 21 85.858 4.954 -14.679 1.00 0.00 H new ATOM 0 HA GLU B 21 88.350 4.703 -16.314 1.00 0.00 H new ATOM 0 HB2 GLU B 21 87.910 7.139 -16.013 1.00 0.00 H new ATOM 0 HB3 GLU B 21 87.755 6.906 -14.284 1.00 0.00 H new ATOM 0 HG2 GLU B 21 90.042 7.680 -14.793 1.00 0.00 H new ATOM 0 HG3 GLU B 21 90.114 6.036 -14.192 1.00 0.00 H new ATOM 1786 N GLY B 22 89.462 3.641 -14.260 1.00 0.00 N ATOM 1787 CA GLY B 22 89.948 2.784 -13.127 1.00 0.00 C ATOM 1788 C GLY B 22 89.996 1.328 -13.589 1.00 0.00 C ATOM 1789 O GLY B 22 89.665 1.016 -14.715 1.00 0.00 O ATOM 0 H GLY B 22 90.115 3.733 -15.038 1.00 0.00 H new ATOM 0 HA2 GLY B 22 90.937 3.110 -12.806 1.00 0.00 H new ATOM 0 HA3 GLY B 22 89.285 2.885 -12.268 1.00 0.00 H new ATOM 1793 N ASP B 23 90.408 0.428 -12.735 1.00 0.00 N ATOM 1794 CA ASP B 23 90.473 -1.001 -13.153 1.00 0.00 C ATOM 1795 C ASP B 23 89.067 -1.491 -13.513 1.00 0.00 C ATOM 1796 O ASP B 23 88.815 -1.884 -14.634 1.00 0.00 O ATOM 1797 CB ASP B 23 91.035 -1.847 -12.010 1.00 0.00 C ATOM 1798 CG ASP B 23 91.315 -3.264 -12.515 1.00 0.00 C ATOM 1799 OD1 ASP B 23 90.800 -3.610 -13.566 1.00 0.00 O ATOM 1800 OD2 ASP B 23 92.038 -3.978 -11.842 1.00 0.00 O ATOM 0 H ASP B 23 90.699 0.619 -11.776 1.00 0.00 H new ATOM 0 HA ASP B 23 91.124 -1.095 -14.022 1.00 0.00 H new ATOM 0 HB2 ASP B 23 91.952 -1.398 -11.627 1.00 0.00 H new ATOM 0 HB3 ASP B 23 90.326 -1.878 -11.183 1.00 0.00 H new ATOM 1805 N LYS B 24 88.139 -1.452 -12.585 1.00 0.00 N ATOM 1806 CA LYS B 24 86.752 -1.904 -12.914 1.00 0.00 C ATOM 1807 C LYS B 24 85.777 -1.585 -11.769 1.00 0.00 C ATOM 1808 O LYS B 24 84.860 -0.806 -11.937 1.00 0.00 O ATOM 1809 CB LYS B 24 86.735 -3.413 -13.187 1.00 0.00 C ATOM 1810 CG LYS B 24 85.361 -3.805 -13.742 1.00 0.00 C ATOM 1811 CD LYS B 24 85.318 -5.308 -14.048 1.00 0.00 C ATOM 1812 CE LYS B 24 86.250 -5.645 -15.221 1.00 0.00 C ATOM 1813 NZ LYS B 24 85.798 -6.910 -15.868 1.00 0.00 N ATOM 0 H LYS B 24 88.280 -1.131 -11.627 1.00 0.00 H new ATOM 0 HA LYS B 24 86.432 -1.366 -13.806 1.00 0.00 H new ATOM 0 HB2 LYS B 24 87.517 -3.675 -13.899 1.00 0.00 H new ATOM 0 HB3 LYS B 24 86.941 -3.964 -12.269 1.00 0.00 H new ATOM 0 HG2 LYS B 24 84.584 -3.552 -13.020 1.00 0.00 H new ATOM 0 HG3 LYS B 24 85.152 -3.237 -14.648 1.00 0.00 H new ATOM 0 HD2 LYS B 24 85.616 -5.874 -13.165 1.00 0.00 H new ATOM 0 HD3 LYS B 24 84.298 -5.607 -14.289 1.00 0.00 H new ATOM 0 HE2 LYS B 24 86.247 -4.832 -15.947 1.00 0.00 H new ATOM 0 HE3 LYS B 24 87.275 -5.752 -14.866 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 86.429 -7.138 -16.662 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 85.822 -7.683 -15.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 84.827 -6.792 -16.220 1.00 0.00 H new ATOM 1827 N HIS B 25 85.951 -2.192 -10.612 1.00 0.00 N ATOM 1828 CA HIS B 25 85.015 -1.940 -9.464 1.00 0.00 C ATOM 1829 C HIS B 25 85.712 -1.163 -8.344 1.00 0.00 C ATOM 1830 O HIS B 25 85.232 -1.125 -7.228 1.00 0.00 O ATOM 1831 CB HIS B 25 84.527 -3.279 -8.906 1.00 0.00 C ATOM 1832 CG HIS B 25 85.704 -4.097 -8.451 1.00 0.00 C ATOM 1833 ND1 HIS B 25 86.649 -3.608 -7.557 1.00 0.00 N ATOM 1834 CD2 HIS B 25 86.107 -5.373 -8.762 1.00 0.00 C ATOM 1835 CE1 HIS B 25 87.564 -4.578 -7.364 1.00 0.00 C ATOM 1836 NE2 HIS B 25 87.278 -5.670 -8.075 1.00 0.00 N ATOM 0 H HIS B 25 86.703 -2.852 -10.415 1.00 0.00 H new ATOM 0 HA HIS B 25 84.176 -1.349 -9.831 1.00 0.00 H new ATOM 0 HB2 HIS B 25 83.845 -3.110 -8.073 1.00 0.00 H new ATOM 0 HB3 HIS B 25 83.969 -3.821 -9.670 1.00 0.00 H new ATOM 0 HD2 HIS B 25 85.593 -6.042 -9.436 1.00 0.00 H new ATOM 0 HE1 HIS B 25 88.422 -4.483 -6.715 1.00 0.00 H new ATOM 0 HE2 HIS B 25 87.808 -6.541 -8.108 1.00 0.00 H new ATOM 1845 N LYS B 26 86.829 -0.541 -8.623 1.00 0.00 N ATOM 1846 CA LYS B 26 87.547 0.239 -7.563 1.00 0.00 C ATOM 1847 C LYS B 26 87.391 1.735 -7.844 1.00 0.00 C ATOM 1848 O LYS B 26 87.617 2.199 -8.945 1.00 0.00 O ATOM 1849 CB LYS B 26 89.028 -0.151 -7.566 1.00 0.00 C ATOM 1850 CG LYS B 26 89.702 0.352 -8.841 1.00 0.00 C ATOM 1851 CD LYS B 26 91.089 -0.284 -8.961 1.00 0.00 C ATOM 1852 CE LYS B 26 91.921 0.049 -7.718 1.00 0.00 C ATOM 1853 NZ LYS B 26 93.367 -0.091 -8.044 1.00 0.00 N ATOM 0 H LYS B 26 87.277 -0.538 -9.539 1.00 0.00 H new ATOM 0 HA LYS B 26 87.123 0.017 -6.584 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.525 0.271 -6.692 1.00 0.00 H new ATOM 0 HB3 LYS B 26 89.127 -1.234 -7.497 1.00 0.00 H new ATOM 0 HG2 LYS B 26 89.096 0.099 -9.711 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.788 1.438 -8.817 1.00 0.00 H new ATOM 0 HD2 LYS B 26 90.996 -1.365 -9.069 1.00 0.00 H new ATOM 0 HD3 LYS B 26 91.592 0.083 -9.856 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.708 1.065 -7.385 1.00 0.00 H new ATOM 0 HE3 LYS B 26 91.655 -0.618 -6.898 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 93.936 0.134 -7.203 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 93.562 -1.068 -8.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 93.614 0.563 -8.814 1.00 0.00 H new ATOM 1867 N LEU B 27 86.976 2.491 -6.858 1.00 0.00 N ATOM 1868 CA LEU B 27 86.771 3.960 -7.060 1.00 0.00 C ATOM 1869 C LEU B 27 87.944 4.739 -6.457 1.00 0.00 C ATOM 1870 O LEU B 27 88.291 4.571 -5.305 1.00 0.00 O ATOM 1871 CB LEU B 27 85.481 4.373 -6.355 1.00 0.00 C ATOM 1872 CG LEU B 27 84.299 3.565 -6.905 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.042 3.919 -6.108 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.075 3.889 -8.393 1.00 0.00 C ATOM 0 H LEU B 27 86.769 2.153 -5.918 1.00 0.00 H new ATOM 0 HA LEU B 27 86.709 4.178 -8.126 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.575 4.209 -5.281 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.303 5.438 -6.501 1.00 0.00 H new ATOM 0 HG LEU B 27 84.515 2.501 -6.809 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.196 3.349 -6.492 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.197 3.675 -5.057 1.00 0.00 H new ATOM 0 HD13 LEU B 27 82.837 4.985 -6.207 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.233 3.308 -8.769 1.00 0.00 H new ATOM 0 HD22 LEU B 27 83.862 4.952 -8.506 1.00 0.00 H new ATOM 0 HD23 LEU B 27 84.972 3.637 -8.959 1.00 0.00 H new ATOM 1886 N LYS B 28 88.553 5.595 -7.235 1.00 0.00 N ATOM 1887 CA LYS B 28 89.708 6.405 -6.735 1.00 0.00 C ATOM 1888 C LYS B 28 89.199 7.775 -6.264 1.00 0.00 C ATOM 1889 O LYS B 28 88.068 8.141 -6.512 1.00 0.00 O ATOM 1890 CB LYS B 28 90.721 6.577 -7.867 1.00 0.00 C ATOM 1891 CG LYS B 28 91.362 5.219 -8.172 1.00 0.00 C ATOM 1892 CD LYS B 28 92.380 5.370 -9.304 1.00 0.00 C ATOM 1893 CE LYS B 28 92.991 4.004 -9.632 1.00 0.00 C ATOM 1894 NZ LYS B 28 93.844 3.549 -8.498 1.00 0.00 N ATOM 0 H LYS B 28 88.298 5.771 -8.207 1.00 0.00 H new ATOM 0 HA LYS B 28 90.189 5.899 -5.897 1.00 0.00 H new ATOM 0 HB2 LYS B 28 90.229 6.969 -8.757 1.00 0.00 H new ATOM 0 HB3 LYS B 28 91.486 7.299 -7.581 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.852 4.829 -7.280 1.00 0.00 H new ATOM 0 HG3 LYS B 28 90.594 4.499 -8.455 1.00 0.00 H new ATOM 0 HD2 LYS B 28 91.897 5.785 -10.188 1.00 0.00 H new ATOM 0 HD3 LYS B 28 93.163 6.069 -9.011 1.00 0.00 H new ATOM 0 HE2 LYS B 28 92.201 3.277 -9.819 1.00 0.00 H new ATOM 0 HE3 LYS B 28 93.586 4.070 -10.543 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 94.438 2.753 -8.808 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 94.451 4.333 -8.184 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 93.239 3.243 -7.710 1.00 0.00 H new ATOM 1908 N LYS B 29 90.009 8.521 -5.558 1.00 0.00 N ATOM 1909 CA LYS B 29 89.542 9.847 -5.047 1.00 0.00 C ATOM 1910 C LYS B 29 89.063 10.722 -6.209 1.00 0.00 C ATOM 1911 O LYS B 29 88.051 11.390 -6.111 1.00 0.00 O ATOM 1912 CB LYS B 29 90.699 10.545 -4.321 1.00 0.00 C ATOM 1913 CG LYS B 29 90.176 11.796 -3.608 1.00 0.00 C ATOM 1914 CD LYS B 29 91.259 12.361 -2.681 1.00 0.00 C ATOM 1915 CE LYS B 29 92.501 12.753 -3.487 1.00 0.00 C ATOM 1916 NZ LYS B 29 93.305 13.735 -2.703 1.00 0.00 N ATOM 0 H LYS B 29 90.968 8.273 -5.314 1.00 0.00 H new ATOM 0 HA LYS B 29 88.712 9.693 -4.357 1.00 0.00 H new ATOM 0 HB2 LYS B 29 91.152 9.865 -3.599 1.00 0.00 H new ATOM 0 HB3 LYS B 29 91.477 10.818 -5.034 1.00 0.00 H new ATOM 0 HG2 LYS B 29 89.885 12.548 -4.341 1.00 0.00 H new ATOM 0 HG3 LYS B 29 89.284 11.550 -3.032 1.00 0.00 H new ATOM 0 HD2 LYS B 29 90.874 13.231 -2.149 1.00 0.00 H new ATOM 0 HD3 LYS B 29 91.525 11.619 -1.928 1.00 0.00 H new ATOM 0 HE2 LYS B 29 93.099 11.869 -3.708 1.00 0.00 H new ATOM 0 HE3 LYS B 29 92.207 13.186 -4.443 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 93.289 14.658 -3.182 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 92.900 13.833 -1.750 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 94.287 13.400 -2.629 1.00 0.00 H new ATOM 1930 N SER B 30 89.756 10.715 -7.313 1.00 0.00 N ATOM 1931 CA SER B 30 89.304 11.538 -8.473 1.00 0.00 C ATOM 1932 C SER B 30 87.949 11.014 -8.952 1.00 0.00 C ATOM 1933 O SER B 30 87.087 11.763 -9.370 1.00 0.00 O ATOM 1934 CB SER B 30 90.320 11.433 -9.610 1.00 0.00 C ATOM 1935 OG SER B 30 90.420 10.078 -10.026 1.00 0.00 O ATOM 0 H SER B 30 90.611 10.179 -7.464 1.00 0.00 H new ATOM 0 HA SER B 30 89.215 12.581 -8.170 1.00 0.00 H new ATOM 0 HB2 SER B 30 90.013 12.061 -10.447 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.293 11.797 -9.279 1.00 0.00 H new ATOM 0 HG SER B 30 91.070 10.007 -10.756 1.00 0.00 H new ATOM 1941 N GLU B 31 87.759 9.728 -8.879 1.00 0.00 N ATOM 1942 CA GLU B 31 86.466 9.129 -9.314 1.00 0.00 C ATOM 1943 C GLU B 31 85.372 9.521 -8.316 1.00 0.00 C ATOM 1944 O GLU B 31 84.218 9.671 -8.669 1.00 0.00 O ATOM 1945 CB GLU B 31 86.590 7.604 -9.357 1.00 0.00 C ATOM 1946 CG GLU B 31 87.504 7.192 -10.514 1.00 0.00 C ATOM 1947 CD GLU B 31 87.653 5.669 -10.529 1.00 0.00 C ATOM 1948 OE1 GLU B 31 86.719 5.004 -10.945 1.00 0.00 O ATOM 1949 OE2 GLU B 31 88.699 5.192 -10.125 1.00 0.00 O ATOM 0 H GLU B 31 88.448 9.060 -8.534 1.00 0.00 H new ATOM 0 HA GLU B 31 86.211 9.496 -10.308 1.00 0.00 H new ATOM 0 HB2 GLU B 31 86.993 7.236 -8.414 1.00 0.00 H new ATOM 0 HB3 GLU B 31 85.605 7.153 -9.481 1.00 0.00 H new ATOM 0 HG2 GLU B 31 87.088 7.537 -11.461 1.00 0.00 H new ATOM 0 HG3 GLU B 31 88.481 7.663 -10.405 1.00 0.00 H new ATOM 1956 N LEU B 32 85.728 9.686 -7.070 1.00 0.00 N ATOM 1957 CA LEU B 32 84.712 10.066 -6.046 1.00 0.00 C ATOM 1958 C LEU B 32 84.253 11.509 -6.286 1.00 0.00 C ATOM 1959 O LEU B 32 83.085 11.827 -6.173 1.00 0.00 O ATOM 1960 CB LEU B 32 85.334 9.935 -4.649 1.00 0.00 C ATOM 1961 CG LEU B 32 84.318 10.317 -3.561 1.00 0.00 C ATOM 1962 CD1 LEU B 32 83.060 9.441 -3.671 1.00 0.00 C ATOM 1963 CD2 LEU B 32 84.967 10.108 -2.188 1.00 0.00 C ATOM 0 H LEU B 32 86.678 9.574 -6.717 1.00 0.00 H new ATOM 0 HA LEU B 32 83.848 9.406 -6.120 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.674 8.911 -4.492 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.212 10.577 -4.575 1.00 0.00 H new ATOM 0 HG LEU B 32 84.028 11.360 -3.688 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.350 9.724 -2.894 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.602 9.583 -4.650 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.334 8.393 -3.548 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.257 10.375 -1.405 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.253 9.062 -2.076 1.00 0.00 H new ATOM 0 HD23 LEU B 32 85.853 10.738 -2.105 1.00 0.00 H new ATOM 1975 N LYS B 33 85.163 12.383 -6.615 1.00 0.00 N ATOM 1976 CA LYS B 33 84.784 13.807 -6.863 1.00 0.00 C ATOM 1977 C LYS B 33 83.805 13.890 -8.039 1.00 0.00 C ATOM 1978 O LYS B 33 82.857 14.650 -8.018 1.00 0.00 O ATOM 1979 CB LYS B 33 86.044 14.620 -7.184 1.00 0.00 C ATOM 1980 CG LYS B 33 85.678 16.096 -7.380 1.00 0.00 C ATOM 1981 CD LYS B 33 86.948 16.903 -7.663 1.00 0.00 C ATOM 1982 CE LYS B 33 86.606 18.394 -7.748 1.00 0.00 C ATOM 1983 NZ LYS B 33 85.723 18.640 -8.922 1.00 0.00 N ATOM 0 H LYS B 33 86.156 12.174 -6.724 1.00 0.00 H new ATOM 0 HA LYS B 33 84.304 14.212 -5.972 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.767 14.520 -6.375 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.518 14.231 -8.085 1.00 0.00 H new ATOM 0 HG2 LYS B 33 84.976 16.201 -8.207 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.181 16.480 -6.489 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.681 16.733 -6.875 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.401 16.570 -8.597 1.00 0.00 H new ATOM 0 HE2 LYS B 33 86.109 18.716 -6.833 1.00 0.00 H new ATOM 0 HE3 LYS B 33 87.519 18.982 -7.838 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 85.644 19.664 -9.088 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 86.129 18.183 -9.763 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 84.779 18.246 -8.735 1.00 0.00 H new ATOM 1997 N GLU B 34 84.029 13.115 -9.065 1.00 0.00 N ATOM 1998 CA GLU B 34 83.113 13.154 -10.243 1.00 0.00 C ATOM 1999 C GLU B 34 81.702 12.739 -9.822 1.00 0.00 C ATOM 2000 O GLU B 34 80.723 13.367 -10.174 1.00 0.00 O ATOM 2001 CB GLU B 34 83.624 12.191 -11.318 1.00 0.00 C ATOM 2002 CG GLU B 34 84.914 12.742 -11.929 1.00 0.00 C ATOM 2003 CD GLU B 34 85.434 11.767 -12.988 1.00 0.00 C ATOM 2004 OE1 GLU B 34 84.819 10.728 -13.162 1.00 0.00 O ATOM 2005 OE2 GLU B 34 86.438 12.080 -13.609 1.00 0.00 O ATOM 0 H GLU B 34 84.805 12.457 -9.140 1.00 0.00 H new ATOM 0 HA GLU B 34 83.086 14.169 -10.640 1.00 0.00 H new ATOM 0 HB2 GLU B 34 83.806 11.208 -10.883 1.00 0.00 H new ATOM 0 HB3 GLU B 34 82.869 12.061 -12.093 1.00 0.00 H new ATOM 0 HG2 GLU B 34 84.729 13.718 -12.378 1.00 0.00 H new ATOM 0 HG3 GLU B 34 85.665 12.886 -11.152 1.00 0.00 H new ATOM 2012 N LEU B 35 81.596 11.676 -9.076 1.00 0.00 N ATOM 2013 CA LEU B 35 80.258 11.194 -8.630 1.00 0.00 C ATOM 2014 C LEU B 35 79.564 12.272 -7.793 1.00 0.00 C ATOM 2015 O LEU B 35 78.398 12.558 -7.977 1.00 0.00 O ATOM 2016 CB LEU B 35 80.448 9.916 -7.802 1.00 0.00 C ATOM 2017 CG LEU B 35 79.097 9.372 -7.313 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.208 8.996 -8.511 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.348 8.128 -6.449 1.00 0.00 C ATOM 0 H LEU B 35 82.385 11.115 -8.753 1.00 0.00 H new ATOM 0 HA LEU B 35 79.632 10.980 -9.496 1.00 0.00 H new ATOM 0 HB2 LEU B 35 80.952 9.160 -8.404 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.091 10.124 -6.947 1.00 0.00 H new ATOM 0 HG LEU B 35 78.588 10.139 -6.728 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.254 8.612 -8.150 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.034 9.879 -9.126 1.00 0.00 H new ATOM 0 HD13 LEU B 35 78.705 8.230 -9.107 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.396 7.732 -6.096 1.00 0.00 H new ATOM 0 HD22 LEU B 35 79.858 7.370 -7.043 1.00 0.00 H new ATOM 0 HD23 LEU B 35 79.968 8.398 -5.594 1.00 0.00 H new ATOM 2031 N ILE B 36 80.269 12.872 -6.872 1.00 0.00 N ATOM 2032 CA ILE B 36 79.639 13.926 -6.028 1.00 0.00 C ATOM 2033 C ILE B 36 79.178 15.084 -6.915 1.00 0.00 C ATOM 2034 O ILE B 36 78.111 15.626 -6.738 1.00 0.00 O ATOM 2035 CB ILE B 36 80.653 14.439 -5.000 1.00 0.00 C ATOM 2036 CG1 ILE B 36 81.000 13.308 -4.026 1.00 0.00 C ATOM 2037 CG2 ILE B 36 80.049 15.615 -4.226 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.171 13.731 -3.137 1.00 0.00 C ATOM 0 H ILE B 36 81.250 12.679 -6.669 1.00 0.00 H new ATOM 0 HA ILE B 36 78.780 13.504 -5.506 1.00 0.00 H new ATOM 0 HB ILE B 36 81.556 14.771 -5.512 1.00 0.00 H new ATOM 0 HG12 ILE B 36 80.133 13.067 -3.411 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.259 12.406 -4.580 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.771 15.979 -3.495 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.799 16.418 -4.920 1.00 0.00 H new ATOM 0 HG23 ILE B 36 79.146 15.286 -3.711 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.414 12.923 -2.446 1.00 0.00 H new ATOM 0 HD12 ILE B 36 83.039 13.950 -3.759 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.896 14.621 -2.572 1.00 0.00 H new ATOM 2050 N ASN B 37 79.978 15.474 -7.861 1.00 0.00 N ATOM 2051 CA ASN B 37 79.585 16.605 -8.748 1.00 0.00 C ATOM 2052 C ASN B 37 78.434 16.200 -9.674 1.00 0.00 C ATOM 2053 O ASN B 37 77.550 16.985 -9.951 1.00 0.00 O ATOM 2054 CB ASN B 37 80.786 17.022 -9.597 1.00 0.00 C ATOM 2055 CG ASN B 37 81.832 17.694 -8.706 1.00 0.00 C ATOM 2056 OD1 ASN B 37 83.014 17.446 -8.843 1.00 0.00 O ATOM 2057 ND2 ASN B 37 81.443 18.544 -7.794 1.00 0.00 N ATOM 0 H ASN B 37 80.889 15.060 -8.061 1.00 0.00 H new ATOM 0 HA ASN B 37 79.255 17.435 -8.123 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.218 16.150 -10.089 1.00 0.00 H new ATOM 0 HB3 ASN B 37 80.469 17.707 -10.383 1.00 0.00 H new ATOM 0 HD21 ASN B 37 82.131 19.001 -7.196 1.00 0.00 H new ATOM 0 HD22 ASN B 37 80.451 18.751 -7.680 1.00 0.00 H new ATOM 2064 N ASN B 38 78.457 15.004 -10.195 1.00 0.00 N ATOM 2065 CA ASN B 38 77.386 14.587 -11.146 1.00 0.00 C ATOM 2066 C ASN B 38 76.063 14.250 -10.436 1.00 0.00 C ATOM 2067 O ASN B 38 75.028 14.794 -10.762 1.00 0.00 O ATOM 2068 CB ASN B 38 77.872 13.356 -11.915 1.00 0.00 C ATOM 2069 CG ASN B 38 76.865 12.999 -13.008 1.00 0.00 C ATOM 2070 OD1 ASN B 38 76.433 13.854 -13.755 1.00 0.00 O ATOM 2071 ND2 ASN B 38 76.476 11.760 -13.138 1.00 0.00 N ATOM 0 H ASN B 38 79.169 14.299 -10.005 1.00 0.00 H new ATOM 0 HA ASN B 38 77.188 15.423 -11.817 1.00 0.00 H new ATOM 0 HB2 ASN B 38 78.848 13.554 -12.358 1.00 0.00 H new ATOM 0 HB3 ASN B 38 77.996 12.515 -11.233 1.00 0.00 H new ATOM 0 HD21 ASN B 38 75.809 11.509 -13.867 1.00 0.00 H new ATOM 0 HD22 ASN B 38 76.839 11.043 -12.510 1.00 0.00 H new ATOM 2078 N GLU B 39 76.069 13.315 -9.522 1.00 0.00 N ATOM 2079 CA GLU B 39 74.783 12.907 -8.866 1.00 0.00 C ATOM 2080 C GLU B 39 74.405 13.813 -7.686 1.00 0.00 C ATOM 2081 O GLU B 39 73.773 14.837 -7.852 1.00 0.00 O ATOM 2082 CB GLU B 39 74.914 11.471 -8.360 1.00 0.00 C ATOM 2083 CG GLU B 39 74.981 10.514 -9.551 1.00 0.00 C ATOM 2084 CD GLU B 39 75.118 9.079 -9.043 1.00 0.00 C ATOM 2085 OE1 GLU B 39 75.227 8.906 -7.842 1.00 0.00 O ATOM 2086 OE2 GLU B 39 75.111 8.177 -9.864 1.00 0.00 O ATOM 0 H GLU B 39 76.900 12.818 -9.201 1.00 0.00 H new ATOM 0 HA GLU B 39 73.996 12.995 -9.615 1.00 0.00 H new ATOM 0 HB2 GLU B 39 75.810 11.370 -7.748 1.00 0.00 H new ATOM 0 HB3 GLU B 39 74.065 11.219 -7.725 1.00 0.00 H new ATOM 0 HG2 GLU B 39 74.083 10.611 -10.161 1.00 0.00 H new ATOM 0 HG3 GLU B 39 75.828 10.768 -10.188 1.00 0.00 H new ATOM 2093 N LEU B 40 74.739 13.409 -6.488 1.00 0.00 N ATOM 2094 CA LEU B 40 74.351 14.207 -5.286 1.00 0.00 C ATOM 2095 C LEU B 40 74.974 15.604 -5.332 1.00 0.00 C ATOM 2096 O LEU B 40 76.158 15.763 -5.519 1.00 0.00 O ATOM 2097 CB LEU B 40 74.832 13.473 -4.029 1.00 0.00 C ATOM 2098 CG LEU B 40 74.144 12.100 -3.926 1.00 0.00 C ATOM 2099 CD1 LEU B 40 74.820 11.279 -2.825 1.00 0.00 C ATOM 2100 CD2 LEU B 40 72.650 12.272 -3.591 1.00 0.00 C ATOM 0 H LEU B 40 75.265 12.558 -6.289 1.00 0.00 H new ATOM 0 HA LEU B 40 73.267 14.318 -5.270 1.00 0.00 H new ATOM 0 HB2 LEU B 40 75.914 13.345 -4.064 1.00 0.00 H new ATOM 0 HB3 LEU B 40 74.610 14.068 -3.143 1.00 0.00 H new ATOM 0 HG LEU B 40 74.233 11.586 -4.883 1.00 0.00 H new ATOM 0 HD11 LEU B 40 74.336 10.305 -2.748 1.00 0.00 H new ATOM 0 HD12 LEU B 40 75.874 11.142 -3.068 1.00 0.00 H new ATOM 0 HD13 LEU B 40 74.732 11.804 -1.874 1.00 0.00 H new ATOM 0 HD21 LEU B 40 72.178 11.292 -3.522 1.00 0.00 H new ATOM 0 HD22 LEU B 40 72.548 12.792 -2.639 1.00 0.00 H new ATOM 0 HD23 LEU B 40 72.166 12.853 -4.376 1.00 0.00 H new ATOM 2112 N SER B 41 74.172 16.621 -5.145 1.00 0.00 N ATOM 2113 CA SER B 41 74.698 18.019 -5.160 1.00 0.00 C ATOM 2114 C SER B 41 73.880 18.872 -4.189 1.00 0.00 C ATOM 2115 O SER B 41 74.418 19.577 -3.359 1.00 0.00 O ATOM 2116 CB SER B 41 74.572 18.598 -6.571 1.00 0.00 C ATOM 2117 OG SER B 41 75.391 17.852 -7.461 1.00 0.00 O ATOM 0 H SER B 41 73.168 16.542 -4.981 1.00 0.00 H new ATOM 0 HA SER B 41 75.746 18.019 -4.860 1.00 0.00 H new ATOM 0 HB2 SER B 41 73.533 18.563 -6.899 1.00 0.00 H new ATOM 0 HB3 SER B 41 74.872 19.646 -6.574 1.00 0.00 H new ATOM 0 HG SER B 41 75.311 18.220 -8.366 1.00 0.00 H new ATOM 2123 N HIS B 42 72.581 18.811 -4.291 1.00 0.00 N ATOM 2124 CA HIS B 42 71.711 19.610 -3.382 1.00 0.00 C ATOM 2125 C HIS B 42 71.770 19.035 -1.961 1.00 0.00 C ATOM 2126 O HIS B 42 71.430 19.699 -1.002 1.00 0.00 O ATOM 2127 CB HIS B 42 70.269 19.563 -3.890 1.00 0.00 C ATOM 2128 CG HIS B 42 70.159 20.351 -5.168 1.00 0.00 C ATOM 2129 ND1 HIS B 42 70.058 21.736 -5.182 1.00 0.00 N ATOM 2130 CD2 HIS B 42 70.131 19.960 -6.484 1.00 0.00 C ATOM 2131 CE1 HIS B 42 69.973 22.124 -6.469 1.00 0.00 C ATOM 2132 NE2 HIS B 42 70.013 21.082 -7.299 1.00 0.00 N ATOM 0 H HIS B 42 72.081 18.237 -4.970 1.00 0.00 H new ATOM 0 HA HIS B 42 72.062 20.642 -3.365 1.00 0.00 H new ATOM 0 HB2 HIS B 42 69.966 18.530 -4.060 1.00 0.00 H new ATOM 0 HB3 HIS B 42 69.594 19.973 -3.139 1.00 0.00 H new ATOM 0 HD2 HIS B 42 70.191 18.940 -6.833 1.00 0.00 H new ATOM 0 HE1 HIS B 42 69.884 23.152 -6.789 1.00 0.00 H new ATOM 0 HE2 HIS B 42 69.967 21.103 -8.318 1.00 0.00 H new ATOM 2141 N PHE B 43 72.179 17.798 -1.819 1.00 0.00 N ATOM 2142 CA PHE B 43 72.235 17.168 -0.459 1.00 0.00 C ATOM 2143 C PHE B 43 73.665 17.212 0.083 1.00 0.00 C ATOM 2144 O PHE B 43 73.937 16.740 1.169 1.00 0.00 O ATOM 2145 CB PHE B 43 71.782 15.708 -0.550 1.00 0.00 C ATOM 2146 CG PHE B 43 70.316 15.652 -0.905 1.00 0.00 C ATOM 2147 CD1 PHE B 43 69.349 15.670 0.108 1.00 0.00 C ATOM 2148 CD2 PHE B 43 69.923 15.578 -2.246 1.00 0.00 C ATOM 2149 CE1 PHE B 43 67.989 15.615 -0.221 1.00 0.00 C ATOM 2150 CE2 PHE B 43 68.563 15.524 -2.575 1.00 0.00 C ATOM 2151 CZ PHE B 43 67.597 15.542 -1.563 1.00 0.00 C ATOM 0 H PHE B 43 72.477 17.195 -2.586 1.00 0.00 H new ATOM 0 HA PHE B 43 71.576 17.721 0.211 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.369 15.181 -1.303 1.00 0.00 H new ATOM 0 HB3 PHE B 43 71.956 15.203 0.400 1.00 0.00 H new ATOM 0 HD1 PHE B 43 69.652 15.726 1.143 1.00 0.00 H new ATOM 0 HD2 PHE B 43 70.669 15.563 -3.027 1.00 0.00 H new ATOM 0 HE1 PHE B 43 67.243 15.629 0.560 1.00 0.00 H new ATOM 0 HE2 PHE B 43 68.260 15.468 -3.610 1.00 0.00 H new ATOM 0 HZ PHE B 43 66.548 15.500 -1.817 1.00 0.00 H new ATOM 2161 N LEU B 44 74.581 17.774 -0.664 1.00 0.00 N ATOM 2162 CA LEU B 44 76.003 17.855 -0.198 1.00 0.00 C ATOM 2163 C LEU B 44 76.527 19.276 -0.405 1.00 0.00 C ATOM 2164 O LEU B 44 76.101 19.985 -1.295 1.00 0.00 O ATOM 2165 CB LEU B 44 76.859 16.875 -1.004 1.00 0.00 C ATOM 2166 CG LEU B 44 76.362 15.438 -0.775 1.00 0.00 C ATOM 2167 CD1 LEU B 44 77.061 14.492 -1.758 1.00 0.00 C ATOM 2168 CD2 LEU B 44 76.669 14.991 0.666 1.00 0.00 C ATOM 0 H LEU B 44 74.406 18.183 -1.582 1.00 0.00 H new ATOM 0 HA LEU B 44 76.054 17.599 0.860 1.00 0.00 H new ATOM 0 HB2 LEU B 44 76.809 17.122 -2.065 1.00 0.00 H new ATOM 0 HB3 LEU B 44 77.904 16.960 -0.705 1.00 0.00 H new ATOM 0 HG LEU B 44 75.284 15.408 -0.935 1.00 0.00 H new ATOM 0 HD11 LEU B 44 76.709 13.473 -1.596 1.00 0.00 H new ATOM 0 HD12 LEU B 44 76.834 14.796 -2.780 1.00 0.00 H new ATOM 0 HD13 LEU B 44 78.139 14.533 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU B 44 76.312 13.972 0.815 1.00 0.00 H new ATOM 0 HD22 LEU B 44 77.745 15.027 0.837 1.00 0.00 H new ATOM 0 HD23 LEU B 44 76.168 15.657 1.368 1.00 0.00 H new ATOM 2180 N GLU B 45 77.455 19.693 0.411 1.00 0.00 N ATOM 2181 CA GLU B 45 78.018 21.062 0.263 1.00 0.00 C ATOM 2182 C GLU B 45 78.998 21.063 -0.911 1.00 0.00 C ATOM 2183 O GLU B 45 79.690 20.095 -1.149 1.00 0.00 O ATOM 2184 CB GLU B 45 78.756 21.452 1.547 1.00 0.00 C ATOM 2185 CG GLU B 45 77.753 21.645 2.686 1.00 0.00 C ATOM 2186 CD GLU B 45 76.876 22.867 2.401 1.00 0.00 C ATOM 2187 OE1 GLU B 45 77.285 23.691 1.600 1.00 0.00 O ATOM 2188 OE2 GLU B 45 75.809 22.956 2.987 1.00 0.00 O ATOM 0 H GLU B 45 77.848 19.143 1.175 1.00 0.00 H new ATOM 0 HA GLU B 45 77.217 21.778 0.080 1.00 0.00 H new ATOM 0 HB2 GLU B 45 79.476 20.678 1.812 1.00 0.00 H new ATOM 0 HB3 GLU B 45 79.320 22.371 1.388 1.00 0.00 H new ATOM 0 HG2 GLU B 45 77.131 20.756 2.790 1.00 0.00 H new ATOM 0 HG3 GLU B 45 78.281 21.777 3.630 1.00 0.00 H new ATOM 2195 N GLU B 46 79.065 22.135 -1.652 1.00 0.00 N ATOM 2196 CA GLU B 46 80.008 22.166 -2.804 1.00 0.00 C ATOM 2197 C GLU B 46 81.443 22.060 -2.282 1.00 0.00 C ATOM 2198 O GLU B 46 81.794 22.636 -1.271 1.00 0.00 O ATOM 2199 CB GLU B 46 79.827 23.471 -3.585 1.00 0.00 C ATOM 2200 CG GLU B 46 80.041 24.668 -2.657 1.00 0.00 C ATOM 2201 CD GLU B 46 79.858 25.965 -3.448 1.00 0.00 C ATOM 2202 OE1 GLU B 46 79.917 25.907 -4.665 1.00 0.00 O ATOM 2203 OE2 GLU B 46 79.660 26.994 -2.823 1.00 0.00 O ATOM 0 H GLU B 46 78.514 22.982 -1.512 1.00 0.00 H new ATOM 0 HA GLU B 46 79.803 21.327 -3.470 1.00 0.00 H new ATOM 0 HB2 GLU B 46 80.535 23.511 -4.413 1.00 0.00 H new ATOM 0 HB3 GLU B 46 78.828 23.510 -4.018 1.00 0.00 H new ATOM 0 HG2 GLU B 46 79.333 24.631 -1.829 1.00 0.00 H new ATOM 0 HG3 GLU B 46 81.040 24.632 -2.223 1.00 0.00 H new ATOM 2210 N ILE B 47 82.270 21.310 -2.961 1.00 0.00 N ATOM 2211 CA ILE B 47 83.685 21.137 -2.515 1.00 0.00 C ATOM 2212 C ILE B 47 84.590 22.085 -3.303 1.00 0.00 C ATOM 2213 O ILE B 47 84.645 22.037 -4.516 1.00 0.00 O ATOM 2214 CB ILE B 47 84.102 19.685 -2.766 1.00 0.00 C ATOM 2215 CG1 ILE B 47 83.204 18.762 -1.933 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.565 19.481 -2.367 1.00 0.00 C ATOM 2217 CD1 ILE B 47 83.439 17.308 -2.338 1.00 0.00 C ATOM 0 H ILE B 47 82.024 20.805 -3.813 1.00 0.00 H new ATOM 0 HA ILE B 47 83.775 21.368 -1.454 1.00 0.00 H new ATOM 0 HB ILE B 47 83.994 19.452 -3.825 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.417 18.893 -0.872 1.00 0.00 H new ATOM 0 HG13 ILE B 47 82.157 19.026 -2.083 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.851 18.445 -2.550 1.00 0.00 H new ATOM 0 HG22 ILE B 47 86.199 20.142 -2.958 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.689 19.710 -1.309 1.00 0.00 H new ATOM 0 HD11 ILE B 47 82.799 16.657 -1.743 1.00 0.00 H new ATOM 0 HD12 ILE B 47 83.203 17.182 -3.395 1.00 0.00 H new ATOM 0 HD13 ILE B 47 84.483 17.046 -2.165 1.00 0.00 H new ATOM 2229 N LYS B 48 85.296 22.956 -2.621 1.00 0.00 N ATOM 2230 CA LYS B 48 86.196 23.923 -3.326 1.00 0.00 C ATOM 2231 C LYS B 48 87.659 23.478 -3.195 1.00 0.00 C ATOM 2232 O LYS B 48 88.471 23.766 -4.053 1.00 0.00 O ATOM 2233 CB LYS B 48 86.020 25.312 -2.699 1.00 0.00 C ATOM 2234 CG LYS B 48 86.765 26.357 -3.532 1.00 0.00 C ATOM 2235 CD LYS B 48 86.582 27.738 -2.897 1.00 0.00 C ATOM 2236 CE LYS B 48 87.372 28.778 -3.693 1.00 0.00 C ATOM 2237 NZ LYS B 48 88.810 28.391 -3.718 1.00 0.00 N ATOM 0 H LYS B 48 85.287 23.039 -1.604 1.00 0.00 H new ATOM 0 HA LYS B 48 85.936 23.956 -4.384 1.00 0.00 H new ATOM 0 HB2 LYS B 48 84.961 25.565 -2.645 1.00 0.00 H new ATOM 0 HB3 LYS B 48 86.400 25.310 -1.677 1.00 0.00 H new ATOM 0 HG2 LYS B 48 87.825 26.107 -3.586 1.00 0.00 H new ATOM 0 HG3 LYS B 48 86.386 26.361 -4.554 1.00 0.00 H new ATOM 0 HD2 LYS B 48 85.525 28.004 -2.880 1.00 0.00 H new ATOM 0 HD3 LYS B 48 86.923 27.722 -1.862 1.00 0.00 H new ATOM 0 HE2 LYS B 48 86.984 28.846 -4.709 1.00 0.00 H new ATOM 0 HE3 LYS B 48 87.257 29.763 -3.241 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 89.391 29.227 -3.929 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 89.082 28.005 -2.791 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 88.963 27.670 -4.452 1.00 0.00 H new ATOM 2251 N GLU B 49 88.005 22.779 -2.133 1.00 0.00 N ATOM 2252 CA GLU B 49 89.427 22.314 -1.949 1.00 0.00 C ATOM 2253 C GLU B 49 89.482 20.782 -1.847 1.00 0.00 C ATOM 2254 O GLU B 49 88.712 20.167 -1.137 1.00 0.00 O ATOM 2255 CB GLU B 49 90.002 22.921 -0.666 1.00 0.00 C ATOM 2256 CG GLU B 49 91.494 22.588 -0.579 1.00 0.00 C ATOM 2257 CD GLU B 49 92.094 23.217 0.680 1.00 0.00 C ATOM 2258 OE1 GLU B 49 91.390 23.963 1.341 1.00 0.00 O ATOM 2259 OE2 GLU B 49 93.250 22.944 0.960 1.00 0.00 O ATOM 0 H GLU B 49 87.365 22.510 -1.385 1.00 0.00 H new ATOM 0 HA GLU B 49 90.013 22.636 -2.810 1.00 0.00 H new ATOM 0 HB2 GLU B 49 89.857 24.001 -0.663 1.00 0.00 H new ATOM 0 HB3 GLU B 49 89.477 22.527 0.204 1.00 0.00 H new ATOM 0 HG2 GLU B 49 91.634 21.507 -0.558 1.00 0.00 H new ATOM 0 HG3 GLU B 49 92.011 22.960 -1.464 1.00 0.00 H new ATOM 2266 N GLN B 50 90.404 20.169 -2.547 1.00 0.00 N ATOM 2267 CA GLN B 50 90.541 18.680 -2.495 1.00 0.00 C ATOM 2268 C GLN B 50 90.862 18.236 -1.062 1.00 0.00 C ATOM 2269 O GLN B 50 90.391 17.220 -0.593 1.00 0.00 O ATOM 2270 CB GLN B 50 91.669 18.235 -3.433 1.00 0.00 C ATOM 2271 CG GLN B 50 91.221 18.372 -4.892 1.00 0.00 C ATOM 2272 CD GLN B 50 91.107 19.852 -5.255 1.00 0.00 C ATOM 2273 OE1 GLN B 50 92.101 20.543 -5.362 1.00 0.00 O ATOM 2274 NE2 GLN B 50 89.927 20.372 -5.457 1.00 0.00 N ATOM 0 H GLN B 50 91.073 20.640 -3.157 1.00 0.00 H new ATOM 0 HA GLN B 50 89.603 18.223 -2.811 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.558 18.840 -3.259 1.00 0.00 H new ATOM 0 HB3 GLN B 50 91.941 17.201 -3.223 1.00 0.00 H new ATOM 0 HG2 GLN B 50 91.936 17.879 -5.551 1.00 0.00 H new ATOM 0 HG3 GLN B 50 90.261 17.876 -5.037 1.00 0.00 H new ATOM 0 HE21 GLN B 50 89.092 19.793 -5.367 1.00 0.00 H new ATOM 0 HE22 GLN B 50 89.840 21.358 -5.704 1.00 0.00 H new ATOM 2283 N GLU B 51 91.678 18.990 -0.377 1.00 0.00 N ATOM 2284 CA GLU B 51 92.055 18.618 1.022 1.00 0.00 C ATOM 2285 C GLU B 51 90.793 18.222 1.795 1.00 0.00 C ATOM 2286 O GLU B 51 90.823 17.365 2.655 1.00 0.00 O ATOM 2287 CB GLU B 51 92.725 19.812 1.710 1.00 0.00 C ATOM 2288 CG GLU B 51 93.156 19.421 3.127 1.00 0.00 C ATOM 2289 CD GLU B 51 93.825 20.618 3.806 1.00 0.00 C ATOM 2290 OE1 GLU B 51 94.059 21.604 3.127 1.00 0.00 O ATOM 2291 OE2 GLU B 51 94.085 20.531 4.995 1.00 0.00 O ATOM 0 H GLU B 51 92.102 19.850 -0.724 1.00 0.00 H new ATOM 0 HA GLU B 51 92.751 17.779 1.002 1.00 0.00 H new ATOM 0 HB2 GLU B 51 93.591 20.136 1.133 1.00 0.00 H new ATOM 0 HB3 GLU B 51 92.035 20.655 1.750 1.00 0.00 H new ATOM 0 HG2 GLU B 51 92.291 19.098 3.706 1.00 0.00 H new ATOM 0 HG3 GLU B 51 93.846 18.578 3.089 1.00 0.00 H new ATOM 2298 N VAL B 52 89.683 18.823 1.475 1.00 0.00 N ATOM 2299 CA VAL B 52 88.410 18.470 2.168 1.00 0.00 C ATOM 2300 C VAL B 52 88.022 17.036 1.791 1.00 0.00 C ATOM 2301 O VAL B 52 87.453 16.304 2.577 1.00 0.00 O ATOM 2302 CB VAL B 52 87.302 19.437 1.734 1.00 0.00 C ATOM 2303 CG1 VAL B 52 85.942 18.938 2.242 1.00 0.00 C ATOM 2304 CG2 VAL B 52 87.588 20.824 2.315 1.00 0.00 C ATOM 0 H VAL B 52 89.600 19.547 0.761 1.00 0.00 H new ATOM 0 HA VAL B 52 88.543 18.544 3.247 1.00 0.00 H new ATOM 0 HB VAL B 52 87.276 19.491 0.646 1.00 0.00 H new ATOM 0 HG11 VAL B 52 85.160 19.631 1.929 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.739 17.951 1.828 1.00 0.00 H new ATOM 0 HG13 VAL B 52 85.960 18.878 3.330 1.00 0.00 H new ATOM 0 HG21 VAL B 52 86.803 21.516 2.009 1.00 0.00 H new ATOM 0 HG22 VAL B 52 87.615 20.764 3.403 1.00 0.00 H new ATOM 0 HG23 VAL B 52 88.550 21.181 1.947 1.00 0.00 H new ATOM 2314 N VAL B 53 88.340 16.634 0.591 1.00 0.00 N ATOM 2315 CA VAL B 53 88.007 15.249 0.151 1.00 0.00 C ATOM 2316 C VAL B 53 88.858 14.254 0.936 1.00 0.00 C ATOM 2317 O VAL B 53 88.398 13.207 1.344 1.00 0.00 O ATOM 2318 CB VAL B 53 88.312 15.103 -1.345 1.00 0.00 C ATOM 2319 CG1 VAL B 53 88.019 13.671 -1.809 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.440 16.075 -2.134 1.00 0.00 C ATOM 0 H VAL B 53 88.817 17.206 -0.106 1.00 0.00 H new ATOM 0 HA VAL B 53 86.950 15.053 0.330 1.00 0.00 H new ATOM 0 HB VAL B 53 89.366 15.324 -1.516 1.00 0.00 H new ATOM 0 HG11 VAL B 53 88.240 13.581 -2.873 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.641 12.973 -1.249 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.968 13.440 -1.636 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.654 15.974 -3.198 1.00 0.00 H new ATOM 0 HG22 VAL B 53 86.389 15.851 -1.952 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.653 17.096 -1.816 1.00 0.00 H new ATOM 2330 N ASP B 54 90.105 14.570 1.132 1.00 0.00 N ATOM 2331 CA ASP B 54 91.003 13.639 1.866 1.00 0.00 C ATOM 2332 C ASP B 54 90.463 13.406 3.277 1.00 0.00 C ATOM 2333 O ASP B 54 90.476 12.300 3.782 1.00 0.00 O ATOM 2334 CB ASP B 54 92.402 14.250 1.940 1.00 0.00 C ATOM 2335 CG ASP B 54 93.029 14.244 0.545 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.563 13.484 -0.289 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.957 15.004 0.330 1.00 0.00 O ATOM 0 H ASP B 54 90.543 15.435 0.815 1.00 0.00 H new ATOM 0 HA ASP B 54 91.049 12.684 1.343 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.347 15.269 2.322 1.00 0.00 H new ATOM 0 HB3 ASP B 54 93.023 13.683 2.633 1.00 0.00 H new ATOM 2342 N LYS B 55 89.969 14.432 3.912 1.00 0.00 N ATOM 2343 CA LYS B 55 89.412 14.253 5.282 1.00 0.00 C ATOM 2344 C LYS B 55 88.232 13.284 5.214 1.00 0.00 C ATOM 2345 O LYS B 55 88.066 12.421 6.053 1.00 0.00 O ATOM 2346 CB LYS B 55 88.926 15.601 5.826 1.00 0.00 C ATOM 2347 CG LYS B 55 88.503 15.435 7.292 1.00 0.00 C ATOM 2348 CD LYS B 55 87.995 16.772 7.861 1.00 0.00 C ATOM 2349 CE LYS B 55 89.174 17.654 8.295 1.00 0.00 C ATOM 2350 NZ LYS B 55 90.003 16.924 9.296 1.00 0.00 N ATOM 0 H LYS B 55 89.927 15.382 3.544 1.00 0.00 H new ATOM 0 HA LYS B 55 90.185 13.858 5.941 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.719 16.345 5.746 1.00 0.00 H new ATOM 0 HB3 LYS B 55 88.087 15.964 5.233 1.00 0.00 H new ATOM 0 HG2 LYS B 55 87.720 14.680 7.368 1.00 0.00 H new ATOM 0 HG3 LYS B 55 89.347 15.079 7.882 1.00 0.00 H new ATOM 0 HD2 LYS B 55 87.402 17.292 7.109 1.00 0.00 H new ATOM 0 HD3 LYS B 55 87.339 16.586 8.712 1.00 0.00 H new ATOM 0 HE2 LYS B 55 89.781 17.919 7.429 1.00 0.00 H new ATOM 0 HE3 LYS B 55 88.806 18.586 8.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 90.238 17.562 10.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 89.470 16.108 9.659 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 90.880 16.593 8.845 1.00 0.00 H new ATOM 2364 N VAL B 56 87.403 13.438 4.218 1.00 0.00 N ATOM 2365 CA VAL B 56 86.214 12.551 4.078 1.00 0.00 C ATOM 2366 C VAL B 56 86.650 11.124 3.729 1.00 0.00 C ATOM 2367 O VAL B 56 86.113 10.160 4.237 1.00 0.00 O ATOM 2368 CB VAL B 56 85.318 13.104 2.961 1.00 0.00 C ATOM 2369 CG1 VAL B 56 84.206 12.101 2.631 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.700 14.427 3.418 1.00 0.00 C ATOM 0 H VAL B 56 87.500 14.146 3.490 1.00 0.00 H new ATOM 0 HA VAL B 56 85.668 12.524 5.021 1.00 0.00 H new ATOM 0 HB VAL B 56 85.919 13.269 2.067 1.00 0.00 H new ATOM 0 HG11 VAL B 56 83.577 12.504 1.837 1.00 0.00 H new ATOM 0 HG12 VAL B 56 84.650 11.162 2.301 1.00 0.00 H new ATOM 0 HG13 VAL B 56 83.600 11.924 3.520 1.00 0.00 H new ATOM 0 HG21 VAL B 56 84.063 14.823 2.627 1.00 0.00 H new ATOM 0 HG22 VAL B 56 84.104 14.259 4.315 1.00 0.00 H new ATOM 0 HG23 VAL B 56 85.493 15.142 3.638 1.00 0.00 H new ATOM 2380 N MET B 57 87.605 10.983 2.855 1.00 0.00 N ATOM 2381 CA MET B 57 88.062 9.619 2.461 1.00 0.00 C ATOM 2382 C MET B 57 88.644 8.891 3.669 1.00 0.00 C ATOM 2383 O MET B 57 88.400 7.718 3.878 1.00 0.00 O ATOM 2384 CB MET B 57 89.134 9.747 1.381 1.00 0.00 C ATOM 2385 CG MET B 57 88.493 10.270 0.096 1.00 0.00 C ATOM 2386 SD MET B 57 87.448 8.982 -0.633 1.00 0.00 S ATOM 2387 CE MET B 57 88.766 7.906 -1.262 1.00 0.00 C ATOM 0 H MET B 57 88.091 11.753 2.395 1.00 0.00 H new ATOM 0 HA MET B 57 87.214 9.050 2.080 1.00 0.00 H new ATOM 0 HB2 MET B 57 89.921 10.425 1.711 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.602 8.780 1.200 1.00 0.00 H new ATOM 0 HG2 MET B 57 87.897 11.157 0.310 1.00 0.00 H new ATOM 0 HG3 MET B 57 89.266 10.569 -0.612 1.00 0.00 H new ATOM 0 HE1 MET B 57 88.387 7.317 -2.097 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.604 8.516 -1.599 1.00 0.00 H new ATOM 0 HE3 MET B 57 89.100 7.238 -0.468 1.00 0.00 H new ATOM 2397 N GLU B 58 89.411 9.573 4.465 1.00 0.00 N ATOM 2398 CA GLU B 58 90.006 8.913 5.658 1.00 0.00 C ATOM 2399 C GLU B 58 88.876 8.408 6.551 1.00 0.00 C ATOM 2400 O GLU B 58 88.909 7.301 7.053 1.00 0.00 O ATOM 2401 CB GLU B 58 90.863 9.924 6.423 1.00 0.00 C ATOM 2402 CG GLU B 58 91.646 9.210 7.526 1.00 0.00 C ATOM 2403 CD GLU B 58 92.717 8.319 6.892 1.00 0.00 C ATOM 2404 OE1 GLU B 58 93.024 8.531 5.729 1.00 0.00 O ATOM 2405 OE2 GLU B 58 93.209 7.437 7.577 1.00 0.00 O ATOM 0 H GLU B 58 89.653 10.557 4.344 1.00 0.00 H new ATOM 0 HA GLU B 58 90.634 8.076 5.352 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.551 10.422 5.740 1.00 0.00 H new ATOM 0 HB3 GLU B 58 90.229 10.697 6.857 1.00 0.00 H new ATOM 0 HG2 GLU B 58 92.110 9.940 8.189 1.00 0.00 H new ATOM 0 HG3 GLU B 58 90.971 8.609 8.136 1.00 0.00 H new ATOM 2412 N THR B 59 87.872 9.213 6.747 1.00 0.00 N ATOM 2413 CA THR B 59 86.725 8.791 7.598 1.00 0.00 C ATOM 2414 C THR B 59 85.909 7.701 6.904 1.00 0.00 C ATOM 2415 O THR B 59 85.438 6.772 7.529 1.00 0.00 O ATOM 2416 CB THR B 59 85.816 9.995 7.865 1.00 0.00 C ATOM 2417 OG1 THR B 59 86.553 11.007 8.536 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.623 9.559 8.721 1.00 0.00 C ATOM 0 H THR B 59 87.795 10.151 6.353 1.00 0.00 H new ATOM 0 HA THR B 59 87.118 8.399 8.536 1.00 0.00 H new ATOM 0 HB THR B 59 85.448 10.391 6.918 1.00 0.00 H new ATOM 0 HG1 THR B 59 87.071 11.522 7.883 1.00 0.00 H new ATOM 0 HG21 THR B 59 83.978 10.417 8.910 1.00 0.00 H new ATOM 0 HG22 THR B 59 84.059 8.790 8.194 1.00 0.00 H new ATOM 0 HG23 THR B 59 84.982 9.160 9.669 1.00 0.00 H new ATOM 2426 N LEU B 60 85.709 7.822 5.621 1.00 0.00 N ATOM 2427 CA LEU B 60 84.892 6.809 4.895 1.00 0.00 C ATOM 2428 C LEU B 60 85.623 5.469 4.796 1.00 0.00 C ATOM 2429 O LEU B 60 85.036 4.423 4.989 1.00 0.00 O ATOM 2430 CB LEU B 60 84.571 7.338 3.491 1.00 0.00 C ATOM 2431 CG LEU B 60 83.808 6.281 2.676 1.00 0.00 C ATOM 2432 CD1 LEU B 60 82.565 5.809 3.445 1.00 0.00 C ATOM 2433 CD2 LEU B 60 83.374 6.903 1.345 1.00 0.00 C ATOM 0 H LEU B 60 86.076 8.579 5.044 1.00 0.00 H new ATOM 0 HA LEU B 60 83.970 6.641 5.451 1.00 0.00 H new ATOM 0 HB2 LEU B 60 83.974 8.247 3.567 1.00 0.00 H new ATOM 0 HB3 LEU B 60 85.494 7.605 2.977 1.00 0.00 H new ATOM 0 HG LEU B 60 84.458 5.424 2.499 1.00 0.00 H new ATOM 0 HD11 LEU B 60 82.035 5.061 2.856 1.00 0.00 H new ATOM 0 HD12 LEU B 60 82.870 5.373 4.396 1.00 0.00 H new ATOM 0 HD13 LEU B 60 81.907 6.658 3.630 1.00 0.00 H new ATOM 0 HD21 LEU B 60 82.831 6.163 0.757 1.00 0.00 H new ATOM 0 HD22 LEU B 60 82.727 7.759 1.537 1.00 0.00 H new ATOM 0 HD23 LEU B 60 84.254 7.231 0.792 1.00 0.00 H new ATOM 2445 N ASP B 61 86.883 5.478 4.464 1.00 0.00 N ATOM 2446 CA ASP B 61 87.620 4.190 4.322 1.00 0.00 C ATOM 2447 C ASP B 61 87.744 3.487 5.671 1.00 0.00 C ATOM 2448 O ASP B 61 88.553 3.846 6.503 1.00 0.00 O ATOM 2449 CB ASP B 61 89.020 4.464 3.768 1.00 0.00 C ATOM 2450 CG ASP B 61 88.923 4.861 2.293 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.928 4.524 1.672 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.845 5.497 1.810 1.00 0.00 O ATOM 0 H ASP B 61 87.434 6.318 4.285 1.00 0.00 H new ATOM 0 HA ASP B 61 87.065 3.546 3.640 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.498 5.261 4.338 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.644 3.577 3.875 1.00 0.00 H new ATOM 2457 N GLU B 62 86.954 2.471 5.885 1.00 0.00 N ATOM 2458 CA GLU B 62 87.031 1.723 7.166 1.00 0.00 C ATOM 2459 C GLU B 62 88.414 1.080 7.280 1.00 0.00 C ATOM 2460 O GLU B 62 89.013 1.044 8.337 1.00 0.00 O ATOM 2461 CB GLU B 62 85.970 0.621 7.173 1.00 0.00 C ATOM 2462 CG GLU B 62 85.983 -0.104 8.520 1.00 0.00 C ATOM 2463 CD GLU B 62 84.922 -1.206 8.515 1.00 0.00 C ATOM 2464 OE1 GLU B 62 84.187 -1.287 7.545 1.00 0.00 O ATOM 2465 OE2 GLU B 62 84.865 -1.951 9.480 1.00 0.00 O ATOM 0 H GLU B 62 86.257 2.128 5.224 1.00 0.00 H new ATOM 0 HA GLU B 62 86.862 2.403 8.001 1.00 0.00 H new ATOM 0 HB2 GLU B 62 84.985 1.051 6.991 1.00 0.00 H new ATOM 0 HB3 GLU B 62 86.163 -0.087 6.367 1.00 0.00 H new ATOM 0 HG2 GLU B 62 86.968 -0.533 8.705 1.00 0.00 H new ATOM 0 HG3 GLU B 62 85.786 0.602 9.327 1.00 0.00 H new ATOM 2472 N ASP B 63 88.917 0.557 6.193 1.00 0.00 N ATOM 2473 CA ASP B 63 90.252 -0.108 6.219 1.00 0.00 C ATOM 2474 C ASP B 63 91.357 0.917 5.936 1.00 0.00 C ATOM 2475 O ASP B 63 92.524 0.651 6.147 1.00 0.00 O ATOM 2476 CB ASP B 63 90.284 -1.200 5.148 1.00 0.00 C ATOM 2477 CG ASP B 63 90.046 -0.572 3.774 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.682 0.592 3.731 1.00 0.00 O ATOM 2479 OD2 ASP B 63 90.232 -1.264 2.787 1.00 0.00 O ATOM 0 H ASP B 63 88.457 0.562 5.283 1.00 0.00 H new ATOM 0 HA ASP B 63 90.420 -0.545 7.203 1.00 0.00 H new ATOM 0 HB2 ASP B 63 91.246 -1.712 5.164 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.520 -1.950 5.355 1.00 0.00 H new ATOM 2484 N GLY B 64 91.004 2.086 5.472 1.00 0.00 N ATOM 2485 CA GLY B 64 92.043 3.122 5.190 1.00 0.00 C ATOM 2486 C GLY B 64 92.827 2.768 3.918 1.00 0.00 C ATOM 2487 O GLY B 64 94.001 3.057 3.806 1.00 0.00 O ATOM 0 H GLY B 64 90.044 2.369 5.276 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.570 4.097 5.073 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.727 3.199 6.036 1.00 0.00 H new ATOM 2491 N ASP B 65 92.198 2.131 2.967 1.00 0.00 N ATOM 2492 CA ASP B 65 92.921 1.745 1.717 1.00 0.00 C ATOM 2493 C ASP B 65 93.038 2.940 0.756 1.00 0.00 C ATOM 2494 O ASP B 65 93.668 2.844 -0.280 1.00 0.00 O ATOM 2495 CB ASP B 65 92.158 0.620 1.020 1.00 0.00 C ATOM 2496 CG ASP B 65 90.782 1.133 0.592 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.346 2.129 1.146 1.00 0.00 O ATOM 2498 OD2 ASP B 65 90.189 0.522 -0.283 1.00 0.00 O ATOM 0 H ASP B 65 91.215 1.861 3.000 1.00 0.00 H new ATOM 0 HA ASP B 65 93.924 1.415 1.988 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.715 0.271 0.151 1.00 0.00 H new ATOM 0 HB3 ASP B 65 92.049 -0.232 1.692 1.00 0.00 H new ATOM 2503 N GLY B 66 92.474 4.069 1.093 1.00 0.00 N ATOM 2504 CA GLY B 66 92.599 5.259 0.196 1.00 0.00 C ATOM 2505 C GLY B 66 91.650 5.155 -1.004 1.00 0.00 C ATOM 2506 O GLY B 66 91.676 5.984 -1.892 1.00 0.00 O ATOM 0 H GLY B 66 91.935 4.220 1.945 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.379 6.166 0.759 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.627 5.345 -0.157 1.00 0.00 H new ATOM 2510 N GLU B 67 90.813 4.154 -1.044 1.00 0.00 N ATOM 2511 CA GLU B 67 89.860 3.997 -2.187 1.00 0.00 C ATOM 2512 C GLU B 67 88.519 3.533 -1.621 1.00 0.00 C ATOM 2513 O GLU B 67 88.462 3.029 -0.516 1.00 0.00 O ATOM 2514 CB GLU B 67 90.398 2.944 -3.160 1.00 0.00 C ATOM 2515 CG GLU B 67 91.644 3.483 -3.864 1.00 0.00 C ATOM 2516 CD GLU B 67 92.178 2.425 -4.831 1.00 0.00 C ATOM 2517 OE1 GLU B 67 91.699 1.304 -4.773 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.060 2.751 -5.608 1.00 0.00 O ATOM 0 H GLU B 67 90.746 3.430 -0.328 1.00 0.00 H new ATOM 0 HA GLU B 67 89.742 4.941 -2.718 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.640 2.027 -2.622 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.634 2.690 -3.895 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.402 4.398 -4.405 1.00 0.00 H new ATOM 0 HG3 GLU B 67 92.408 3.739 -3.130 1.00 0.00 H new ATOM 2525 N CYS B 68 87.435 3.686 -2.349 1.00 0.00 N ATOM 2526 CA CYS B 68 86.104 3.238 -1.822 1.00 0.00 C ATOM 2527 C CYS B 68 85.657 1.983 -2.577 1.00 0.00 C ATOM 2528 O CYS B 68 85.317 2.033 -3.745 1.00 0.00 O ATOM 2529 CB CYS B 68 85.078 4.354 -2.042 1.00 0.00 C ATOM 2530 SG CYS B 68 85.614 5.845 -1.168 1.00 0.00 S ATOM 0 H CYS B 68 87.415 4.100 -3.281 1.00 0.00 H new ATOM 0 HA CYS B 68 86.184 3.014 -0.758 1.00 0.00 H new ATOM 0 HB2 CYS B 68 84.973 4.561 -3.107 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.099 4.039 -1.680 1.00 0.00 H new ATOM 0 HG CYS B 68 84.745 6.794 -1.356 1.00 0.00 H new ATOM 2536 N ASP B 69 85.685 0.853 -1.925 1.00 0.00 N ATOM 2537 CA ASP B 69 85.293 -0.416 -2.600 1.00 0.00 C ATOM 2538 C ASP B 69 83.769 -0.507 -2.749 1.00 0.00 C ATOM 2539 O ASP B 69 83.033 0.384 -2.375 1.00 0.00 O ATOM 2540 CB ASP B 69 85.811 -1.614 -1.796 1.00 0.00 C ATOM 2541 CG ASP B 69 85.060 -1.715 -0.468 1.00 0.00 C ATOM 2542 OD1 ASP B 69 84.284 -0.823 -0.181 1.00 0.00 O ATOM 2543 OD2 ASP B 69 85.270 -2.689 0.235 1.00 0.00 O ATOM 0 H ASP B 69 85.964 0.754 -0.949 1.00 0.00 H new ATOM 0 HA ASP B 69 85.737 -0.428 -3.595 1.00 0.00 H new ATOM 0 HB2 ASP B 69 85.679 -2.532 -2.369 1.00 0.00 H new ATOM 0 HB3 ASP B 69 86.880 -1.504 -1.612 1.00 0.00 H new ATOM 2548 N PHE B 70 83.312 -1.595 -3.301 1.00 0.00 N ATOM 2549 CA PHE B 70 81.846 -1.791 -3.493 1.00 0.00 C ATOM 2550 C PHE B 70 81.131 -1.771 -2.138 1.00 0.00 C ATOM 2551 O PHE B 70 80.121 -1.120 -1.965 1.00 0.00 O ATOM 2552 CB PHE B 70 81.583 -3.126 -4.192 1.00 0.00 C ATOM 2553 CG PHE B 70 80.101 -3.264 -4.454 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.559 -2.782 -5.652 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.268 -3.865 -3.501 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.187 -2.901 -5.898 1.00 0.00 C ATOM 2557 CE2 PHE B 70 77.895 -3.983 -3.749 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.355 -3.501 -4.947 1.00 0.00 C ATOM 0 H PHE B 70 83.895 -2.364 -3.631 1.00 0.00 H new ATOM 0 HA PHE B 70 81.463 -0.980 -4.112 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.137 -3.175 -5.130 1.00 0.00 H new ATOM 0 HB3 PHE B 70 81.933 -3.951 -3.571 1.00 0.00 H new ATOM 0 HD1 PHE B 70 80.201 -2.318 -6.386 1.00 0.00 H new ATOM 0 HD2 PHE B 70 79.684 -4.237 -2.576 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.770 -2.530 -6.822 1.00 0.00 H new ATOM 0 HE2 PHE B 70 77.252 -4.446 -3.015 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.296 -3.592 -5.137 1.00 0.00 H new ATOM 2568 N GLN B 71 81.623 -2.514 -1.189 1.00 0.00 N ATOM 2569 CA GLN B 71 80.944 -2.564 0.138 1.00 0.00 C ATOM 2570 C GLN B 71 80.896 -1.162 0.758 1.00 0.00 C ATOM 2571 O GLN B 71 79.839 -0.661 1.083 1.00 0.00 O ATOM 2572 CB GLN B 71 81.701 -3.524 1.060 1.00 0.00 C ATOM 2573 CG GLN B 71 80.958 -3.660 2.396 1.00 0.00 C ATOM 2574 CD GLN B 71 81.301 -2.475 3.302 1.00 0.00 C ATOM 2575 OE1 GLN B 71 82.443 -2.071 3.390 1.00 0.00 O ATOM 2576 NE2 GLN B 71 80.351 -1.897 3.986 1.00 0.00 N ATOM 0 H GLN B 71 82.462 -3.088 -1.272 1.00 0.00 H new ATOM 0 HA GLN B 71 79.922 -2.921 0.008 1.00 0.00 H new ATOM 0 HB2 GLN B 71 81.794 -4.501 0.585 1.00 0.00 H new ATOM 0 HB3 GLN B 71 82.712 -3.155 1.232 1.00 0.00 H new ATOM 0 HG2 GLN B 71 79.883 -3.698 2.222 1.00 0.00 H new ATOM 0 HG3 GLN B 71 81.235 -4.595 2.883 1.00 0.00 H new ATOM 0 HE21 GLN B 71 79.392 -2.235 3.913 1.00 0.00 H new ATOM 0 HE22 GLN B 71 80.568 -1.107 4.594 1.00 0.00 H new ATOM 2585 N GLU B 72 82.021 -0.519 0.931 1.00 0.00 N ATOM 2586 CA GLU B 72 81.994 0.848 1.538 1.00 0.00 C ATOM 2587 C GLU B 72 81.150 1.753 0.643 1.00 0.00 C ATOM 2588 O GLU B 72 80.349 2.540 1.103 1.00 0.00 O ATOM 2589 CB GLU B 72 83.416 1.404 1.624 1.00 0.00 C ATOM 2590 CG GLU B 72 84.205 0.619 2.672 1.00 0.00 C ATOM 2591 CD GLU B 72 85.628 1.171 2.758 1.00 0.00 C ATOM 2592 OE1 GLU B 72 85.959 2.023 1.950 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.362 0.731 3.627 1.00 0.00 O ATOM 0 H GLU B 72 82.945 -0.873 0.683 1.00 0.00 H new ATOM 0 HA GLU B 72 81.570 0.803 2.541 1.00 0.00 H new ATOM 0 HB2 GLU B 72 83.906 1.331 0.653 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.390 2.461 1.889 1.00 0.00 H new ATOM 0 HG2 GLU B 72 83.715 0.694 3.643 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.229 -0.438 2.408 1.00 0.00 H new ATOM 2600 N PHE B 73 81.352 1.644 -0.640 1.00 0.00 N ATOM 2601 CA PHE B 73 80.584 2.497 -1.593 1.00 0.00 C ATOM 2602 C PHE B 73 79.109 2.481 -1.185 1.00 0.00 C ATOM 2603 O PHE B 73 78.440 3.492 -1.197 1.00 0.00 O ATOM 2604 CB PHE B 73 80.735 1.965 -3.024 1.00 0.00 C ATOM 2605 CG PHE B 73 79.756 2.679 -3.930 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.109 3.890 -4.533 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.488 2.129 -4.149 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.193 4.552 -5.360 1.00 0.00 C ATOM 2609 CE2 PHE B 73 77.571 2.790 -4.975 1.00 0.00 C ATOM 2610 CZ PHE B 73 77.924 4.002 -5.582 1.00 0.00 C ATOM 0 H PHE B 73 82.016 1.001 -1.072 1.00 0.00 H new ATOM 0 HA PHE B 73 80.969 3.516 -1.563 1.00 0.00 H new ATOM 0 HB2 PHE B 73 81.755 2.121 -3.376 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.551 0.891 -3.046 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.087 4.315 -4.361 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.217 1.194 -3.681 1.00 0.00 H new ATOM 0 HE1 PHE B 73 79.465 5.487 -5.827 1.00 0.00 H new ATOM 0 HE2 PHE B 73 76.592 2.366 -5.144 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.218 4.512 -6.221 1.00 0.00 H new ATOM 2620 N MET B 74 78.609 1.344 -0.800 1.00 0.00 N ATOM 2621 CA MET B 74 77.188 1.272 -0.366 1.00 0.00 C ATOM 2622 C MET B 74 77.024 1.991 0.982 1.00 0.00 C ATOM 2623 O MET B 74 75.974 2.517 1.288 1.00 0.00 O ATOM 2624 CB MET B 74 76.743 -0.186 -0.238 1.00 0.00 C ATOM 2625 CG MET B 74 76.692 -0.831 -1.627 1.00 0.00 C ATOM 2626 SD MET B 74 75.782 -2.395 -1.539 1.00 0.00 S ATOM 2627 CE MET B 74 74.125 -1.706 -1.268 1.00 0.00 C ATOM 0 H MET B 74 79.121 0.462 -0.767 1.00 0.00 H new ATOM 0 HA MET B 74 76.564 1.761 -1.115 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.434 -0.733 0.403 1.00 0.00 H new ATOM 0 HB3 MET B 74 75.762 -0.237 0.234 1.00 0.00 H new ATOM 0 HG2 MET B 74 76.209 -0.157 -2.334 1.00 0.00 H new ATOM 0 HG3 MET B 74 77.703 -1.007 -1.994 1.00 0.00 H new ATOM 0 HE1 MET B 74 73.376 -2.392 -1.665 1.00 0.00 H new ATOM 0 HE2 MET B 74 73.959 -1.566 -0.200 1.00 0.00 H new ATOM 0 HE3 MET B 74 74.043 -0.745 -1.776 1.00 0.00 H new ATOM 2637 N ALA B 75 78.051 2.014 1.796 1.00 0.00 N ATOM 2638 CA ALA B 75 77.929 2.701 3.121 1.00 0.00 C ATOM 2639 C ALA B 75 77.669 4.192 2.888 1.00 0.00 C ATOM 2640 O ALA B 75 76.660 4.733 3.301 1.00 0.00 O ATOM 2641 CB ALA B 75 79.229 2.520 3.908 1.00 0.00 C ATOM 0 H ALA B 75 78.960 1.592 1.604 1.00 0.00 H new ATOM 0 HA ALA B 75 77.103 2.271 3.688 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.143 3.019 4.873 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.415 1.457 4.065 1.00 0.00 H new ATOM 0 HB3 ALA B 75 80.057 2.954 3.348 1.00 0.00 H new ATOM 2647 N PHE B 76 78.576 4.855 2.226 1.00 0.00 N ATOM 2648 CA PHE B 76 78.395 6.315 1.953 1.00 0.00 C ATOM 2649 C PHE B 76 76.996 6.514 1.374 1.00 0.00 C ATOM 2650 O PHE B 76 76.283 7.436 1.717 1.00 0.00 O ATOM 2651 CB PHE B 76 79.435 6.771 0.930 1.00 0.00 C ATOM 2652 CG PHE B 76 79.220 8.227 0.596 1.00 0.00 C ATOM 2653 CD1 PHE B 76 78.354 8.583 -0.445 1.00 0.00 C ATOM 2654 CD2 PHE B 76 79.884 9.220 1.324 1.00 0.00 C ATOM 2655 CE1 PHE B 76 78.154 9.933 -0.759 1.00 0.00 C ATOM 2656 CE2 PHE B 76 79.685 10.570 1.010 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.820 10.926 -0.032 1.00 0.00 C ATOM 0 H PHE B 76 79.438 4.451 1.860 1.00 0.00 H new ATOM 0 HA PHE B 76 78.516 6.894 2.869 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.439 6.624 1.328 1.00 0.00 H new ATOM 0 HB3 PHE B 76 79.359 6.166 0.026 1.00 0.00 H new ATOM 0 HD1 PHE B 76 77.840 7.816 -1.006 1.00 0.00 H new ATOM 0 HD2 PHE B 76 80.550 8.945 2.128 1.00 0.00 H new ATOM 0 HE1 PHE B 76 77.486 10.208 -1.562 1.00 0.00 H new ATOM 0 HE2 PHE B 76 80.199 11.336 1.571 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.667 11.967 -0.275 1.00 0.00 H new ATOM 2667 N VAL B 77 76.598 5.616 0.529 1.00 0.00 N ATOM 2668 CA VAL B 77 75.232 5.705 -0.041 1.00 0.00 C ATOM 2669 C VAL B 77 74.249 5.585 1.130 1.00 0.00 C ATOM 2670 O VAL B 77 73.246 6.267 1.191 1.00 0.00 O ATOM 2671 CB VAL B 77 75.001 4.590 -1.064 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.525 4.556 -1.471 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.858 4.859 -2.303 1.00 0.00 C ATOM 0 H VAL B 77 77.156 4.825 0.208 1.00 0.00 H new ATOM 0 HA VAL B 77 75.091 6.651 -0.564 1.00 0.00 H new ATOM 0 HB VAL B 77 75.276 3.632 -0.622 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.367 3.761 -2.199 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.909 4.370 -0.591 1.00 0.00 H new ATOM 0 HG13 VAL B 77 73.247 5.513 -1.913 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.697 4.068 -3.035 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.578 5.818 -2.738 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.910 4.883 -2.019 1.00 0.00 H new ATOM 2683 N SER B 78 74.543 4.713 2.066 1.00 0.00 N ATOM 2684 CA SER B 78 73.649 4.531 3.251 1.00 0.00 C ATOM 2685 C SER B 78 73.755 5.727 4.206 1.00 0.00 C ATOM 2686 O SER B 78 72.763 6.273 4.642 1.00 0.00 O ATOM 2687 CB SER B 78 74.064 3.263 3.996 1.00 0.00 C ATOM 2688 OG SER B 78 73.107 2.974 5.007 1.00 0.00 O ATOM 0 H SER B 78 75.370 4.116 2.058 1.00 0.00 H new ATOM 0 HA SER B 78 72.619 4.453 2.902 1.00 0.00 H new ATOM 0 HB2 SER B 78 74.138 2.427 3.300 1.00 0.00 H new ATOM 0 HB3 SER B 78 75.050 3.396 4.441 1.00 0.00 H new ATOM 0 HG SER B 78 72.243 3.364 4.760 1.00 0.00 H new ATOM 2694 N MET B 79 74.945 6.116 4.574 1.00 0.00 N ATOM 2695 CA MET B 79 75.084 7.246 5.542 1.00 0.00 C ATOM 2696 C MET B 79 74.324 8.462 5.020 1.00 0.00 C ATOM 2697 O MET B 79 73.656 9.155 5.761 1.00 0.00 O ATOM 2698 CB MET B 79 76.566 7.600 5.708 1.00 0.00 C ATOM 2699 CG MET B 79 76.718 8.686 6.777 1.00 0.00 C ATOM 2700 SD MET B 79 78.478 8.995 7.084 1.00 0.00 S ATOM 2701 CE MET B 79 78.745 10.201 5.764 1.00 0.00 C ATOM 0 H MET B 79 75.821 5.706 4.251 1.00 0.00 H new ATOM 0 HA MET B 79 74.673 6.949 6.507 1.00 0.00 H new ATOM 0 HB2 MET B 79 77.132 6.713 5.993 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.975 7.949 4.760 1.00 0.00 H new ATOM 0 HG2 MET B 79 76.229 9.604 6.450 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.227 8.374 7.699 1.00 0.00 H new ATOM 0 HE1 MET B 79 79.785 10.528 5.775 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.519 9.743 4.801 1.00 0.00 H new ATOM 0 HE3 MET B 79 78.093 11.060 5.919 1.00 0.00 H new ATOM 2711 N VAL B 80 74.396 8.710 3.749 1.00 0.00 N ATOM 2712 CA VAL B 80 73.651 9.862 3.173 1.00 0.00 C ATOM 2713 C VAL B 80 72.157 9.547 3.217 1.00 0.00 C ATOM 2714 O VAL B 80 71.322 10.426 3.299 1.00 0.00 O ATOM 2715 CB VAL B 80 74.079 10.081 1.723 1.00 0.00 C ATOM 2716 CG1 VAL B 80 73.208 11.172 1.093 1.00 0.00 C ATOM 2717 CG2 VAL B 80 75.547 10.511 1.685 1.00 0.00 C ATOM 0 H VAL B 80 74.939 8.165 3.079 1.00 0.00 H new ATOM 0 HA VAL B 80 73.863 10.764 3.747 1.00 0.00 H new ATOM 0 HB VAL B 80 73.958 9.154 1.163 1.00 0.00 H new ATOM 0 HG11 VAL B 80 73.513 11.329 0.058 1.00 0.00 H new ATOM 0 HG12 VAL B 80 72.163 10.864 1.121 1.00 0.00 H new ATOM 0 HG13 VAL B 80 73.328 12.101 1.651 1.00 0.00 H new ATOM 0 HG21 VAL B 80 75.854 10.668 0.651 1.00 0.00 H new ATOM 0 HG22 VAL B 80 75.669 11.439 2.244 1.00 0.00 H new ATOM 0 HG23 VAL B 80 76.166 9.733 2.133 1.00 0.00 H new ATOM 2727 N THR B 81 71.820 8.287 3.171 1.00 0.00 N ATOM 2728 CA THR B 81 70.384 7.899 3.215 1.00 0.00 C ATOM 2729 C THR B 81 69.821 8.204 4.604 1.00 0.00 C ATOM 2730 O THR B 81 68.737 8.737 4.741 1.00 0.00 O ATOM 2731 CB THR B 81 70.242 6.402 2.931 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.899 6.084 1.714 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.759 6.056 2.818 1.00 0.00 C ATOM 0 H THR B 81 72.478 7.510 3.105 1.00 0.00 H new ATOM 0 HA THR B 81 69.835 8.463 2.461 1.00 0.00 H new ATOM 0 HB THR B 81 70.693 5.829 3.741 1.00 0.00 H new ATOM 0 HG1 THR B 81 70.235 5.987 1.000 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.648 4.991 2.616 1.00 0.00 H new ATOM 0 HG22 THR B 81 68.256 6.302 3.753 1.00 0.00 H new ATOM 0 HG23 THR B 81 68.313 6.628 2.005 1.00 0.00 H new ATOM 2741 N THR B 82 70.549 7.875 5.636 1.00 0.00 N ATOM 2742 CA THR B 82 70.048 8.154 7.010 1.00 0.00 C ATOM 2743 C THR B 82 70.034 9.669 7.221 1.00 0.00 C ATOM 2744 O THR B 82 69.032 10.250 7.587 1.00 0.00 O ATOM 2745 CB THR B 82 70.984 7.489 8.027 1.00 0.00 C ATOM 2746 OG1 THR B 82 71.107 6.107 7.718 1.00 0.00 O ATOM 2747 CG2 THR B 82 70.418 7.637 9.439 1.00 0.00 C ATOM 0 H THR B 82 71.464 7.427 5.587 1.00 0.00 H new ATOM 0 HA THR B 82 69.041 7.757 7.141 1.00 0.00 H new ATOM 0 HB THR B 82 71.960 7.971 7.980 1.00 0.00 H new ATOM 0 HG1 THR B 82 70.252 5.657 7.883 1.00 0.00 H new ATOM 0 HG21 THR B 82 71.091 7.161 10.152 1.00 0.00 H new ATOM 0 HG22 THR B 82 70.320 8.695 9.683 1.00 0.00 H new ATOM 0 HG23 THR B 82 69.439 7.161 9.490 1.00 0.00 H new ATOM 2755 N ALA B 83 71.150 10.308 6.997 1.00 0.00 N ATOM 2756 CA ALA B 83 71.229 11.784 7.188 1.00 0.00 C ATOM 2757 C ALA B 83 70.011 12.453 6.546 1.00 0.00 C ATOM 2758 O ALA B 83 69.431 13.369 7.098 1.00 0.00 O ATOM 2759 CB ALA B 83 72.505 12.304 6.521 1.00 0.00 C ATOM 0 H ALA B 83 72.016 9.867 6.688 1.00 0.00 H new ATOM 0 HA ALA B 83 71.245 12.015 8.253 1.00 0.00 H new ATOM 0 HB1 ALA B 83 72.572 13.384 6.655 1.00 0.00 H new ATOM 0 HB2 ALA B 83 73.373 11.827 6.976 1.00 0.00 H new ATOM 0 HB3 ALA B 83 72.480 12.072 5.456 1.00 0.00 H new ATOM 2765 N CYS B 84 69.618 12.009 5.386 1.00 0.00 N ATOM 2766 CA CYS B 84 68.439 12.630 4.715 1.00 0.00 C ATOM 2767 C CYS B 84 67.158 12.195 5.435 1.00 0.00 C ATOM 2768 O CYS B 84 66.767 11.045 5.384 1.00 0.00 O ATOM 2769 CB CYS B 84 68.382 12.172 3.256 1.00 0.00 C ATOM 2770 SG CYS B 84 67.141 13.143 2.364 1.00 0.00 S ATOM 0 H CYS B 84 70.059 11.246 4.873 1.00 0.00 H new ATOM 0 HA CYS B 84 68.529 13.716 4.752 1.00 0.00 H new ATOM 0 HB2 CYS B 84 69.359 12.293 2.788 1.00 0.00 H new ATOM 0 HB3 CYS B 84 68.134 11.112 3.206 1.00 0.00 H new ATOM 0 HG CYS B 84 67.732 13.916 1.502 1.00 0.00 H new