USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=38 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: A 7 MET CE :methyl -113:sc= -2.24 (180deg=-4.55!) USER MOD Set 1.2: B 81 THR OG1 : rot 78:sc= -0.15 USER MOD Set 2.1: B 78 SER OG : rot 180:sc= -0.407 USER MOD Set 2.2: B 82 THR OG1 : rot 109:sc= 0.0293 USER MOD Set 3.1: A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.1: B 29 LYS NZ :NH3+ -167:sc= -3.3! (180deg=-1.01) USER MOD Set 4.2: B 33 LYS NZ :NH3+ 179:sc= 1.25 (180deg=0) USER MOD Set 4.3: B 50 GLN : amide:sc= -2.55 K(o=-4.6,f=-12!) USER MOD Set 5.1: B 26 LYS NZ :NH3+ -132:sc= -1.11 (180deg=-3.29!) USER MOD Set 5.2: B 28 LYS NZ :NH3+ 154:sc= -4.48! (180deg=-6.29!) USER MOD Set 6.1: A 81 THR OG1 : rot 79:sc= -0.0179 USER MOD Set 6.2: B 7 MET CE :methyl -111:sc= -1.67 (180deg=-4.25!) USER MOD Set 7.1: A 78 SER OG : rot 180:sc= -0.455 USER MOD Set 7.2: A 82 THR OG1 : rot 107:sc= 0.0396 USER MOD Set 8.1: A 29 LYS NZ :NH3+ -166:sc= -3.47! (180deg=-1.15) USER MOD Set 8.2: A 33 LYS NZ :NH3+ -176:sc= 1.19 (180deg=0) USER MOD Set 8.3: A 50 GLN : amide:sc= -2.66! C(o=-4.9!,f=-11!) USER MOD Set 9.1: A 26 LYS NZ :NH3+ -124:sc= -0.964 (180deg=-3.06!) USER MOD Set 9.2: A 28 LYS NZ :NH3+ 146:sc= -4.76! (180deg=-6.6!) USER MOD Single : A 1 SER N :NH3+ -111:sc= 0.0613 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= -0.154 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 16 GLN : amide:sc= -0.485 X(o=-0.49,f=-0.31) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot -102:sc= 1.16 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.357 X(o=-0.36,f=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 38 ASN : amide:sc= -0.156 K(o=-0.16,f=-1.7!) USER MOD Single : A 41 SER OG : rot -31:sc= -2.01! USER MOD Single : A 42 HIS : no HD1:sc= -0.147 X(o=-0.15,f=-0.59) USER MOD Single : A 48 LYS NZ :NH3+ 136:sc= 0.0499 (180deg=-0.551) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -159:sc= -1.34 (180deg=-2.75!) USER MOD Single : A 59 THR OG1 : rot 83:sc= 0.149 USER MOD Single : A 68 CYS SG : rot -26:sc= 0.0651 USER MOD Single : A 71 GLN : amide:sc= -1.86! C(o=-1.9!,f=-5!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 SER N :NH3+ 138:sc= 0.0732 (180deg=0) USER MOD Single : B 1 SER OG : rot 180:sc= -0.286 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 16 GLN : amide:sc= -0.428 X(o=-0.43,f=-0.3) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot -104:sc= 1.22 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -0.388 X(o=-0.39,f=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : B 38 ASN : amide:sc= -0.187 K(o=-0.19,f=-1.8!) USER MOD Single : B 41 SER OG : rot -31:sc= -1.86 USER MOD Single : B 42 HIS : no HD1:sc= -0.168 X(o=-0.17,f=-0.53) USER MOD Single : B 48 LYS NZ :NH3+ 134:sc= 0.0484 (180deg=-0.596) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl -161:sc= -1.22 (180deg=-2.52!) USER MOD Single : B 59 THR OG1 : rot 83:sc= 0.155 USER MOD Single : B 68 CYS SG : rot -25:sc= 0.0756 USER MOD Single : B 71 GLN : amide:sc= -1.97! C(o=-2!,f=-5.2!) USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 84 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 66.787 12.970 -9.971 1.00 0.00 N ATOM 2 CA SER A 1 67.740 11.942 -10.487 1.00 0.00 C ATOM 3 C SER A 1 67.154 10.545 -10.277 1.00 0.00 C ATOM 4 O SER A 1 66.343 10.332 -9.394 1.00 0.00 O ATOM 5 CB SER A 1 69.056 12.046 -9.724 1.00 0.00 C ATOM 6 OG SER A 1 68.813 11.793 -8.346 1.00 0.00 O ATOM 0 H1 SER A 1 66.390 13.507 -10.768 1.00 0.00 H new ATOM 0 H2 SER A 1 66.017 12.501 -9.452 1.00 0.00 H new ATOM 0 H3 SER A 1 67.289 13.619 -9.332 1.00 0.00 H new ATOM 0 HA SER A 1 67.911 12.112 -11.550 1.00 0.00 H new ATOM 0 HB2 SER A 1 69.777 11.329 -10.117 1.00 0.00 H new ATOM 0 HB3 SER A 1 69.489 13.038 -9.854 1.00 0.00 H new ATOM 0 HG SER A 1 69.655 11.856 -7.848 1.00 0.00 H new ATOM 14 N GLU A 2 67.542 9.591 -11.084 1.00 0.00 N ATOM 15 CA GLU A 2 66.995 8.216 -10.931 1.00 0.00 C ATOM 16 C GLU A 2 67.466 7.611 -9.606 1.00 0.00 C ATOM 17 O GLU A 2 66.781 6.808 -9.005 1.00 0.00 O ATOM 18 CB GLU A 2 67.482 7.351 -12.095 1.00 0.00 C ATOM 19 CG GLU A 2 66.801 7.803 -13.391 1.00 0.00 C ATOM 20 CD GLU A 2 67.288 6.937 -14.555 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.130 6.086 -14.321 1.00 0.00 O ATOM 22 OE2 GLU A 2 66.809 7.138 -15.659 1.00 0.00 O ATOM 0 H GLU A 2 68.215 9.708 -11.842 1.00 0.00 H new ATOM 0 HA GLU A 2 65.906 8.256 -10.933 1.00 0.00 H new ATOM 0 HB2 GLU A 2 68.564 7.432 -12.194 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.257 6.302 -11.901 1.00 0.00 H new ATOM 0 HG2 GLU A 2 65.718 7.722 -13.292 1.00 0.00 H new ATOM 0 HG3 GLU A 2 67.026 8.852 -13.586 1.00 0.00 H new ATOM 29 N LEU A 3 68.629 7.987 -9.144 1.00 0.00 N ATOM 30 CA LEU A 3 69.139 7.439 -7.856 1.00 0.00 C ATOM 31 C LEU A 3 68.298 7.994 -6.701 1.00 0.00 C ATOM 32 O LEU A 3 68.073 7.327 -5.708 1.00 0.00 O ATOM 33 CB LEU A 3 70.597 7.877 -7.665 1.00 0.00 C ATOM 34 CG LEU A 3 71.502 7.191 -8.698 1.00 0.00 C ATOM 35 CD1 LEU A 3 72.893 7.839 -8.658 1.00 0.00 C ATOM 36 CD2 LEU A 3 71.626 5.685 -8.391 1.00 0.00 C ATOM 0 H LEU A 3 69.249 8.652 -9.606 1.00 0.00 H new ATOM 0 HA LEU A 3 69.076 6.351 -7.870 1.00 0.00 H new ATOM 0 HB2 LEU A 3 70.674 8.960 -7.766 1.00 0.00 H new ATOM 0 HB3 LEU A 3 70.930 7.627 -6.658 1.00 0.00 H new ATOM 0 HG LEU A 3 71.064 7.310 -9.689 1.00 0.00 H new ATOM 0 HD11 LEU A 3 73.541 7.356 -9.390 1.00 0.00 H new ATOM 0 HD12 LEU A 3 72.807 8.900 -8.894 1.00 0.00 H new ATOM 0 HD13 LEU A 3 73.320 7.722 -7.662 1.00 0.00 H new ATOM 0 HD21 LEU A 3 72.271 5.214 -9.133 1.00 0.00 H new ATOM 0 HD22 LEU A 3 72.056 5.550 -7.399 1.00 0.00 H new ATOM 0 HD23 LEU A 3 70.639 5.224 -8.424 1.00 0.00 H new ATOM 48 N GLU A 4 67.823 9.207 -6.827 1.00 0.00 N ATOM 49 CA GLU A 4 66.991 9.804 -5.745 1.00 0.00 C ATOM 50 C GLU A 4 65.734 8.955 -5.544 1.00 0.00 C ATOM 51 O GLU A 4 65.297 8.733 -4.431 1.00 0.00 O ATOM 52 CB GLU A 4 66.596 11.235 -6.143 1.00 0.00 C ATOM 53 CG GLU A 4 65.751 11.877 -5.034 1.00 0.00 C ATOM 54 CD GLU A 4 65.343 13.292 -5.456 1.00 0.00 C ATOM 55 OE1 GLU A 4 65.772 13.721 -6.513 1.00 0.00 O ATOM 56 OE2 GLU A 4 64.603 13.917 -4.716 1.00 0.00 O ATOM 0 H GLU A 4 67.977 9.809 -7.636 1.00 0.00 H new ATOM 0 HA GLU A 4 67.558 9.831 -4.814 1.00 0.00 H new ATOM 0 HB2 GLU A 4 67.491 11.831 -6.320 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.033 11.219 -7.076 1.00 0.00 H new ATOM 0 HG2 GLU A 4 64.864 11.273 -4.843 1.00 0.00 H new ATOM 0 HG3 GLU A 4 66.319 11.913 -4.104 1.00 0.00 H new ATOM 63 N LYS A 5 65.140 8.485 -6.605 1.00 0.00 N ATOM 64 CA LYS A 5 63.909 7.657 -6.452 1.00 0.00 C ATOM 65 C LYS A 5 64.246 6.363 -5.704 1.00 0.00 C ATOM 66 O LYS A 5 63.501 5.914 -4.858 1.00 0.00 O ATOM 67 CB LYS A 5 63.337 7.330 -7.836 1.00 0.00 C ATOM 68 CG LYS A 5 62.033 6.541 -7.689 1.00 0.00 C ATOM 69 CD LYS A 5 61.474 6.229 -9.079 1.00 0.00 C ATOM 70 CE LYS A 5 60.171 5.439 -8.950 1.00 0.00 C ATOM 71 NZ LYS A 5 59.577 5.256 -10.305 1.00 0.00 N ATOM 0 H LYS A 5 65.450 8.636 -7.565 1.00 0.00 H new ATOM 0 HA LYS A 5 63.166 8.213 -5.880 1.00 0.00 H new ATOM 0 HB2 LYS A 5 63.154 8.251 -8.390 1.00 0.00 H new ATOM 0 HB3 LYS A 5 64.060 6.750 -8.410 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.213 5.616 -7.141 1.00 0.00 H new ATOM 0 HG3 LYS A 5 61.308 7.117 -7.113 1.00 0.00 H new ATOM 0 HD2 LYS A 5 61.295 7.155 -9.625 1.00 0.00 H new ATOM 0 HD3 LYS A 5 62.202 5.656 -9.653 1.00 0.00 H new ATOM 0 HE2 LYS A 5 60.363 4.470 -8.489 1.00 0.00 H new ATOM 0 HE3 LYS A 5 59.473 5.968 -8.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 58.690 4.719 -10.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 59.382 6.186 -10.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 60.244 4.735 -10.909 1.00 0.00 H new ATOM 85 N ALA A 6 65.365 5.765 -6.000 1.00 0.00 N ATOM 86 CA ALA A 6 65.745 4.509 -5.293 1.00 0.00 C ATOM 87 C ALA A 6 65.866 4.790 -3.792 1.00 0.00 C ATOM 88 O ALA A 6 65.302 4.091 -2.974 1.00 0.00 O ATOM 89 CB ALA A 6 67.078 3.994 -5.837 1.00 0.00 C ATOM 0 H ALA A 6 66.033 6.090 -6.699 1.00 0.00 H new ATOM 0 HA ALA A 6 64.980 3.751 -5.458 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.353 3.076 -5.318 1.00 0.00 H new ATOM 0 HB2 ALA A 6 66.982 3.793 -6.904 1.00 0.00 H new ATOM 0 HB3 ALA A 6 67.851 4.746 -5.678 1.00 0.00 H new ATOM 95 N MET A 7 66.588 5.815 -3.425 1.00 0.00 N ATOM 96 CA MET A 7 66.727 6.144 -1.977 1.00 0.00 C ATOM 97 C MET A 7 65.346 6.466 -1.407 1.00 0.00 C ATOM 98 O MET A 7 64.944 5.953 -0.381 1.00 0.00 O ATOM 99 CB MET A 7 67.630 7.369 -1.830 1.00 0.00 C ATOM 100 CG MET A 7 67.979 7.584 -0.353 1.00 0.00 C ATOM 101 SD MET A 7 69.008 9.067 -0.179 1.00 0.00 S ATOM 102 CE MET A 7 70.600 8.360 -0.686 1.00 0.00 C ATOM 0 H MET A 7 67.086 6.436 -4.063 1.00 0.00 H new ATOM 0 HA MET A 7 67.161 5.299 -1.441 1.00 0.00 H new ATOM 0 HB2 MET A 7 68.541 7.232 -2.412 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.128 8.252 -2.227 1.00 0.00 H new ATOM 0 HG2 MET A 7 67.067 7.691 0.234 1.00 0.00 H new ATOM 0 HG3 MET A 7 68.508 6.714 0.036 1.00 0.00 H new ATOM 0 HE1 MET A 7 71.278 8.342 0.167 1.00 0.00 H new ATOM 0 HE2 MET A 7 70.448 7.344 -1.050 1.00 0.00 H new ATOM 0 HE3 MET A 7 71.032 8.969 -1.480 1.00 0.00 H new ATOM 112 N VAL A 8 64.636 7.342 -2.062 1.00 0.00 N ATOM 113 CA VAL A 8 63.288 7.736 -1.574 1.00 0.00 C ATOM 114 C VAL A 8 62.400 6.496 -1.519 1.00 0.00 C ATOM 115 O VAL A 8 61.633 6.317 -0.597 1.00 0.00 O ATOM 116 CB VAL A 8 62.685 8.771 -2.532 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.219 9.028 -2.172 1.00 0.00 C ATOM 118 CG2 VAL A 8 63.478 10.077 -2.430 1.00 0.00 C ATOM 0 H VAL A 8 64.935 7.804 -2.921 1.00 0.00 H new ATOM 0 HA VAL A 8 63.362 8.173 -0.578 1.00 0.00 H new ATOM 0 HB VAL A 8 62.736 8.390 -3.552 1.00 0.00 H new ATOM 0 HG11 VAL A 8 60.800 9.764 -2.858 1.00 0.00 H new ATOM 0 HG12 VAL A 8 60.657 8.098 -2.250 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.156 9.405 -1.151 1.00 0.00 H new ATOM 0 HG21 VAL A 8 63.052 10.815 -3.110 1.00 0.00 H new ATOM 0 HG22 VAL A 8 63.429 10.454 -1.408 1.00 0.00 H new ATOM 0 HG23 VAL A 8 64.518 9.893 -2.699 1.00 0.00 H new ATOM 128 N ALA A 9 62.495 5.630 -2.491 1.00 0.00 N ATOM 129 CA ALA A 9 61.647 4.411 -2.465 1.00 0.00 C ATOM 130 C ALA A 9 61.960 3.605 -1.200 1.00 0.00 C ATOM 131 O ALA A 9 61.074 3.092 -0.549 1.00 0.00 O ATOM 132 CB ALA A 9 61.936 3.565 -3.710 1.00 0.00 C ATOM 0 H ALA A 9 63.118 5.715 -3.294 1.00 0.00 H new ATOM 0 HA ALA A 9 60.594 4.692 -2.460 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.315 2.669 -3.694 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.712 4.146 -4.605 1.00 0.00 H new ATOM 0 HB3 ALA A 9 62.987 3.277 -3.718 1.00 0.00 H new ATOM 138 N LEU A 10 63.211 3.472 -0.856 1.00 0.00 N ATOM 139 CA LEU A 10 63.572 2.681 0.362 1.00 0.00 C ATOM 140 C LEU A 10 62.930 3.294 1.619 1.00 0.00 C ATOM 141 O LEU A 10 62.316 2.606 2.412 1.00 0.00 O ATOM 142 CB LEU A 10 65.094 2.666 0.526 1.00 0.00 C ATOM 143 CG LEU A 10 65.733 1.820 -0.587 1.00 0.00 C ATOM 144 CD1 LEU A 10 67.254 2.012 -0.554 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.388 0.328 -0.404 1.00 0.00 C ATOM 0 H LEU A 10 64.000 3.874 -1.362 1.00 0.00 H new ATOM 0 HA LEU A 10 63.200 1.664 0.240 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.482 3.684 0.489 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.359 2.259 1.502 1.00 0.00 H new ATOM 0 HG LEU A 10 65.340 2.145 -1.550 1.00 0.00 H new ATOM 0 HD11 LEU A 10 67.713 1.414 -1.341 1.00 0.00 H new ATOM 0 HD12 LEU A 10 67.491 3.064 -0.712 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.640 1.694 0.415 1.00 0.00 H new ATOM 0 HD21 LEU A 10 65.850 -0.253 -1.202 1.00 0.00 H new ATOM 0 HD22 LEU A 10 65.763 -0.017 0.560 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.306 0.198 -0.440 1.00 0.00 H new ATOM 157 N ILE A 11 63.077 4.579 1.818 1.00 0.00 N ATOM 158 CA ILE A 11 62.482 5.218 3.030 1.00 0.00 C ATOM 159 C ILE A 11 60.971 5.013 3.015 1.00 0.00 C ATOM 160 O ILE A 11 60.378 4.595 3.987 1.00 0.00 O ATOM 161 CB ILE A 11 62.799 6.716 3.016 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.296 6.909 3.269 1.00 0.00 C ATOM 163 CG2 ILE A 11 61.990 7.439 4.102 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.678 8.364 3.004 1.00 0.00 C ATOM 0 H ILE A 11 63.581 5.211 1.196 1.00 0.00 H new ATOM 0 HA ILE A 11 62.900 4.767 3.930 1.00 0.00 H new ATOM 0 HB ILE A 11 62.531 7.135 2.046 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.539 6.640 4.297 1.00 0.00 H new ATOM 0 HG13 ILE A 11 64.872 6.248 2.622 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.224 8.503 4.082 1.00 0.00 H new ATOM 0 HG22 ILE A 11 60.925 7.298 3.917 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.246 7.030 5.079 1.00 0.00 H new ATOM 0 HD11 ILE A 11 65.744 8.499 3.185 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.451 8.617 1.968 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.112 9.016 3.669 1.00 0.00 H new ATOM 176 N ASP A 12 60.342 5.320 1.917 1.00 0.00 N ATOM 177 CA ASP A 12 58.870 5.161 1.849 1.00 0.00 C ATOM 178 C ASP A 12 58.519 3.692 2.096 1.00 0.00 C ATOM 179 O ASP A 12 57.564 3.380 2.774 1.00 0.00 O ATOM 180 CB ASP A 12 58.383 5.575 0.459 1.00 0.00 C ATOM 181 CG ASP A 12 56.859 5.483 0.407 1.00 0.00 C ATOM 182 OD1 ASP A 12 56.293 4.879 1.302 1.00 0.00 O ATOM 183 OD2 ASP A 12 56.285 6.023 -0.522 1.00 0.00 O ATOM 0 H ASP A 12 60.784 5.673 1.068 1.00 0.00 H new ATOM 0 HA ASP A 12 58.391 5.786 2.603 1.00 0.00 H new ATOM 0 HB2 ASP A 12 58.705 6.593 0.237 1.00 0.00 H new ATOM 0 HB3 ASP A 12 58.823 4.929 -0.300 1.00 0.00 H new ATOM 188 N VAL A 13 59.291 2.787 1.561 1.00 0.00 N ATOM 189 CA VAL A 13 58.998 1.341 1.777 1.00 0.00 C ATOM 190 C VAL A 13 59.290 0.959 3.242 1.00 0.00 C ATOM 191 O VAL A 13 58.547 0.228 3.857 1.00 0.00 O ATOM 192 CB VAL A 13 59.860 0.501 0.825 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.754 -0.984 1.193 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.387 0.711 -0.624 1.00 0.00 C ATOM 0 H VAL A 13 60.110 2.984 0.985 1.00 0.00 H new ATOM 0 HA VAL A 13 57.945 1.147 1.572 1.00 0.00 H new ATOM 0 HB VAL A 13 60.900 0.816 0.915 1.00 0.00 H new ATOM 0 HG11 VAL A 13 60.369 -1.572 0.512 1.00 0.00 H new ATOM 0 HG12 VAL A 13 60.102 -1.131 2.215 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.715 -1.305 1.113 1.00 0.00 H new ATOM 0 HG21 VAL A 13 60.001 0.113 -1.297 1.00 0.00 H new ATOM 0 HG22 VAL A 13 58.345 0.404 -0.715 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.479 1.765 -0.888 1.00 0.00 H new ATOM 204 N PHE A 14 60.371 1.436 3.803 1.00 0.00 N ATOM 205 CA PHE A 14 60.704 1.080 5.224 1.00 0.00 C ATOM 206 C PHE A 14 59.617 1.579 6.188 1.00 0.00 C ATOM 207 O PHE A 14 59.084 0.824 6.980 1.00 0.00 O ATOM 208 CB PHE A 14 62.042 1.734 5.583 1.00 0.00 C ATOM 209 CG PHE A 14 62.421 1.446 7.021 1.00 0.00 C ATOM 210 CD1 PHE A 14 62.010 2.314 8.041 1.00 0.00 C ATOM 211 CD2 PHE A 14 63.209 0.327 7.331 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.386 2.064 9.369 1.00 0.00 C ATOM 213 CE2 PHE A 14 63.581 0.077 8.660 1.00 0.00 C ATOM 214 CZ PHE A 14 63.170 0.946 9.679 1.00 0.00 C ATOM 0 H PHE A 14 61.039 2.055 3.344 1.00 0.00 H new ATOM 0 HA PHE A 14 60.765 -0.004 5.316 1.00 0.00 H new ATOM 0 HB2 PHE A 14 62.822 1.364 4.917 1.00 0.00 H new ATOM 0 HB3 PHE A 14 61.977 2.811 5.430 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.404 3.176 7.805 1.00 0.00 H new ATOM 0 HD2 PHE A 14 63.529 -0.342 6.546 1.00 0.00 H new ATOM 0 HE1 PHE A 14 62.070 2.735 10.154 1.00 0.00 H new ATOM 0 HE2 PHE A 14 64.185 -0.786 8.898 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.457 0.754 10.702 1.00 0.00 H new ATOM 224 N HIS A 15 59.322 2.852 6.167 1.00 0.00 N ATOM 225 CA HIS A 15 58.322 3.422 7.122 1.00 0.00 C ATOM 226 C HIS A 15 56.951 2.760 6.964 1.00 0.00 C ATOM 227 O HIS A 15 56.283 2.494 7.943 1.00 0.00 O ATOM 228 CB HIS A 15 58.184 4.922 6.849 1.00 0.00 C ATOM 229 CG HIS A 15 57.181 5.521 7.791 1.00 0.00 C ATOM 230 ND1 HIS A 15 57.378 5.547 9.163 1.00 0.00 N ATOM 231 CD2 HIS A 15 55.973 6.135 7.573 1.00 0.00 C ATOM 232 CE1 HIS A 15 56.314 6.160 9.715 1.00 0.00 C ATOM 233 NE2 HIS A 15 55.432 6.536 8.788 1.00 0.00 N ATOM 0 H HIS A 15 59.734 3.528 5.524 1.00 0.00 H new ATOM 0 HA HIS A 15 58.672 3.238 8.138 1.00 0.00 H new ATOM 0 HB2 HIS A 15 59.149 5.413 6.971 1.00 0.00 H new ATOM 0 HB3 HIS A 15 57.871 5.086 5.818 1.00 0.00 H new ATOM 0 HD2 HIS A 15 55.514 6.283 6.607 1.00 0.00 H new ATOM 0 HE1 HIS A 15 56.190 6.326 10.775 1.00 0.00 H new ATOM 0 HE2 HIS A 15 54.546 7.017 8.939 1.00 0.00 H new ATOM 242 N GLN A 16 56.512 2.481 5.769 1.00 0.00 N ATOM 243 CA GLN A 16 55.179 1.836 5.611 1.00 0.00 C ATOM 244 C GLN A 16 55.229 0.402 6.147 1.00 0.00 C ATOM 245 O GLN A 16 54.273 -0.094 6.710 1.00 0.00 O ATOM 246 CB GLN A 16 54.798 1.804 4.122 1.00 0.00 C ATOM 247 CG GLN A 16 54.537 3.224 3.607 1.00 0.00 C ATOM 248 CD GLN A 16 53.350 3.840 4.349 1.00 0.00 C ATOM 249 OE1 GLN A 16 53.432 4.951 4.831 1.00 0.00 O ATOM 250 NE2 GLN A 16 52.248 3.154 4.475 1.00 0.00 N ATOM 0 H GLN A 16 57.014 2.670 4.901 1.00 0.00 H new ATOM 0 HA GLN A 16 54.438 2.407 6.170 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.599 1.342 3.545 1.00 0.00 H new ATOM 0 HB3 GLN A 16 53.909 1.190 3.981 1.00 0.00 H new ATOM 0 HG2 GLN A 16 55.425 3.840 3.749 1.00 0.00 H new ATOM 0 HG3 GLN A 16 54.334 3.200 2.536 1.00 0.00 H new ATOM 0 HE21 GLN A 16 52.179 2.220 4.070 1.00 0.00 H new ATOM 0 HE22 GLN A 16 51.455 3.551 4.979 1.00 0.00 H new ATOM 259 N TYR A 17 56.330 -0.274 5.953 1.00 0.00 N ATOM 260 CA TYR A 17 56.436 -1.688 6.427 1.00 0.00 C ATOM 261 C TYR A 17 56.836 -1.741 7.909 1.00 0.00 C ATOM 262 O TYR A 17 56.290 -2.521 8.668 1.00 0.00 O ATOM 263 CB TYR A 17 57.460 -2.445 5.555 1.00 0.00 C ATOM 264 CG TYR A 17 56.758 -3.051 4.351 1.00 0.00 C ATOM 265 CD1 TYR A 17 56.221 -4.338 4.440 1.00 0.00 C ATOM 266 CD2 TYR A 17 56.640 -2.328 3.156 1.00 0.00 C ATOM 267 CE1 TYR A 17 55.566 -4.904 3.341 1.00 0.00 C ATOM 268 CE2 TYR A 17 55.986 -2.894 2.057 1.00 0.00 C ATOM 269 CZ TYR A 17 55.449 -4.183 2.149 1.00 0.00 C ATOM 270 OH TYR A 17 54.801 -4.738 1.064 1.00 0.00 O ATOM 0 H TYR A 17 57.161 0.090 5.487 1.00 0.00 H new ATOM 0 HA TYR A 17 55.462 -2.168 6.332 1.00 0.00 H new ATOM 0 HB2 TYR A 17 58.245 -1.765 5.226 1.00 0.00 H new ATOM 0 HB3 TYR A 17 57.942 -3.229 6.140 1.00 0.00 H new ATOM 0 HD1 TYR A 17 56.312 -4.897 5.360 1.00 0.00 H new ATOM 0 HD2 TYR A 17 57.054 -1.333 3.084 1.00 0.00 H new ATOM 0 HE1 TYR A 17 55.151 -5.898 3.413 1.00 0.00 H new ATOM 0 HE2 TYR A 17 55.895 -2.336 1.137 1.00 0.00 H new ATOM 0 HH TYR A 17 54.809 -4.102 0.318 1.00 0.00 H new ATOM 280 N SER A 18 57.772 -0.937 8.340 1.00 0.00 N ATOM 281 CA SER A 18 58.176 -0.975 9.777 1.00 0.00 C ATOM 282 C SER A 18 57.057 -0.410 10.651 1.00 0.00 C ATOM 283 O SER A 18 56.989 -0.671 11.837 1.00 0.00 O ATOM 284 CB SER A 18 59.439 -0.133 9.979 1.00 0.00 C ATOM 285 OG SER A 18 59.921 -0.322 11.305 1.00 0.00 O ATOM 0 H SER A 18 58.272 -0.260 7.764 1.00 0.00 H new ATOM 0 HA SER A 18 58.371 -2.009 10.060 1.00 0.00 H new ATOM 0 HB2 SER A 18 60.203 -0.422 9.257 1.00 0.00 H new ATOM 0 HB3 SER A 18 59.220 0.921 9.806 1.00 0.00 H new ATOM 0 HG SER A 18 59.678 0.452 11.855 1.00 0.00 H new ATOM 291 N GLY A 19 56.191 0.379 10.078 1.00 0.00 N ATOM 292 CA GLY A 19 55.082 0.987 10.868 1.00 0.00 C ATOM 293 C GLY A 19 53.904 0.018 10.955 1.00 0.00 C ATOM 294 O GLY A 19 52.783 0.413 11.209 1.00 0.00 O ATOM 0 H GLY A 19 56.204 0.631 9.090 1.00 0.00 H new ATOM 0 HA2 GLY A 19 55.433 1.235 11.870 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.762 1.919 10.402 1.00 0.00 H new ATOM 298 N ARG A 20 54.146 -1.247 10.757 1.00 0.00 N ATOM 299 CA ARG A 20 53.040 -2.241 10.837 1.00 0.00 C ATOM 300 C ARG A 20 52.874 -2.697 12.292 1.00 0.00 C ATOM 301 O ARG A 20 51.799 -2.631 12.856 1.00 0.00 O ATOM 302 CB ARG A 20 53.390 -3.436 9.951 1.00 0.00 C ATOM 303 CG ARG A 20 52.154 -4.313 9.747 1.00 0.00 C ATOM 304 CD ARG A 20 52.526 -5.499 8.860 1.00 0.00 C ATOM 305 NE ARG A 20 51.313 -6.321 8.601 1.00 0.00 N ATOM 306 CZ ARG A 20 50.432 -5.923 7.725 1.00 0.00 C ATOM 307 NH1 ARG A 20 50.621 -4.812 7.067 1.00 0.00 N ATOM 308 NH2 ARG A 20 49.362 -6.636 7.509 1.00 0.00 N ATOM 0 H ARG A 20 55.064 -1.637 10.543 1.00 0.00 H new ATOM 0 HA ARG A 20 52.106 -1.795 10.496 1.00 0.00 H new ATOM 0 HB2 ARG A 20 53.763 -3.088 8.988 1.00 0.00 H new ATOM 0 HB3 ARG A 20 54.188 -4.019 10.410 1.00 0.00 H new ATOM 0 HG2 ARG A 20 51.779 -4.665 10.708 1.00 0.00 H new ATOM 0 HG3 ARG A 20 51.354 -3.734 9.286 1.00 0.00 H new ATOM 0 HD2 ARG A 20 52.947 -5.146 7.919 1.00 0.00 H new ATOM 0 HD3 ARG A 20 53.292 -6.104 9.345 1.00 0.00 H new ATOM 0 HE ARG A 20 51.170 -7.195 9.108 1.00 0.00 H new ATOM 0 HH11 ARG A 20 51.458 -4.254 7.237 1.00 0.00 H new ATOM 0 HH12 ARG A 20 49.932 -4.501 6.382 1.00 0.00 H new ATOM 0 HH21 ARG A 20 49.215 -7.504 8.025 1.00 0.00 H new ATOM 0 HH22 ARG A 20 48.672 -6.326 6.824 1.00 0.00 H new ATOM 322 N GLU A 21 53.939 -3.155 12.908 1.00 0.00 N ATOM 323 CA GLU A 21 53.866 -3.609 14.330 1.00 0.00 C ATOM 324 C GLU A 21 55.198 -3.316 15.023 1.00 0.00 C ATOM 325 O GLU A 21 56.211 -3.119 14.383 1.00 0.00 O ATOM 326 CB GLU A 21 53.573 -5.111 14.397 1.00 0.00 C ATOM 327 CG GLU A 21 52.112 -5.365 14.018 1.00 0.00 C ATOM 328 CD GLU A 21 51.812 -6.864 14.087 1.00 0.00 C ATOM 329 OE1 GLU A 21 52.749 -7.631 14.244 1.00 0.00 O ATOM 330 OE2 GLU A 21 50.647 -7.220 13.994 1.00 0.00 O ATOM 0 H GLU A 21 54.862 -3.233 12.481 1.00 0.00 H new ATOM 0 HA GLU A 21 53.061 -3.073 14.833 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.234 -5.652 13.720 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.769 -5.486 15.401 1.00 0.00 H new ATOM 0 HG2 GLU A 21 51.452 -4.821 14.693 1.00 0.00 H new ATOM 0 HG3 GLU A 21 51.917 -4.992 13.013 1.00 0.00 H new ATOM 337 N GLY A 22 55.203 -3.277 16.330 1.00 0.00 N ATOM 338 CA GLY A 22 56.468 -2.986 17.062 1.00 0.00 C ATOM 339 C GLY A 22 56.692 -1.475 17.080 1.00 0.00 C ATOM 340 O GLY A 22 55.767 -0.703 16.918 1.00 0.00 O ATOM 0 H GLY A 22 54.386 -3.434 16.920 1.00 0.00 H new ATOM 0 HA2 GLY A 22 56.412 -3.371 18.080 1.00 0.00 H new ATOM 0 HA3 GLY A 22 57.307 -3.486 16.578 1.00 0.00 H new ATOM 344 N ASP A 23 57.906 -1.039 17.271 1.00 0.00 N ATOM 345 CA ASP A 23 58.163 0.424 17.287 1.00 0.00 C ATOM 346 C ASP A 23 58.186 0.927 15.845 1.00 0.00 C ATOM 347 O ASP A 23 58.245 0.158 14.907 1.00 0.00 O ATOM 348 CB ASP A 23 59.512 0.726 17.962 1.00 0.00 C ATOM 349 CG ASP A 23 59.531 2.176 18.459 1.00 0.00 C ATOM 350 OD1 ASP A 23 58.670 2.934 18.042 1.00 0.00 O ATOM 351 OD2 ASP A 23 60.404 2.502 19.248 1.00 0.00 O ATOM 0 H ASP A 23 58.725 -1.630 17.416 1.00 0.00 H new ATOM 0 HA ASP A 23 57.377 0.926 17.851 1.00 0.00 H new ATOM 0 HB2 ASP A 23 59.672 0.044 18.797 1.00 0.00 H new ATOM 0 HB3 ASP A 23 60.327 0.563 17.256 1.00 0.00 H new ATOM 356 N LYS A 24 58.122 2.205 15.664 1.00 0.00 N ATOM 357 CA LYS A 24 58.121 2.767 14.288 1.00 0.00 C ATOM 358 C LYS A 24 59.408 2.399 13.531 1.00 0.00 C ATOM 359 O LYS A 24 59.369 2.148 12.343 1.00 0.00 O ATOM 360 CB LYS A 24 58.012 4.288 14.367 1.00 0.00 C ATOM 361 CG LYS A 24 56.615 4.682 14.854 1.00 0.00 C ATOM 362 CD LYS A 24 56.523 6.207 14.926 1.00 0.00 C ATOM 363 CE LYS A 24 55.138 6.617 15.435 1.00 0.00 C ATOM 364 NZ LYS A 24 55.053 8.105 15.495 1.00 0.00 N ATOM 0 H LYS A 24 58.070 2.895 16.413 1.00 0.00 H new ATOM 0 HA LYS A 24 57.271 2.347 13.750 1.00 0.00 H new ATOM 0 HB2 LYS A 24 58.768 4.681 15.046 1.00 0.00 H new ATOM 0 HB3 LYS A 24 58.203 4.727 13.388 1.00 0.00 H new ATOM 0 HG2 LYS A 24 55.856 4.291 14.176 1.00 0.00 H new ATOM 0 HG3 LYS A 24 56.422 4.247 15.834 1.00 0.00 H new ATOM 0 HD2 LYS A 24 57.295 6.597 15.590 1.00 0.00 H new ATOM 0 HD3 LYS A 24 56.702 6.639 13.941 1.00 0.00 H new ATOM 0 HE2 LYS A 24 54.365 6.224 14.775 1.00 0.00 H new ATOM 0 HE3 LYS A 24 54.961 6.191 16.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 54.113 8.385 15.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 55.782 8.469 16.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 55.205 8.500 14.545 1.00 0.00 H new ATOM 378 N HIS A 25 60.559 2.421 14.178 1.00 0.00 N ATOM 379 CA HIS A 25 61.844 2.131 13.452 1.00 0.00 C ATOM 380 C HIS A 25 62.495 0.803 13.887 1.00 0.00 C ATOM 381 O HIS A 25 63.552 0.462 13.394 1.00 0.00 O ATOM 382 CB HIS A 25 62.818 3.272 13.749 1.00 0.00 C ATOM 383 CG HIS A 25 62.228 4.571 13.275 1.00 0.00 C ATOM 384 ND1 HIS A 25 62.668 5.798 13.753 1.00 0.00 N ATOM 385 CD2 HIS A 25 61.224 4.853 12.382 1.00 0.00 C ATOM 386 CE1 HIS A 25 61.936 6.752 13.151 1.00 0.00 C ATOM 387 NE2 HIS A 25 61.044 6.228 12.309 1.00 0.00 N ATOM 0 H HIS A 25 60.661 2.626 15.172 1.00 0.00 H new ATOM 0 HA HIS A 25 61.617 2.045 12.389 1.00 0.00 H new ATOM 0 HB2 HIS A 25 63.021 3.322 14.819 1.00 0.00 H new ATOM 0 HB3 HIS A 25 63.771 3.090 13.252 1.00 0.00 H new ATOM 0 HD2 HIS A 25 60.662 4.120 11.823 1.00 0.00 H new ATOM 0 HE1 HIS A 25 62.055 7.811 13.327 1.00 0.00 H new ATOM 0 HE2 HIS A 25 60.370 6.732 11.732 1.00 0.00 H new ATOM 396 N LYS A 26 61.907 0.049 14.792 1.00 0.00 N ATOM 397 CA LYS A 26 62.548 -1.247 15.223 1.00 0.00 C ATOM 398 C LYS A 26 61.768 -2.419 14.629 1.00 0.00 C ATOM 399 O LYS A 26 60.566 -2.517 14.782 1.00 0.00 O ATOM 400 CB LYS A 26 62.529 -1.361 16.756 1.00 0.00 C ATOM 401 CG LYS A 26 63.303 -0.188 17.365 1.00 0.00 C ATOM 402 CD LYS A 26 63.246 -0.264 18.899 1.00 0.00 C ATOM 403 CE LYS A 26 64.088 -1.443 19.424 1.00 0.00 C ATOM 404 NZ LYS A 26 63.256 -2.681 19.443 1.00 0.00 N ATOM 0 H LYS A 26 61.021 0.269 15.248 1.00 0.00 H new ATOM 0 HA LYS A 26 63.580 -1.266 14.872 1.00 0.00 H new ATOM 0 HB2 LYS A 26 61.501 -1.360 17.119 1.00 0.00 H new ATOM 0 HB3 LYS A 26 62.975 -2.306 17.067 1.00 0.00 H new ATOM 0 HG2 LYS A 26 64.340 -0.212 17.029 1.00 0.00 H new ATOM 0 HG3 LYS A 26 62.879 0.756 17.023 1.00 0.00 H new ATOM 0 HD2 LYS A 26 63.613 0.669 19.327 1.00 0.00 H new ATOM 0 HD3 LYS A 26 62.212 -0.378 19.223 1.00 0.00 H new ATOM 0 HE2 LYS A 26 64.962 -1.590 18.790 1.00 0.00 H new ATOM 0 HE3 LYS A 26 64.455 -1.223 20.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 63.253 -3.083 20.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 62.282 -2.449 19.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 63.652 -3.376 18.778 1.00 0.00 H new ATOM 418 N LEU A 27 62.446 -3.314 13.953 1.00 0.00 N ATOM 419 CA LEU A 27 61.746 -4.490 13.343 1.00 0.00 C ATOM 420 C LEU A 27 61.933 -5.710 14.247 1.00 0.00 C ATOM 421 O LEU A 27 63.026 -6.021 14.676 1.00 0.00 O ATOM 422 CB LEU A 27 62.342 -4.792 11.961 1.00 0.00 C ATOM 423 CG LEU A 27 62.189 -3.578 11.040 1.00 0.00 C ATOM 424 CD1 LEU A 27 62.869 -3.874 9.700 1.00 0.00 C ATOM 425 CD2 LEU A 27 60.699 -3.276 10.802 1.00 0.00 C ATOM 0 H LEU A 27 63.453 -3.282 13.797 1.00 0.00 H new ATOM 0 HA LEU A 27 60.685 -4.263 13.237 1.00 0.00 H new ATOM 0 HB2 LEU A 27 63.396 -5.051 12.061 1.00 0.00 H new ATOM 0 HB3 LEU A 27 61.842 -5.655 11.522 1.00 0.00 H new ATOM 0 HG LEU A 27 62.655 -2.712 11.510 1.00 0.00 H new ATOM 0 HD11 LEU A 27 62.763 -3.013 9.040 1.00 0.00 H new ATOM 0 HD12 LEU A 27 63.927 -4.076 9.866 1.00 0.00 H new ATOM 0 HD13 LEU A 27 62.401 -4.744 9.239 1.00 0.00 H new ATOM 0 HD21 LEU A 27 60.603 -2.411 10.146 1.00 0.00 H new ATOM 0 HD22 LEU A 27 60.223 -4.139 10.337 1.00 0.00 H new ATOM 0 HD23 LEU A 27 60.214 -3.064 11.755 1.00 0.00 H new ATOM 437 N LYS A 28 60.859 -6.398 14.537 1.00 0.00 N ATOM 438 CA LYS A 28 60.931 -7.606 15.416 1.00 0.00 C ATOM 439 C LYS A 28 61.076 -8.859 14.545 1.00 0.00 C ATOM 440 O LYS A 28 60.902 -8.815 13.343 1.00 0.00 O ATOM 441 CB LYS A 28 59.645 -7.698 16.256 1.00 0.00 C ATOM 442 CG LYS A 28 59.768 -6.818 17.508 1.00 0.00 C ATOM 443 CD LYS A 28 59.824 -5.344 17.102 1.00 0.00 C ATOM 444 CE LYS A 28 59.605 -4.463 18.334 1.00 0.00 C ATOM 445 NZ LYS A 28 59.705 -3.033 17.941 1.00 0.00 N ATOM 0 H LYS A 28 59.924 -6.172 14.199 1.00 0.00 H new ATOM 0 HA LYS A 28 61.791 -7.530 16.081 1.00 0.00 H new ATOM 0 HB2 LYS A 28 58.789 -7.379 15.661 1.00 0.00 H new ATOM 0 HB3 LYS A 28 59.464 -8.733 16.546 1.00 0.00 H new ATOM 0 HG2 LYS A 28 58.919 -6.990 18.170 1.00 0.00 H new ATOM 0 HG3 LYS A 28 60.666 -7.086 18.065 1.00 0.00 H new ATOM 0 HD2 LYS A 28 60.789 -5.118 16.648 1.00 0.00 H new ATOM 0 HD3 LYS A 28 59.061 -5.134 16.352 1.00 0.00 H new ATOM 0 HE2 LYS A 28 58.626 -4.664 18.770 1.00 0.00 H new ATOM 0 HE3 LYS A 28 60.348 -4.695 19.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 59.047 -2.468 18.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 60.677 -2.697 18.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 59.461 -2.931 16.935 1.00 0.00 H new ATOM 459 N LYS A 29 61.420 -9.968 15.142 1.00 0.00 N ATOM 460 CA LYS A 29 61.610 -11.223 14.356 1.00 0.00 C ATOM 461 C LYS A 29 60.315 -11.587 13.612 1.00 0.00 C ATOM 462 O LYS A 29 60.331 -11.852 12.428 1.00 0.00 O ATOM 463 CB LYS A 29 61.978 -12.348 15.330 1.00 0.00 C ATOM 464 CG LYS A 29 62.227 -13.651 14.570 1.00 0.00 C ATOM 465 CD LYS A 29 62.592 -14.752 15.573 1.00 0.00 C ATOM 466 CE LYS A 29 62.847 -16.071 14.839 1.00 0.00 C ATOM 467 NZ LYS A 29 61.850 -16.233 13.743 1.00 0.00 N ATOM 0 H LYS A 29 61.579 -10.060 16.145 1.00 0.00 H new ATOM 0 HA LYS A 29 62.402 -11.082 13.620 1.00 0.00 H new ATOM 0 HB2 LYS A 29 62.869 -12.072 15.894 1.00 0.00 H new ATOM 0 HB3 LYS A 29 61.174 -12.489 16.053 1.00 0.00 H new ATOM 0 HG2 LYS A 29 61.338 -13.934 14.007 1.00 0.00 H new ATOM 0 HG3 LYS A 29 63.032 -13.518 13.848 1.00 0.00 H new ATOM 0 HD2 LYS A 29 63.480 -14.462 16.135 1.00 0.00 H new ATOM 0 HD3 LYS A 29 61.785 -14.879 16.295 1.00 0.00 H new ATOM 0 HE2 LYS A 29 63.857 -16.082 14.430 1.00 0.00 H new ATOM 0 HE3 LYS A 29 62.776 -16.906 15.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 61.866 -17.215 13.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 60.900 -16.006 14.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 62.087 -15.591 12.960 1.00 0.00 H new ATOM 481 N SER A 30 59.195 -11.598 14.283 1.00 0.00 N ATOM 482 CA SER A 30 57.912 -11.938 13.591 1.00 0.00 C ATOM 483 C SER A 30 57.648 -10.928 12.463 1.00 0.00 C ATOM 484 O SER A 30 57.211 -11.279 11.386 1.00 0.00 O ATOM 485 CB SER A 30 56.767 -11.906 14.601 1.00 0.00 C ATOM 486 OG SER A 30 56.906 -13.005 15.491 1.00 0.00 O ATOM 0 H SER A 30 59.110 -11.387 15.277 1.00 0.00 H new ATOM 0 HA SER A 30 57.983 -12.937 13.161 1.00 0.00 H new ATOM 0 HB2 SER A 30 56.780 -10.968 15.156 1.00 0.00 H new ATOM 0 HB3 SER A 30 55.808 -11.958 14.085 1.00 0.00 H new ATOM 0 HG SER A 30 56.176 -12.991 16.144 1.00 0.00 H new ATOM 492 N GLU A 31 57.928 -9.680 12.716 1.00 0.00 N ATOM 493 CA GLU A 31 57.728 -8.626 11.678 1.00 0.00 C ATOM 494 C GLU A 31 58.778 -8.812 10.578 1.00 0.00 C ATOM 495 O GLU A 31 58.511 -8.641 9.403 1.00 0.00 O ATOM 496 CB GLU A 31 57.892 -7.249 12.326 1.00 0.00 C ATOM 497 CG GLU A 31 57.613 -6.148 11.299 1.00 0.00 C ATOM 498 CD GLU A 31 57.724 -4.789 11.986 1.00 0.00 C ATOM 499 OE1 GLU A 31 57.955 -4.772 13.184 1.00 0.00 O ATOM 500 OE2 GLU A 31 57.573 -3.791 11.306 1.00 0.00 O ATOM 0 H GLU A 31 58.291 -9.340 13.607 1.00 0.00 H new ATOM 0 HA GLU A 31 56.730 -8.704 11.246 1.00 0.00 H new ATOM 0 HB2 GLU A 31 57.209 -7.152 13.170 1.00 0.00 H new ATOM 0 HB3 GLU A 31 58.903 -7.142 12.720 1.00 0.00 H new ATOM 0 HG2 GLU A 31 58.324 -6.213 10.475 1.00 0.00 H new ATOM 0 HG3 GLU A 31 56.618 -6.274 10.872 1.00 0.00 H new ATOM 507 N LEU A 32 59.966 -9.177 10.972 1.00 0.00 N ATOM 508 CA LEU A 32 61.057 -9.394 9.982 1.00 0.00 C ATOM 509 C LEU A 32 60.647 -10.519 9.026 1.00 0.00 C ATOM 510 O LEU A 32 60.810 -10.421 7.825 1.00 0.00 O ATOM 511 CB LEU A 32 62.360 -9.770 10.711 1.00 0.00 C ATOM 512 CG LEU A 32 63.498 -9.987 9.700 1.00 0.00 C ATOM 513 CD1 LEU A 32 63.799 -8.677 8.956 1.00 0.00 C ATOM 514 CD2 LEU A 32 64.756 -10.455 10.445 1.00 0.00 C ATOM 0 H LEU A 32 60.230 -9.335 11.945 1.00 0.00 H new ATOM 0 HA LEU A 32 61.226 -8.478 9.416 1.00 0.00 H new ATOM 0 HB2 LEU A 32 62.633 -8.980 11.411 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.208 -10.677 11.297 1.00 0.00 H new ATOM 0 HG LEU A 32 63.196 -10.744 8.976 1.00 0.00 H new ATOM 0 HD11 LEU A 32 64.606 -8.841 8.242 1.00 0.00 H new ATOM 0 HD12 LEU A 32 62.906 -8.347 8.425 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.098 -7.912 9.673 1.00 0.00 H new ATOM 0 HD21 LEU A 32 65.565 -10.610 9.731 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.052 -9.697 11.170 1.00 0.00 H new ATOM 0 HD23 LEU A 32 64.545 -11.391 10.963 1.00 0.00 H new ATOM 526 N LYS A 33 60.119 -11.593 9.556 1.00 0.00 N ATOM 527 CA LYS A 33 59.706 -12.732 8.688 1.00 0.00 C ATOM 528 C LYS A 33 58.637 -12.277 7.692 1.00 0.00 C ATOM 529 O LYS A 33 58.646 -12.669 6.542 1.00 0.00 O ATOM 530 CB LYS A 33 59.153 -13.866 9.562 1.00 0.00 C ATOM 531 CG LYS A 33 58.797 -15.065 8.683 1.00 0.00 C ATOM 532 CD LYS A 33 58.252 -16.200 9.555 1.00 0.00 C ATOM 533 CE LYS A 33 57.913 -17.413 8.682 1.00 0.00 C ATOM 534 NZ LYS A 33 56.978 -18.309 9.422 1.00 0.00 N ATOM 0 H LYS A 33 59.957 -11.728 10.554 1.00 0.00 H new ATOM 0 HA LYS A 33 60.573 -13.090 8.132 1.00 0.00 H new ATOM 0 HB2 LYS A 33 59.892 -14.157 10.309 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.271 -13.524 10.103 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.054 -14.776 7.940 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.678 -15.403 8.138 1.00 0.00 H new ATOM 0 HD2 LYS A 33 58.990 -16.478 10.308 1.00 0.00 H new ATOM 0 HD3 LYS A 33 57.362 -15.865 10.089 1.00 0.00 H new ATOM 0 HE2 LYS A 33 57.458 -17.086 7.747 1.00 0.00 H new ATOM 0 HE3 LYS A 33 58.823 -17.954 8.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 56.800 -19.165 8.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 57.401 -18.575 10.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 56.080 -17.812 9.589 1.00 0.00 H new ATOM 548 N GLU A 34 57.710 -11.463 8.120 1.00 0.00 N ATOM 549 CA GLU A 34 56.641 -11.003 7.188 1.00 0.00 C ATOM 550 C GLU A 34 57.245 -10.200 6.031 1.00 0.00 C ATOM 551 O GLU A 34 56.910 -10.405 4.879 1.00 0.00 O ATOM 552 CB GLU A 34 55.634 -10.136 7.951 1.00 0.00 C ATOM 553 CG GLU A 34 54.833 -11.015 8.919 1.00 0.00 C ATOM 554 CD GLU A 34 53.900 -11.938 8.131 1.00 0.00 C ATOM 555 OE1 GLU A 34 53.416 -11.516 7.094 1.00 0.00 O ATOM 556 OE2 GLU A 34 53.681 -13.050 8.581 1.00 0.00 O ATOM 0 H GLU A 34 57.647 -11.098 9.070 1.00 0.00 H new ATOM 0 HA GLU A 34 56.134 -11.876 6.777 1.00 0.00 H new ATOM 0 HB2 GLU A 34 56.156 -9.353 8.501 1.00 0.00 H new ATOM 0 HB3 GLU A 34 54.961 -9.640 7.251 1.00 0.00 H new ATOM 0 HG2 GLU A 34 55.511 -11.607 9.533 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.253 -10.389 9.597 1.00 0.00 H new ATOM 563 N LEU A 35 58.128 -9.282 6.323 1.00 0.00 N ATOM 564 CA LEU A 35 58.747 -8.464 5.234 1.00 0.00 C ATOM 565 C LEU A 35 59.480 -9.377 4.249 1.00 0.00 C ATOM 566 O LEU A 35 59.306 -9.282 3.050 1.00 0.00 O ATOM 567 CB LEU A 35 59.738 -7.463 5.853 1.00 0.00 C ATOM 568 CG LEU A 35 60.406 -6.597 4.765 1.00 0.00 C ATOM 569 CD1 LEU A 35 59.384 -5.655 4.122 1.00 0.00 C ATOM 570 CD2 LEU A 35 61.519 -5.767 5.408 1.00 0.00 C ATOM 0 H LEU A 35 58.448 -9.062 7.266 1.00 0.00 H new ATOM 0 HA LEU A 35 57.967 -7.922 4.699 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.216 -6.821 6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 35 60.502 -8.002 6.413 1.00 0.00 H new ATOM 0 HG LEU A 35 60.814 -7.249 3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 35 59.875 -5.053 3.357 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.586 -6.241 3.666 1.00 0.00 H new ATOM 0 HD13 LEU A 35 58.963 -5.000 4.885 1.00 0.00 H new ATOM 0 HD21 LEU A 35 61.999 -5.150 4.648 1.00 0.00 H new ATOM 0 HD22 LEU A 35 61.095 -5.126 6.181 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.258 -6.433 5.854 1.00 0.00 H new ATOM 582 N ILE A 36 60.312 -10.250 4.744 1.00 0.00 N ATOM 583 CA ILE A 36 61.062 -11.155 3.832 1.00 0.00 C ATOM 584 C ILE A 36 60.075 -12.012 3.037 1.00 0.00 C ATOM 585 O ILE A 36 60.155 -12.111 1.831 1.00 0.00 O ATOM 586 CB ILE A 36 61.986 -12.055 4.661 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.003 -11.186 5.413 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.728 -13.023 3.736 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.764 -12.045 6.429 1.00 0.00 C ATOM 0 H ILE A 36 60.504 -10.375 5.738 1.00 0.00 H new ATOM 0 HA ILE A 36 61.660 -10.565 3.138 1.00 0.00 H new ATOM 0 HB ILE A 36 61.391 -12.624 5.376 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.701 -10.734 4.709 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.492 -10.369 5.923 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.384 -13.661 4.328 1.00 0.00 H new ATOM 0 HG22 ILE A 36 62.006 -13.641 3.201 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.323 -12.457 3.019 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.485 -11.425 6.961 1.00 0.00 H new ATOM 0 HD12 ILE A 36 63.060 -12.476 7.141 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.288 -12.846 5.908 1.00 0.00 H new ATOM 601 N ASN A 37 59.147 -12.634 3.706 1.00 0.00 N ATOM 602 CA ASN A 37 58.162 -13.493 2.993 1.00 0.00 C ATOM 603 C ASN A 37 57.338 -12.664 2.003 1.00 0.00 C ATOM 604 O ASN A 37 57.030 -13.112 0.918 1.00 0.00 O ATOM 605 CB ASN A 37 57.224 -14.144 4.014 1.00 0.00 C ATOM 606 CG ASN A 37 56.208 -15.033 3.288 1.00 0.00 C ATOM 607 OD1 ASN A 37 56.574 -15.829 2.445 1.00 0.00 O ATOM 608 ND2 ASN A 37 54.940 -14.930 3.584 1.00 0.00 N ATOM 0 H ASN A 37 59.027 -12.585 4.718 1.00 0.00 H new ATOM 0 HA ASN A 37 58.703 -14.261 2.440 1.00 0.00 H new ATOM 0 HB2 ASN A 37 57.799 -14.738 4.724 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.705 -13.376 4.587 1.00 0.00 H new ATOM 0 HD21 ASN A 37 54.256 -15.518 3.108 1.00 0.00 H new ATOM 0 HD22 ASN A 37 54.634 -14.262 4.291 1.00 0.00 H new ATOM 615 N ASN A 38 56.953 -11.473 2.377 1.00 0.00 N ATOM 616 CA ASN A 38 56.118 -10.639 1.461 1.00 0.00 C ATOM 617 C ASN A 38 56.967 -10.025 0.341 1.00 0.00 C ATOM 618 O ASN A 38 56.665 -10.172 -0.826 1.00 0.00 O ATOM 619 CB ASN A 38 55.462 -9.512 2.266 1.00 0.00 C ATOM 620 CG ASN A 38 54.443 -10.109 3.235 1.00 0.00 C ATOM 621 OD1 ASN A 38 53.946 -11.198 3.020 1.00 0.00 O ATOM 622 ND2 ASN A 38 54.108 -9.437 4.302 1.00 0.00 N ATOM 0 H ASN A 38 57.179 -11.042 3.273 1.00 0.00 H new ATOM 0 HA ASN A 38 55.360 -11.279 1.009 1.00 0.00 H new ATOM 0 HB2 ASN A 38 56.220 -8.954 2.816 1.00 0.00 H new ATOM 0 HB3 ASN A 38 54.972 -8.807 1.594 1.00 0.00 H new ATOM 0 HD21 ASN A 38 53.429 -9.825 4.957 1.00 0.00 H new ATOM 0 HD22 ASN A 38 54.525 -8.524 4.481 1.00 0.00 H new ATOM 629 N GLU A 39 57.998 -9.298 0.683 1.00 0.00 N ATOM 630 CA GLU A 39 58.824 -8.628 -0.370 1.00 0.00 C ATOM 631 C GLU A 39 59.934 -9.542 -0.901 1.00 0.00 C ATOM 632 O GLU A 39 59.862 -10.031 -2.012 1.00 0.00 O ATOM 633 CB GLU A 39 59.461 -7.371 0.225 1.00 0.00 C ATOM 634 CG GLU A 39 58.381 -6.318 0.473 1.00 0.00 C ATOM 635 CD GLU A 39 59.019 -5.064 1.074 1.00 0.00 C ATOM 636 OE1 GLU A 39 60.232 -5.048 1.206 1.00 0.00 O ATOM 637 OE2 GLU A 39 58.287 -4.144 1.395 1.00 0.00 O ATOM 0 H GLU A 39 58.305 -9.138 1.643 1.00 0.00 H new ATOM 0 HA GLU A 39 58.167 -8.380 -1.203 1.00 0.00 H new ATOM 0 HB2 GLU A 39 59.967 -7.615 1.159 1.00 0.00 H new ATOM 0 HB3 GLU A 39 60.217 -6.978 -0.454 1.00 0.00 H new ATOM 0 HG2 GLU A 39 57.878 -6.071 -0.462 1.00 0.00 H new ATOM 0 HG3 GLU A 39 57.622 -6.712 1.149 1.00 0.00 H new ATOM 644 N LEU A 40 60.986 -9.741 -0.148 1.00 0.00 N ATOM 645 CA LEU A 40 62.112 -10.581 -0.659 1.00 0.00 C ATOM 646 C LEU A 40 61.813 -12.069 -0.463 1.00 0.00 C ATOM 647 O LEU A 40 62.057 -12.636 0.581 1.00 0.00 O ATOM 648 CB LEU A 40 63.395 -10.208 0.092 1.00 0.00 C ATOM 649 CG LEU A 40 64.584 -11.021 -0.442 1.00 0.00 C ATOM 650 CD1 LEU A 40 64.837 -10.686 -1.925 1.00 0.00 C ATOM 651 CD2 LEU A 40 65.833 -10.687 0.381 1.00 0.00 C ATOM 0 H LEU A 40 61.114 -9.362 0.790 1.00 0.00 H new ATOM 0 HA LEU A 40 62.236 -10.395 -1.726 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.594 -9.142 -0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 40 63.267 -10.396 1.158 1.00 0.00 H new ATOM 0 HG LEU A 40 64.358 -12.084 -0.357 1.00 0.00 H new ATOM 0 HD11 LEU A 40 65.682 -11.269 -2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 40 63.949 -10.928 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 40 65.059 -9.624 -2.025 1.00 0.00 H new ATOM 0 HD21 LEU A 40 66.680 -11.261 0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 40 66.051 -9.622 0.296 1.00 0.00 H new ATOM 0 HD23 LEU A 40 65.658 -10.939 1.427 1.00 0.00 H new ATOM 663 N SER A 41 61.307 -12.705 -1.482 1.00 0.00 N ATOM 664 CA SER A 41 61.002 -14.163 -1.402 1.00 0.00 C ATOM 665 C SER A 41 61.221 -14.787 -2.783 1.00 0.00 C ATOM 666 O SER A 41 61.620 -15.929 -2.909 1.00 0.00 O ATOM 667 CB SER A 41 59.549 -14.356 -0.970 1.00 0.00 C ATOM 668 OG SER A 41 59.301 -13.579 0.193 1.00 0.00 O ATOM 0 H SER A 41 61.089 -12.272 -2.379 1.00 0.00 H new ATOM 0 HA SER A 41 61.655 -14.643 -0.674 1.00 0.00 H new ATOM 0 HB2 SER A 41 58.875 -14.056 -1.773 1.00 0.00 H new ATOM 0 HB3 SER A 41 59.354 -15.409 -0.767 1.00 0.00 H new ATOM 0 HG SER A 41 60.123 -13.509 0.721 1.00 0.00 H new ATOM 674 N HIS A 42 60.948 -14.040 -3.818 1.00 0.00 N ATOM 675 CA HIS A 42 61.115 -14.558 -5.204 1.00 0.00 C ATOM 676 C HIS A 42 62.581 -14.920 -5.467 1.00 0.00 C ATOM 677 O HIS A 42 62.890 -15.582 -6.439 1.00 0.00 O ATOM 678 CB HIS A 42 60.669 -13.482 -6.198 1.00 0.00 C ATOM 679 CG HIS A 42 60.728 -14.031 -7.597 1.00 0.00 C ATOM 680 ND1 HIS A 42 61.805 -13.799 -8.439 1.00 0.00 N ATOM 681 CD2 HIS A 42 59.847 -14.801 -8.316 1.00 0.00 C ATOM 682 CE1 HIS A 42 61.547 -14.419 -9.607 1.00 0.00 C ATOM 683 NE2 HIS A 42 60.369 -15.042 -9.581 1.00 0.00 N ATOM 0 H HIS A 42 60.611 -13.079 -3.760 1.00 0.00 H new ATOM 0 HA HIS A 42 60.506 -15.454 -5.325 1.00 0.00 H new ATOM 0 HB2 HIS A 42 59.655 -13.157 -5.967 1.00 0.00 H new ATOM 0 HB3 HIS A 42 61.312 -12.606 -6.113 1.00 0.00 H new ATOM 0 HD2 HIS A 42 58.896 -15.163 -7.954 1.00 0.00 H new ATOM 0 HE1 HIS A 42 62.212 -14.412 -10.458 1.00 0.00 H new ATOM 0 HE2 HIS A 42 59.940 -15.583 -10.332 1.00 0.00 H new ATOM 692 N PHE A 43 63.490 -14.503 -4.614 1.00 0.00 N ATOM 693 CA PHE A 43 64.940 -14.837 -4.818 1.00 0.00 C ATOM 694 C PHE A 43 65.397 -15.818 -3.736 1.00 0.00 C ATOM 695 O PHE A 43 66.458 -16.408 -3.830 1.00 0.00 O ATOM 696 CB PHE A 43 65.780 -13.564 -4.703 1.00 0.00 C ATOM 697 CG PHE A 43 65.499 -12.654 -5.875 1.00 0.00 C ATOM 698 CD1 PHE A 43 66.257 -12.770 -7.047 1.00 0.00 C ATOM 699 CD2 PHE A 43 64.482 -11.695 -5.791 1.00 0.00 C ATOM 700 CE1 PHE A 43 65.999 -11.925 -8.134 1.00 0.00 C ATOM 701 CE2 PHE A 43 64.223 -10.852 -6.878 1.00 0.00 C ATOM 702 CZ PHE A 43 64.981 -10.966 -8.049 1.00 0.00 C ATOM 0 H PHE A 43 63.290 -13.945 -3.784 1.00 0.00 H new ATOM 0 HA PHE A 43 65.066 -15.282 -5.805 1.00 0.00 H new ATOM 0 HB2 PHE A 43 65.551 -13.050 -3.769 1.00 0.00 H new ATOM 0 HB3 PHE A 43 66.840 -13.818 -4.675 1.00 0.00 H new ATOM 0 HD1 PHE A 43 67.040 -13.511 -7.113 1.00 0.00 H new ATOM 0 HD2 PHE A 43 63.897 -11.606 -4.887 1.00 0.00 H new ATOM 0 HE1 PHE A 43 66.585 -12.013 -9.037 1.00 0.00 H new ATOM 0 HE2 PHE A 43 63.438 -10.113 -6.813 1.00 0.00 H new ATOM 0 HZ PHE A 43 64.781 -10.315 -8.887 1.00 0.00 H new ATOM 712 N LEU A 44 64.605 -15.993 -2.708 1.00 0.00 N ATOM 713 CA LEU A 44 64.979 -16.929 -1.598 1.00 0.00 C ATOM 714 C LEU A 44 64.063 -18.156 -1.638 1.00 0.00 C ATOM 715 O LEU A 44 64.366 -19.146 -2.271 1.00 0.00 O ATOM 716 CB LEU A 44 64.804 -16.206 -0.251 1.00 0.00 C ATOM 717 CG LEU A 44 66.058 -15.384 0.072 1.00 0.00 C ATOM 718 CD1 LEU A 44 66.265 -14.298 -0.997 1.00 0.00 C ATOM 719 CD2 LEU A 44 65.882 -14.732 1.449 1.00 0.00 C ATOM 0 H LEU A 44 63.707 -15.524 -2.587 1.00 0.00 H new ATOM 0 HA LEU A 44 66.016 -17.245 -1.715 1.00 0.00 H new ATOM 0 HB2 LEU A 44 63.932 -15.553 -0.290 1.00 0.00 H new ATOM 0 HB3 LEU A 44 64.623 -16.933 0.540 1.00 0.00 H new ATOM 0 HG LEU A 44 66.932 -16.036 0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 44 67.158 -13.719 -0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 44 66.386 -14.767 -1.974 1.00 0.00 H new ATOM 0 HD13 LEU A 44 65.399 -13.637 -1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 44 66.768 -14.145 1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 44 65.008 -14.081 1.434 1.00 0.00 H new ATOM 0 HD23 LEU A 44 65.745 -15.507 2.203 1.00 0.00 H new ATOM 731 N GLU A 45 62.954 -18.097 -0.951 1.00 0.00 N ATOM 732 CA GLU A 45 62.017 -19.252 -0.924 1.00 0.00 C ATOM 733 C GLU A 45 62.722 -20.456 -0.294 1.00 0.00 C ATOM 734 O GLU A 45 62.218 -21.559 -0.295 1.00 0.00 O ATOM 735 CB GLU A 45 61.567 -19.584 -2.352 1.00 0.00 C ATOM 736 CG GLU A 45 60.274 -20.410 -2.312 1.00 0.00 C ATOM 737 CD GLU A 45 59.792 -20.679 -3.738 1.00 0.00 C ATOM 738 OE1 GLU A 45 59.035 -19.871 -4.248 1.00 0.00 O ATOM 739 OE2 GLU A 45 60.188 -21.688 -4.296 1.00 0.00 O ATOM 0 H GLU A 45 62.656 -17.290 -0.403 1.00 0.00 H new ATOM 0 HA GLU A 45 61.138 -19.002 -0.331 1.00 0.00 H new ATOM 0 HB2 GLU A 45 61.405 -18.665 -2.915 1.00 0.00 H new ATOM 0 HB3 GLU A 45 62.349 -20.140 -2.869 1.00 0.00 H new ATOM 0 HG2 GLU A 45 60.449 -21.352 -1.793 1.00 0.00 H new ATOM 0 HG3 GLU A 45 59.506 -19.875 -1.753 1.00 0.00 H new ATOM 746 N GLU A 46 63.893 -20.245 0.254 1.00 0.00 N ATOM 747 CA GLU A 46 64.639 -21.365 0.895 1.00 0.00 C ATOM 748 C GLU A 46 64.304 -21.407 2.389 1.00 0.00 C ATOM 749 O GLU A 46 64.583 -22.374 3.070 1.00 0.00 O ATOM 750 CB GLU A 46 66.146 -21.146 0.708 1.00 0.00 C ATOM 751 CG GLU A 46 66.919 -22.321 1.311 1.00 0.00 C ATOM 752 CD GLU A 46 68.404 -22.187 0.971 1.00 0.00 C ATOM 753 OE1 GLU A 46 68.743 -21.278 0.231 1.00 0.00 O ATOM 754 OE2 GLU A 46 69.177 -22.998 1.456 1.00 0.00 O ATOM 0 H GLU A 46 64.364 -19.341 0.284 1.00 0.00 H new ATOM 0 HA GLU A 46 64.352 -22.310 0.433 1.00 0.00 H new ATOM 0 HB2 GLU A 46 66.380 -21.051 -0.352 1.00 0.00 H new ATOM 0 HB3 GLU A 46 66.450 -20.215 1.187 1.00 0.00 H new ATOM 0 HG2 GLU A 46 66.784 -22.342 2.392 1.00 0.00 H new ATOM 0 HG3 GLU A 46 66.530 -23.263 0.923 1.00 0.00 H new ATOM 761 N ILE A 47 63.709 -20.364 2.911 1.00 0.00 N ATOM 762 CA ILE A 47 63.372 -20.356 4.367 1.00 0.00 C ATOM 763 C ILE A 47 62.021 -21.038 4.584 1.00 0.00 C ATOM 764 O ILE A 47 61.004 -20.580 4.097 1.00 0.00 O ATOM 765 CB ILE A 47 63.282 -18.911 4.866 1.00 0.00 C ATOM 766 CG1 ILE A 47 64.624 -18.215 4.645 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.952 -18.905 6.365 1.00 0.00 C ATOM 768 CD1 ILE A 47 64.476 -16.719 4.926 1.00 0.00 C ATOM 0 H ILE A 47 63.444 -19.524 2.397 1.00 0.00 H new ATOM 0 HA ILE A 47 64.149 -20.889 4.916 1.00 0.00 H new ATOM 0 HB ILE A 47 62.500 -18.386 4.318 1.00 0.00 H new ATOM 0 HG12 ILE A 47 65.381 -18.646 5.300 1.00 0.00 H new ATOM 0 HG13 ILE A 47 64.962 -18.372 3.621 1.00 0.00 H new ATOM 0 HG21 ILE A 47 62.888 -17.876 6.719 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.998 -19.405 6.529 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.736 -19.429 6.912 1.00 0.00 H new ATOM 0 HD11 ILE A 47 65.434 -16.223 4.768 1.00 0.00 H new ATOM 0 HD12 ILE A 47 63.732 -16.294 4.252 1.00 0.00 H new ATOM 0 HD13 ILE A 47 64.157 -16.572 5.958 1.00 0.00 H new ATOM 780 N LYS A 48 62.002 -22.126 5.318 1.00 0.00 N ATOM 781 CA LYS A 48 60.717 -22.849 5.585 1.00 0.00 C ATOM 782 C LYS A 48 60.531 -23.039 7.095 1.00 0.00 C ATOM 783 O LYS A 48 59.421 -23.152 7.577 1.00 0.00 O ATOM 784 CB LYS A 48 60.763 -24.223 4.915 1.00 0.00 C ATOM 785 CG LYS A 48 60.727 -24.061 3.396 1.00 0.00 C ATOM 786 CD LYS A 48 60.774 -25.442 2.740 1.00 0.00 C ATOM 787 CE LYS A 48 60.744 -25.292 1.217 1.00 0.00 C ATOM 788 NZ LYS A 48 61.953 -24.544 0.769 1.00 0.00 N ATOM 0 H LYS A 48 62.827 -22.547 5.746 1.00 0.00 H new ATOM 0 HA LYS A 48 59.888 -22.265 5.186 1.00 0.00 H new ATOM 0 HB2 LYS A 48 61.669 -24.752 5.212 1.00 0.00 H new ATOM 0 HB3 LYS A 48 59.918 -24.827 5.245 1.00 0.00 H new ATOM 0 HG2 LYS A 48 59.821 -23.534 3.096 1.00 0.00 H new ATOM 0 HG3 LYS A 48 61.572 -23.458 3.063 1.00 0.00 H new ATOM 0 HD2 LYS A 48 61.678 -25.969 3.045 1.00 0.00 H new ATOM 0 HD3 LYS A 48 59.927 -26.042 3.073 1.00 0.00 H new ATOM 0 HE2 LYS A 48 60.714 -26.274 0.744 1.00 0.00 H new ATOM 0 HE3 LYS A 48 59.841 -24.763 0.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 62.358 -25.008 -0.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 61.688 -23.567 0.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 62.658 -24.534 1.533 1.00 0.00 H new ATOM 802 N GLU A 49 61.610 -23.097 7.843 1.00 0.00 N ATOM 803 CA GLU A 49 61.507 -23.306 9.326 1.00 0.00 C ATOM 804 C GLU A 49 61.925 -22.041 10.078 1.00 0.00 C ATOM 805 O GLU A 49 62.767 -21.288 9.634 1.00 0.00 O ATOM 806 CB GLU A 49 62.434 -24.453 9.745 1.00 0.00 C ATOM 807 CG GLU A 49 61.895 -25.778 9.203 1.00 0.00 C ATOM 808 CD GLU A 49 62.179 -25.882 7.702 1.00 0.00 C ATOM 809 OE1 GLU A 49 62.917 -25.053 7.196 1.00 0.00 O ATOM 810 OE2 GLU A 49 61.647 -26.788 7.083 1.00 0.00 O ATOM 0 H GLU A 49 62.562 -23.008 7.488 1.00 0.00 H new ATOM 0 HA GLU A 49 60.472 -23.544 9.570 1.00 0.00 H new ATOM 0 HB2 GLU A 49 63.440 -24.277 9.366 1.00 0.00 H new ATOM 0 HB3 GLU A 49 62.506 -24.496 10.832 1.00 0.00 H new ATOM 0 HG2 GLU A 49 62.360 -26.612 9.728 1.00 0.00 H new ATOM 0 HG3 GLU A 49 60.822 -25.846 9.384 1.00 0.00 H new ATOM 817 N GLN A 50 61.343 -21.820 11.227 1.00 0.00 N ATOM 818 CA GLN A 50 61.699 -20.623 12.044 1.00 0.00 C ATOM 819 C GLN A 50 63.184 -20.678 12.410 1.00 0.00 C ATOM 820 O GLN A 50 63.869 -19.675 12.438 1.00 0.00 O ATOM 821 CB GLN A 50 60.855 -20.601 13.322 1.00 0.00 C ATOM 822 CG GLN A 50 59.400 -20.276 12.974 1.00 0.00 C ATOM 823 CD GLN A 50 59.295 -18.809 12.547 1.00 0.00 C ATOM 824 OE1 GLN A 50 58.762 -18.503 11.499 1.00 0.00 O ATOM 825 NE2 GLN A 50 59.785 -17.880 13.324 1.00 0.00 N ATOM 0 H GLN A 50 60.630 -22.423 11.638 1.00 0.00 H new ATOM 0 HA GLN A 50 61.501 -19.720 11.467 1.00 0.00 H new ATOM 0 HB2 GLN A 50 60.912 -21.567 13.824 1.00 0.00 H new ATOM 0 HB3 GLN A 50 61.248 -19.858 14.016 1.00 0.00 H new ATOM 0 HG2 GLN A 50 59.053 -20.926 12.171 1.00 0.00 H new ATOM 0 HG3 GLN A 50 58.758 -20.463 13.835 1.00 0.00 H new ATOM 0 HE21 GLN A 50 60.233 -18.135 14.204 1.00 0.00 H new ATOM 0 HE22 GLN A 50 59.720 -16.900 13.050 1.00 0.00 H new ATOM 834 N GLU A 51 63.675 -21.843 12.729 1.00 0.00 N ATOM 835 CA GLU A 51 65.104 -21.972 13.135 1.00 0.00 C ATOM 836 C GLU A 51 66.022 -21.378 12.065 1.00 0.00 C ATOM 837 O GLU A 51 67.053 -20.811 12.373 1.00 0.00 O ATOM 838 CB GLU A 51 65.456 -23.450 13.335 1.00 0.00 C ATOM 839 CG GLU A 51 64.752 -23.983 14.584 1.00 0.00 C ATOM 840 CD GLU A 51 65.110 -25.458 14.775 1.00 0.00 C ATOM 841 OE1 GLU A 51 65.702 -26.027 13.870 1.00 0.00 O ATOM 842 OE2 GLU A 51 64.796 -25.991 15.824 1.00 0.00 O ATOM 0 H GLU A 51 63.146 -22.715 12.726 1.00 0.00 H new ATOM 0 HA GLU A 51 65.247 -21.428 14.069 1.00 0.00 H new ATOM 0 HB2 GLU A 51 65.154 -24.027 12.461 1.00 0.00 H new ATOM 0 HB3 GLU A 51 66.535 -23.566 13.436 1.00 0.00 H new ATOM 0 HG2 GLU A 51 65.054 -23.407 15.459 1.00 0.00 H new ATOM 0 HG3 GLU A 51 63.673 -23.869 14.484 1.00 0.00 H new ATOM 849 N VAL A 52 65.654 -21.475 10.820 1.00 0.00 N ATOM 850 CA VAL A 52 66.500 -20.890 9.740 1.00 0.00 C ATOM 851 C VAL A 52 66.553 -19.369 9.915 1.00 0.00 C ATOM 852 O VAL A 52 67.561 -18.738 9.666 1.00 0.00 O ATOM 853 CB VAL A 52 65.889 -21.237 8.380 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.661 -20.527 7.268 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.960 -22.750 8.167 1.00 0.00 C ATOM 0 H VAL A 52 64.802 -21.935 10.501 1.00 0.00 H new ATOM 0 HA VAL A 52 67.510 -21.295 9.794 1.00 0.00 H new ATOM 0 HB VAL A 52 64.849 -20.911 8.356 1.00 0.00 H new ATOM 0 HG11 VAL A 52 66.222 -20.778 6.303 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.610 -19.449 7.421 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.703 -20.847 7.287 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.526 -23.002 7.199 1.00 0.00 H new ATOM 0 HG22 VAL A 52 67.001 -23.073 8.193 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.404 -23.255 8.957 1.00 0.00 H new ATOM 865 N VAL A 53 65.473 -18.784 10.361 1.00 0.00 N ATOM 866 CA VAL A 53 65.456 -17.307 10.580 1.00 0.00 C ATOM 867 C VAL A 53 66.341 -16.966 11.787 1.00 0.00 C ATOM 868 O VAL A 53 67.038 -15.971 11.803 1.00 0.00 O ATOM 869 CB VAL A 53 64.023 -16.826 10.838 1.00 0.00 C ATOM 870 CG1 VAL A 53 64.041 -15.343 11.221 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.186 -17.012 9.571 1.00 0.00 C ATOM 0 H VAL A 53 64.601 -19.265 10.583 1.00 0.00 H new ATOM 0 HA VAL A 53 65.838 -16.807 9.690 1.00 0.00 H new ATOM 0 HB VAL A 53 63.588 -17.407 11.651 1.00 0.00 H new ATOM 0 HG11 VAL A 53 63.022 -15.002 11.404 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.637 -15.208 12.124 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.477 -14.763 10.408 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.167 -16.670 9.754 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.623 -16.432 8.758 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.171 -18.067 9.297 1.00 0.00 H new ATOM 881 N ASP A 54 66.282 -17.774 12.812 1.00 0.00 N ATOM 882 CA ASP A 54 67.079 -17.492 14.042 1.00 0.00 C ATOM 883 C ASP A 54 68.566 -17.446 13.709 1.00 0.00 C ATOM 884 O ASP A 54 69.277 -16.561 14.142 1.00 0.00 O ATOM 885 CB ASP A 54 66.835 -18.610 15.060 1.00 0.00 C ATOM 886 CG ASP A 54 65.360 -18.630 15.462 1.00 0.00 C ATOM 887 OD1 ASP A 54 64.530 -18.365 14.608 1.00 0.00 O ATOM 888 OD2 ASP A 54 65.088 -18.907 16.618 1.00 0.00 O ATOM 0 H ASP A 54 65.714 -18.620 12.851 1.00 0.00 H new ATOM 0 HA ASP A 54 66.773 -16.529 14.451 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.118 -19.572 14.633 1.00 0.00 H new ATOM 0 HB3 ASP A 54 67.459 -18.456 15.940 1.00 0.00 H new ATOM 893 N LYS A 55 69.046 -18.373 12.937 1.00 0.00 N ATOM 894 CA LYS A 55 70.490 -18.346 12.577 1.00 0.00 C ATOM 895 C LYS A 55 70.775 -17.069 11.787 1.00 0.00 C ATOM 896 O LYS A 55 71.702 -16.337 12.070 1.00 0.00 O ATOM 897 CB LYS A 55 70.823 -19.577 11.730 1.00 0.00 C ATOM 898 CG LYS A 55 72.322 -19.625 11.423 1.00 0.00 C ATOM 899 CD LYS A 55 72.628 -20.901 10.625 1.00 0.00 C ATOM 900 CE LYS A 55 74.131 -21.012 10.380 1.00 0.00 C ATOM 901 NZ LYS A 55 74.456 -22.394 9.926 1.00 0.00 N ATOM 0 H LYS A 55 68.508 -19.144 12.541 1.00 0.00 H new ATOM 0 HA LYS A 55 71.105 -18.360 13.477 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.525 -20.482 12.259 1.00 0.00 H new ATOM 0 HB3 LYS A 55 70.256 -19.550 10.800 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.618 -18.744 10.853 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.897 -19.613 12.349 1.00 0.00 H new ATOM 0 HD2 LYS A 55 72.274 -21.776 11.171 1.00 0.00 H new ATOM 0 HD3 LYS A 55 72.096 -20.882 9.674 1.00 0.00 H new ATOM 0 HE2 LYS A 55 74.443 -20.287 9.628 1.00 0.00 H new ATOM 0 HE3 LYS A 55 74.678 -20.779 11.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 75.479 -22.473 9.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 74.172 -23.076 10.658 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.944 -22.599 9.044 1.00 0.00 H new ATOM 915 N VAL A 56 69.974 -16.805 10.793 1.00 0.00 N ATOM 916 CA VAL A 56 70.179 -15.586 9.961 1.00 0.00 C ATOM 917 C VAL A 56 69.973 -14.323 10.804 1.00 0.00 C ATOM 918 O VAL A 56 70.701 -13.365 10.676 1.00 0.00 O ATOM 919 CB VAL A 56 69.178 -15.594 8.802 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.270 -14.279 8.013 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.487 -16.775 7.877 1.00 0.00 C ATOM 0 H VAL A 56 69.181 -17.385 10.519 1.00 0.00 H new ATOM 0 HA VAL A 56 71.198 -15.587 9.574 1.00 0.00 H new ATOM 0 HB VAL A 56 68.168 -15.693 9.200 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.554 -14.297 7.192 1.00 0.00 H new ATOM 0 HG12 VAL A 56 69.044 -13.442 8.674 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.278 -14.164 7.613 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.777 -16.785 7.050 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.499 -16.675 7.485 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.405 -17.707 8.437 1.00 0.00 H new ATOM 931 N MET A 57 68.979 -14.304 11.649 1.00 0.00 N ATOM 932 CA MET A 57 68.729 -13.084 12.475 1.00 0.00 C ATOM 933 C MET A 57 69.941 -12.765 13.360 1.00 0.00 C ATOM 934 O MET A 57 70.386 -11.637 13.432 1.00 0.00 O ATOM 935 CB MET A 57 67.496 -13.312 13.350 1.00 0.00 C ATOM 936 CG MET A 57 67.101 -11.998 14.023 1.00 0.00 C ATOM 937 SD MET A 57 65.555 -12.230 14.931 1.00 0.00 S ATOM 938 CE MET A 57 65.153 -10.476 15.131 1.00 0.00 C ATOM 0 H MET A 57 68.330 -15.076 11.804 1.00 0.00 H new ATOM 0 HA MET A 57 68.561 -12.238 11.809 1.00 0.00 H new ATOM 0 HB2 MET A 57 66.671 -13.685 12.744 1.00 0.00 H new ATOM 0 HB3 MET A 57 67.707 -14.071 14.104 1.00 0.00 H new ATOM 0 HG2 MET A 57 67.889 -11.673 14.702 1.00 0.00 H new ATOM 0 HG3 MET A 57 66.982 -11.215 13.275 1.00 0.00 H new ATOM 0 HE1 MET A 57 64.458 -10.354 15.962 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.065 -9.915 15.336 1.00 0.00 H new ATOM 0 HE3 MET A 57 64.694 -10.101 14.216 1.00 0.00 H new ATOM 948 N GLU A 58 70.467 -13.739 14.047 1.00 0.00 N ATOM 949 CA GLU A 58 71.641 -13.482 14.941 1.00 0.00 C ATOM 950 C GLU A 58 72.812 -12.945 14.113 1.00 0.00 C ATOM 951 O GLU A 58 73.453 -11.976 14.473 1.00 0.00 O ATOM 952 CB GLU A 58 72.059 -14.792 15.614 1.00 0.00 C ATOM 953 CG GLU A 58 73.191 -14.525 16.608 1.00 0.00 C ATOM 954 CD GLU A 58 73.598 -15.840 17.274 1.00 0.00 C ATOM 955 OE1 GLU A 58 72.915 -16.827 17.053 1.00 0.00 O ATOM 956 OE2 GLU A 58 74.588 -15.838 17.989 1.00 0.00 O ATOM 0 H GLU A 58 70.138 -14.704 14.031 1.00 0.00 H new ATOM 0 HA GLU A 58 71.366 -12.748 15.698 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.207 -15.235 16.129 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.385 -15.510 14.862 1.00 0.00 H new ATOM 0 HG2 GLU A 58 74.045 -14.084 16.094 1.00 0.00 H new ATOM 0 HG3 GLU A 58 72.867 -13.807 17.362 1.00 0.00 H new ATOM 963 N THR A 59 73.090 -13.570 13.007 1.00 0.00 N ATOM 964 CA THR A 59 74.208 -13.113 12.133 1.00 0.00 C ATOM 965 C THR A 59 73.956 -11.679 11.653 1.00 0.00 C ATOM 966 O THR A 59 74.866 -10.879 11.559 1.00 0.00 O ATOM 967 CB THR A 59 74.330 -14.050 10.927 1.00 0.00 C ATOM 968 OG1 THR A 59 74.618 -15.368 11.380 1.00 0.00 O ATOM 969 CG2 THR A 59 75.448 -13.564 10.002 1.00 0.00 C ATOM 0 H THR A 59 72.586 -14.388 12.665 1.00 0.00 H new ATOM 0 HA THR A 59 75.136 -13.132 12.704 1.00 0.00 H new ATOM 0 HB THR A 59 73.390 -14.053 10.375 1.00 0.00 H new ATOM 0 HG1 THR A 59 73.785 -15.813 11.641 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.530 -14.234 9.146 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.220 -12.557 9.653 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.392 -13.554 10.547 1.00 0.00 H new ATOM 977 N LEU A 60 72.733 -11.356 11.336 1.00 0.00 N ATOM 978 CA LEU A 60 72.433 -9.976 10.844 1.00 0.00 C ATOM 979 C LEU A 60 72.581 -8.953 11.970 1.00 0.00 C ATOM 980 O LEU A 60 73.080 -7.865 11.763 1.00 0.00 O ATOM 981 CB LEU A 60 70.996 -9.915 10.323 1.00 0.00 C ATOM 982 CG LEU A 60 70.856 -10.724 9.028 1.00 0.00 C ATOM 983 CD1 LEU A 60 69.370 -10.826 8.684 1.00 0.00 C ATOM 984 CD2 LEU A 60 71.611 -10.040 7.873 1.00 0.00 C ATOM 0 H LEU A 60 71.930 -11.982 11.395 1.00 0.00 H new ATOM 0 HA LEU A 60 73.139 -9.741 10.047 1.00 0.00 H new ATOM 0 HB2 LEU A 60 70.313 -10.305 11.078 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.713 -8.878 10.143 1.00 0.00 H new ATOM 0 HG LEU A 60 71.284 -11.716 9.171 1.00 0.00 H new ATOM 0 HD11 LEU A 60 69.248 -11.399 7.765 1.00 0.00 H new ATOM 0 HD12 LEU A 60 68.842 -11.326 9.496 1.00 0.00 H new ATOM 0 HD13 LEU A 60 68.959 -9.826 8.546 1.00 0.00 H new ATOM 0 HD21 LEU A 60 71.498 -10.631 6.964 1.00 0.00 H new ATOM 0 HD22 LEU A 60 71.202 -9.043 7.711 1.00 0.00 H new ATOM 0 HD23 LEU A 60 72.668 -9.961 8.126 1.00 0.00 H new ATOM 996 N ASP A 61 72.148 -9.277 13.152 1.00 0.00 N ATOM 997 CA ASP A 61 72.256 -8.296 14.270 1.00 0.00 C ATOM 998 C ASP A 61 73.726 -8.061 14.616 1.00 0.00 C ATOM 999 O ASP A 61 74.360 -8.862 15.276 1.00 0.00 O ATOM 1000 CB ASP A 61 71.512 -8.840 15.490 1.00 0.00 C ATOM 1001 CG ASP A 61 70.005 -8.818 15.218 1.00 0.00 C ATOM 1002 OD1 ASP A 61 69.587 -8.053 14.362 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.295 -9.566 15.868 1.00 0.00 O ATOM 0 H ASP A 61 71.726 -10.173 13.395 1.00 0.00 H new ATOM 0 HA ASP A 61 71.812 -7.348 13.967 1.00 0.00 H new ATOM 0 HB2 ASP A 61 71.839 -9.857 15.705 1.00 0.00 H new ATOM 0 HB3 ASP A 61 71.743 -8.238 16.369 1.00 0.00 H new ATOM 1008 N GLU A 62 74.277 -6.969 14.160 1.00 0.00 N ATOM 1009 CA GLU A 62 75.711 -6.691 14.443 1.00 0.00 C ATOM 1010 C GLU A 62 75.927 -6.611 15.954 1.00 0.00 C ATOM 1011 O GLU A 62 76.917 -7.092 16.475 1.00 0.00 O ATOM 1012 CB GLU A 62 76.117 -5.355 13.806 1.00 0.00 C ATOM 1013 CG GLU A 62 76.134 -5.492 12.281 1.00 0.00 C ATOM 1014 CD GLU A 62 76.530 -4.154 11.653 1.00 0.00 C ATOM 1015 OE1 GLU A 62 76.787 -3.224 12.399 1.00 0.00 O ATOM 1016 OE2 GLU A 62 76.571 -4.083 10.436 1.00 0.00 O ATOM 0 H GLU A 62 73.797 -6.260 13.606 1.00 0.00 H new ATOM 0 HA GLU A 62 76.319 -7.493 14.025 1.00 0.00 H new ATOM 0 HB2 GLU A 62 75.418 -4.573 14.102 1.00 0.00 H new ATOM 0 HB3 GLU A 62 77.102 -5.055 14.164 1.00 0.00 H new ATOM 0 HG2 GLU A 62 76.838 -6.268 11.983 1.00 0.00 H new ATOM 0 HG3 GLU A 62 75.151 -5.798 11.922 1.00 0.00 H new ATOM 1023 N ASP A 63 75.017 -5.996 16.663 1.00 0.00 N ATOM 1024 CA ASP A 63 75.176 -5.864 18.146 1.00 0.00 C ATOM 1025 C ASP A 63 74.404 -6.963 18.891 1.00 0.00 C ATOM 1026 O ASP A 63 74.484 -7.068 20.100 1.00 0.00 O ATOM 1027 CB ASP A 63 74.662 -4.489 18.578 1.00 0.00 C ATOM 1028 CG ASP A 63 73.177 -4.363 18.247 1.00 0.00 C ATOM 1029 OD1 ASP A 63 72.656 -5.256 17.602 1.00 0.00 O ATOM 1030 OD2 ASP A 63 72.590 -3.368 18.637 1.00 0.00 O ATOM 0 H ASP A 63 74.169 -5.578 16.281 1.00 0.00 H new ATOM 0 HA ASP A 63 76.232 -5.970 18.395 1.00 0.00 H new ATOM 0 HB2 ASP A 63 74.818 -4.352 19.648 1.00 0.00 H new ATOM 0 HB3 ASP A 63 75.224 -3.705 18.071 1.00 0.00 H new ATOM 1035 N GLY A 64 73.660 -7.785 18.200 1.00 0.00 N ATOM 1036 CA GLY A 64 72.901 -8.863 18.905 1.00 0.00 C ATOM 1037 C GLY A 64 71.773 -8.251 19.748 1.00 0.00 C ATOM 1038 O GLY A 64 71.409 -8.775 20.782 1.00 0.00 O ATOM 0 H GLY A 64 73.544 -7.759 17.187 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.485 -9.560 18.178 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.574 -9.434 19.544 1.00 0.00 H new ATOM 1042 N ASP A 65 71.230 -7.135 19.331 1.00 0.00 N ATOM 1043 CA ASP A 65 70.145 -6.485 20.129 1.00 0.00 C ATOM 1044 C ASP A 65 68.843 -7.284 20.047 1.00 0.00 C ATOM 1045 O ASP A 65 67.883 -6.975 20.725 1.00 0.00 O ATOM 1046 CB ASP A 65 69.886 -5.088 19.579 1.00 0.00 C ATOM 1047 CG ASP A 65 69.369 -5.188 18.140 1.00 0.00 C ATOM 1048 OD1 ASP A 65 69.631 -6.198 17.501 1.00 0.00 O ATOM 1049 OD2 ASP A 65 68.721 -4.250 17.698 1.00 0.00 O ATOM 0 H ASP A 65 71.490 -6.646 18.474 1.00 0.00 H new ATOM 0 HA ASP A 65 70.469 -6.441 21.169 1.00 0.00 H new ATOM 0 HB2 ASP A 65 69.157 -4.570 20.203 1.00 0.00 H new ATOM 0 HB3 ASP A 65 70.803 -4.500 19.606 1.00 0.00 H new ATOM 1054 N GLY A 66 68.792 -8.313 19.246 1.00 0.00 N ATOM 1055 CA GLY A 66 67.538 -9.121 19.159 1.00 0.00 C ATOM 1056 C GLY A 66 66.616 -8.582 18.060 1.00 0.00 C ATOM 1057 O GLY A 66 65.737 -9.280 17.596 1.00 0.00 O ATOM 0 H GLY A 66 69.558 -8.629 18.651 1.00 0.00 H new ATOM 0 HA2 GLY A 66 67.785 -10.163 18.954 1.00 0.00 H new ATOM 0 HA3 GLY A 66 67.019 -9.099 20.117 1.00 0.00 H new ATOM 1061 N GLU A 67 66.800 -7.352 17.636 1.00 0.00 N ATOM 1062 CA GLU A 67 65.926 -6.768 16.565 1.00 0.00 C ATOM 1063 C GLU A 67 66.810 -6.154 15.477 1.00 0.00 C ATOM 1064 O GLU A 67 68.008 -6.033 15.642 1.00 0.00 O ATOM 1065 CB GLU A 67 65.034 -5.678 17.167 1.00 0.00 C ATOM 1066 CG GLU A 67 64.002 -6.312 18.103 1.00 0.00 C ATOM 1067 CD GLU A 67 64.681 -6.740 19.408 1.00 0.00 C ATOM 1068 OE1 GLU A 67 65.806 -6.323 19.635 1.00 0.00 O ATOM 1069 OE2 GLU A 67 64.065 -7.486 20.155 1.00 0.00 O ATOM 0 H GLU A 67 67.522 -6.724 17.988 1.00 0.00 H new ATOM 0 HA GLU A 67 65.301 -7.551 16.137 1.00 0.00 H new ATOM 0 HB2 GLU A 67 65.642 -4.959 17.715 1.00 0.00 H new ATOM 0 HB3 GLU A 67 64.529 -5.128 16.373 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.203 -5.601 18.314 1.00 0.00 H new ATOM 0 HG3 GLU A 67 63.542 -7.175 17.621 1.00 0.00 H new ATOM 1076 N CYS A 68 66.232 -5.771 14.359 1.00 0.00 N ATOM 1077 CA CYS A 68 67.048 -5.166 13.252 1.00 0.00 C ATOM 1078 C CYS A 68 66.801 -3.655 13.188 1.00 0.00 C ATOM 1079 O CYS A 68 65.764 -3.198 12.742 1.00 0.00 O ATOM 1080 CB CYS A 68 66.648 -5.806 11.919 1.00 0.00 C ATOM 1081 SG CYS A 68 66.985 -7.583 11.981 1.00 0.00 S ATOM 0 H CYS A 68 65.234 -5.851 14.166 1.00 0.00 H new ATOM 0 HA CYS A 68 68.106 -5.347 13.444 1.00 0.00 H new ATOM 0 HB2 CYS A 68 65.590 -5.632 11.722 1.00 0.00 H new ATOM 0 HB3 CYS A 68 67.204 -5.347 11.101 1.00 0.00 H new ATOM 0 HG CYS A 68 67.934 -7.815 12.838 1.00 0.00 H new ATOM 1087 N ASP A 69 67.749 -2.883 13.652 1.00 0.00 N ATOM 1088 CA ASP A 69 67.604 -1.399 13.656 1.00 0.00 C ATOM 1089 C ASP A 69 67.656 -0.840 12.230 1.00 0.00 C ATOM 1090 O ASP A 69 67.891 -1.549 11.273 1.00 0.00 O ATOM 1091 CB ASP A 69 68.738 -0.789 14.484 1.00 0.00 C ATOM 1092 CG ASP A 69 68.512 -1.087 15.970 1.00 0.00 C ATOM 1093 OD1 ASP A 69 67.374 -1.315 16.342 1.00 0.00 O ATOM 1094 OD2 ASP A 69 69.482 -1.081 16.710 1.00 0.00 O ATOM 0 H ASP A 69 68.631 -3.225 14.034 1.00 0.00 H new ATOM 0 HA ASP A 69 66.638 -1.142 14.091 1.00 0.00 H new ATOM 0 HB2 ASP A 69 69.696 -1.198 14.163 1.00 0.00 H new ATOM 0 HB3 ASP A 69 68.781 0.288 14.322 1.00 0.00 H new ATOM 1099 N PHE A 70 67.445 0.441 12.104 1.00 0.00 N ATOM 1100 CA PHE A 70 67.480 1.083 10.762 1.00 0.00 C ATOM 1101 C PHE A 70 68.868 0.888 10.139 1.00 0.00 C ATOM 1102 O PHE A 70 69.001 0.497 8.996 1.00 0.00 O ATOM 1103 CB PHE A 70 67.183 2.578 10.892 1.00 0.00 C ATOM 1104 CG PHE A 70 67.222 3.200 9.519 1.00 0.00 C ATOM 1105 CD1 PHE A 70 66.057 3.244 8.743 1.00 0.00 C ATOM 1106 CD2 PHE A 70 68.420 3.717 9.014 1.00 0.00 C ATOM 1107 CE1 PHE A 70 66.088 3.810 7.464 1.00 0.00 C ATOM 1108 CE2 PHE A 70 68.452 4.283 7.732 1.00 0.00 C ATOM 1109 CZ PHE A 70 67.285 4.329 6.958 1.00 0.00 C ATOM 0 H PHE A 70 67.249 1.074 12.879 1.00 0.00 H new ATOM 0 HA PHE A 70 66.725 0.623 10.124 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.205 2.731 11.348 1.00 0.00 H new ATOM 0 HB3 PHE A 70 67.916 3.054 11.543 1.00 0.00 H new ATOM 0 HD1 PHE A 70 65.134 2.841 9.132 1.00 0.00 H new ATOM 0 HD2 PHE A 70 69.319 3.680 9.611 1.00 0.00 H new ATOM 0 HE1 PHE A 70 65.188 3.846 6.867 1.00 0.00 H new ATOM 0 HE2 PHE A 70 69.376 4.683 7.341 1.00 0.00 H new ATOM 0 HZ PHE A 70 67.309 4.765 5.970 1.00 0.00 H new ATOM 1119 N GLN A 71 69.902 1.188 10.871 1.00 0.00 N ATOM 1120 CA GLN A 71 71.269 1.043 10.299 1.00 0.00 C ATOM 1121 C GLN A 71 71.455 -0.401 9.827 1.00 0.00 C ATOM 1122 O GLN A 71 71.796 -0.649 8.687 1.00 0.00 O ATOM 1123 CB GLN A 71 72.313 1.382 11.368 1.00 0.00 C ATOM 1124 CG GLN A 71 72.254 2.879 11.691 1.00 0.00 C ATOM 1125 CD GLN A 71 70.958 3.192 12.442 1.00 0.00 C ATOM 1126 OE1 GLN A 71 70.539 2.431 13.290 1.00 0.00 O ATOM 1127 NE2 GLN A 71 70.307 4.293 12.172 1.00 0.00 N ATOM 0 H GLN A 71 69.862 1.525 11.833 1.00 0.00 H new ATOM 0 HA GLN A 71 71.394 1.723 9.457 1.00 0.00 H new ATOM 0 HB2 GLN A 71 72.127 0.798 12.269 1.00 0.00 H new ATOM 0 HB3 GLN A 71 73.309 1.115 11.015 1.00 0.00 H new ATOM 0 HG2 GLN A 71 73.115 3.165 12.296 1.00 0.00 H new ATOM 0 HG3 GLN A 71 72.303 3.462 10.771 1.00 0.00 H new ATOM 0 HE21 GLN A 71 70.659 4.932 11.459 1.00 0.00 H new ATOM 0 HE22 GLN A 71 69.447 4.513 12.674 1.00 0.00 H new ATOM 1136 N GLU A 72 71.231 -1.357 10.686 1.00 0.00 N ATOM 1137 CA GLU A 72 71.392 -2.781 10.266 1.00 0.00 C ATOM 1138 C GLU A 72 70.429 -3.068 9.108 1.00 0.00 C ATOM 1139 O GLU A 72 70.765 -3.725 8.144 1.00 0.00 O ATOM 1140 CB GLU A 72 71.067 -3.701 11.447 1.00 0.00 C ATOM 1141 CG GLU A 72 72.154 -3.561 12.512 1.00 0.00 C ATOM 1142 CD GLU A 72 71.838 -4.479 13.695 1.00 0.00 C ATOM 1143 OE1 GLU A 72 70.743 -5.015 13.726 1.00 0.00 O ATOM 1144 OE2 GLU A 72 72.698 -4.631 14.548 1.00 0.00 O ATOM 0 H GLU A 72 70.945 -1.217 11.655 1.00 0.00 H new ATOM 0 HA GLU A 72 72.418 -2.960 9.945 1.00 0.00 H new ATOM 0 HB2 GLU A 72 70.095 -3.442 11.867 1.00 0.00 H new ATOM 0 HB3 GLU A 72 71.004 -4.736 11.110 1.00 0.00 H new ATOM 0 HG2 GLU A 72 73.126 -3.817 12.090 1.00 0.00 H new ATOM 0 HG3 GLU A 72 72.216 -2.526 12.849 1.00 0.00 H new ATOM 1151 N PHE A 73 69.223 -2.587 9.219 1.00 0.00 N ATOM 1152 CA PHE A 73 68.221 -2.839 8.141 1.00 0.00 C ATOM 1153 C PHE A 73 68.862 -2.514 6.784 1.00 0.00 C ATOM 1154 O PHE A 73 68.680 -3.224 5.815 1.00 0.00 O ATOM 1155 CB PHE A 73 66.981 -1.966 8.349 1.00 0.00 C ATOM 1156 CG PHE A 73 66.081 -2.085 7.141 1.00 0.00 C ATOM 1157 CD1 PHE A 73 66.251 -1.214 6.059 1.00 0.00 C ATOM 1158 CD2 PHE A 73 65.088 -3.066 7.101 1.00 0.00 C ATOM 1159 CE1 PHE A 73 65.423 -1.323 4.934 1.00 0.00 C ATOM 1160 CE2 PHE A 73 64.258 -3.177 5.978 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.424 -2.306 4.893 1.00 0.00 C ATOM 0 H PHE A 73 68.886 -2.032 10.006 1.00 0.00 H new ATOM 0 HA PHE A 73 67.915 -3.885 8.169 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.448 -2.279 9.247 1.00 0.00 H new ATOM 0 HB3 PHE A 73 67.274 -0.927 8.498 1.00 0.00 H new ATOM 0 HD1 PHE A 73 67.021 -0.457 6.091 1.00 0.00 H new ATOM 0 HD2 PHE A 73 64.960 -3.739 7.936 1.00 0.00 H new ATOM 0 HE1 PHE A 73 65.554 -0.650 4.099 1.00 0.00 H new ATOM 0 HE2 PHE A 73 63.489 -3.935 5.948 1.00 0.00 H new ATOM 0 HZ PHE A 73 63.784 -2.392 4.027 1.00 0.00 H new ATOM 1171 N MET A 74 69.621 -1.457 6.713 1.00 0.00 N ATOM 1172 CA MET A 74 70.284 -1.099 5.426 1.00 0.00 C ATOM 1173 C MET A 74 71.339 -2.159 5.091 1.00 0.00 C ATOM 1174 O MET A 74 71.598 -2.455 3.942 1.00 0.00 O ATOM 1175 CB MET A 74 70.952 0.273 5.555 1.00 0.00 C ATOM 1176 CG MET A 74 71.435 0.738 4.181 1.00 0.00 C ATOM 1177 SD MET A 74 70.005 1.125 3.139 1.00 0.00 S ATOM 1178 CE MET A 74 70.755 0.697 1.550 1.00 0.00 C ATOM 0 H MET A 74 69.812 -0.824 7.490 1.00 0.00 H new ATOM 0 HA MET A 74 69.541 -1.060 4.630 1.00 0.00 H new ATOM 0 HB2 MET A 74 70.247 0.995 5.968 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.792 0.216 6.247 1.00 0.00 H new ATOM 0 HG2 MET A 74 72.071 1.617 4.285 1.00 0.00 H new ATOM 0 HG3 MET A 74 72.040 -0.039 3.714 1.00 0.00 H new ATOM 0 HE1 MET A 74 70.033 0.863 0.750 1.00 0.00 H new ATOM 0 HE2 MET A 74 71.633 1.321 1.382 1.00 0.00 H new ATOM 0 HE3 MET A 74 71.052 -0.352 1.558 1.00 0.00 H new ATOM 1188 N ALA A 75 71.932 -2.753 6.092 1.00 0.00 N ATOM 1189 CA ALA A 75 72.940 -3.815 5.822 1.00 0.00 C ATOM 1190 C ALA A 75 72.228 -4.951 5.087 1.00 0.00 C ATOM 1191 O ALA A 75 72.643 -5.389 4.033 1.00 0.00 O ATOM 1192 CB ALA A 75 73.523 -4.325 7.144 1.00 0.00 C ATOM 0 H ALA A 75 71.763 -2.550 7.077 1.00 0.00 H new ATOM 0 HA ALA A 75 73.759 -3.426 5.217 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.260 -5.102 6.941 1.00 0.00 H new ATOM 0 HB2 ALA A 75 74.001 -3.501 7.673 1.00 0.00 H new ATOM 0 HB3 ALA A 75 72.723 -4.736 7.760 1.00 0.00 H new ATOM 1198 N PHE A 76 71.154 -5.424 5.657 1.00 0.00 N ATOM 1199 CA PHE A 76 70.392 -6.534 5.017 1.00 0.00 C ATOM 1200 C PHE A 76 70.065 -6.113 3.588 1.00 0.00 C ATOM 1201 O PHE A 76 70.168 -6.885 2.657 1.00 0.00 O ATOM 1202 CB PHE A 76 69.086 -6.763 5.788 1.00 0.00 C ATOM 1203 CG PHE A 76 68.296 -7.888 5.156 1.00 0.00 C ATOM 1204 CD1 PHE A 76 68.501 -9.201 5.588 1.00 0.00 C ATOM 1205 CD2 PHE A 76 67.349 -7.621 4.158 1.00 0.00 C ATOM 1206 CE1 PHE A 76 67.763 -10.249 5.030 1.00 0.00 C ATOM 1207 CE2 PHE A 76 66.611 -8.673 3.596 1.00 0.00 C ATOM 1208 CZ PHE A 76 66.820 -9.987 4.035 1.00 0.00 C ATOM 0 H PHE A 76 70.770 -5.089 6.541 1.00 0.00 H new ATOM 0 HA PHE A 76 70.977 -7.453 5.022 1.00 0.00 H new ATOM 0 HB2 PHE A 76 69.307 -7.003 6.828 1.00 0.00 H new ATOM 0 HB3 PHE A 76 68.492 -5.849 5.791 1.00 0.00 H new ATOM 0 HD1 PHE A 76 69.232 -9.407 6.356 1.00 0.00 H new ATOM 0 HD2 PHE A 76 67.188 -6.607 3.822 1.00 0.00 H new ATOM 0 HE1 PHE A 76 67.923 -11.262 5.369 1.00 0.00 H new ATOM 0 HE2 PHE A 76 65.882 -8.470 2.825 1.00 0.00 H new ATOM 0 HZ PHE A 76 66.251 -10.797 3.603 1.00 0.00 H new ATOM 1218 N VAL A 77 69.716 -4.874 3.411 1.00 0.00 N ATOM 1219 CA VAL A 77 69.430 -4.389 2.037 1.00 0.00 C ATOM 1220 C VAL A 77 70.723 -4.511 1.223 1.00 0.00 C ATOM 1221 O VAL A 77 70.715 -4.950 0.089 1.00 0.00 O ATOM 1222 CB VAL A 77 68.958 -2.930 2.079 1.00 0.00 C ATOM 1223 CG1 VAL A 77 68.896 -2.360 0.659 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.567 -2.864 2.711 1.00 0.00 C ATOM 0 H VAL A 77 69.617 -4.180 4.152 1.00 0.00 H new ATOM 0 HA VAL A 77 68.638 -4.981 1.579 1.00 0.00 H new ATOM 0 HB VAL A 77 69.661 -2.344 2.671 1.00 0.00 H new ATOM 0 HG11 VAL A 77 68.560 -1.324 0.697 1.00 0.00 H new ATOM 0 HG12 VAL A 77 69.886 -2.404 0.206 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.197 -2.946 0.062 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.230 -1.828 2.742 1.00 0.00 H new ATOM 0 HG22 VAL A 77 66.869 -3.455 2.118 1.00 0.00 H new ATOM 0 HG23 VAL A 77 67.609 -3.262 3.725 1.00 0.00 H new ATOM 1234 N SER A 78 71.838 -4.132 1.804 1.00 0.00 N ATOM 1235 CA SER A 78 73.140 -4.231 1.079 1.00 0.00 C ATOM 1236 C SER A 78 73.538 -5.699 0.906 1.00 0.00 C ATOM 1237 O SER A 78 73.939 -6.117 -0.157 1.00 0.00 O ATOM 1238 CB SER A 78 74.222 -3.506 1.880 1.00 0.00 C ATOM 1239 OG SER A 78 75.487 -3.728 1.270 1.00 0.00 O ATOM 0 H SER A 78 71.899 -3.758 2.751 1.00 0.00 H new ATOM 0 HA SER A 78 73.035 -3.772 0.096 1.00 0.00 H new ATOM 0 HB2 SER A 78 74.007 -2.438 1.920 1.00 0.00 H new ATOM 0 HB3 SER A 78 74.233 -3.867 2.908 1.00 0.00 H new ATOM 0 HG SER A 78 76.182 -3.263 1.781 1.00 0.00 H new ATOM 1245 N MET A 79 73.463 -6.477 1.945 1.00 0.00 N ATOM 1246 CA MET A 79 73.876 -7.910 1.832 1.00 0.00 C ATOM 1247 C MET A 79 73.150 -8.557 0.655 1.00 0.00 C ATOM 1248 O MET A 79 73.744 -9.247 -0.151 1.00 0.00 O ATOM 1249 CB MET A 79 73.512 -8.640 3.126 1.00 0.00 C ATOM 1250 CG MET A 79 74.106 -10.053 3.113 1.00 0.00 C ATOM 1251 SD MET A 79 73.724 -10.877 4.679 1.00 0.00 S ATOM 1252 CE MET A 79 74.458 -12.487 4.293 1.00 0.00 C ATOM 0 H MET A 79 73.135 -6.189 2.867 1.00 0.00 H new ATOM 0 HA MET A 79 74.952 -7.972 1.668 1.00 0.00 H new ATOM 0 HB2 MET A 79 73.889 -8.085 3.985 1.00 0.00 H new ATOM 0 HB3 MET A 79 72.428 -8.693 3.232 1.00 0.00 H new ATOM 0 HG2 MET A 79 73.697 -10.624 2.279 1.00 0.00 H new ATOM 0 HG3 MET A 79 75.185 -10.005 2.968 1.00 0.00 H new ATOM 0 HE1 MET A 79 74.330 -13.158 5.142 1.00 0.00 H new ATOM 0 HE2 MET A 79 73.966 -12.911 3.418 1.00 0.00 H new ATOM 0 HE3 MET A 79 75.521 -12.362 4.086 1.00 0.00 H new ATOM 1262 N VAL A 80 71.881 -8.317 0.530 1.00 0.00 N ATOM 1263 CA VAL A 80 71.127 -8.891 -0.615 1.00 0.00 C ATOM 1264 C VAL A 80 71.723 -8.326 -1.907 1.00 0.00 C ATOM 1265 O VAL A 80 71.731 -8.965 -2.941 1.00 0.00 O ATOM 1266 CB VAL A 80 69.648 -8.504 -0.502 1.00 0.00 C ATOM 1267 CG1 VAL A 80 68.871 -9.084 -1.686 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.071 -9.062 0.805 1.00 0.00 C ATOM 0 H VAL A 80 71.330 -7.747 1.172 1.00 0.00 H new ATOM 0 HA VAL A 80 71.201 -9.979 -0.615 1.00 0.00 H new ATOM 0 HB VAL A 80 69.560 -7.418 -0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 80 67.820 -8.807 -1.602 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.278 -8.689 -2.617 1.00 0.00 H new ATOM 0 HG13 VAL A 80 68.961 -10.170 -1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.019 -8.787 0.885 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.163 -10.148 0.809 1.00 0.00 H new ATOM 0 HG23 VAL A 80 69.620 -8.648 1.651 1.00 0.00 H new ATOM 1278 N THR A 81 72.251 -7.134 -1.832 1.00 0.00 N ATOM 1279 CA THR A 81 72.888 -6.509 -3.028 1.00 0.00 C ATOM 1280 C THR A 81 74.320 -7.043 -3.173 1.00 0.00 C ATOM 1281 O THR A 81 74.739 -7.472 -4.231 1.00 0.00 O ATOM 1282 CB THR A 81 72.917 -4.988 -2.846 1.00 0.00 C ATOM 1283 OG1 THR A 81 71.599 -4.519 -2.605 1.00 0.00 O ATOM 1284 CG2 THR A 81 73.470 -4.325 -4.108 1.00 0.00 C ATOM 0 H THR A 81 72.269 -6.562 -0.988 1.00 0.00 H new ATOM 0 HA THR A 81 72.318 -6.754 -3.924 1.00 0.00 H new ATOM 0 HB THR A 81 73.557 -4.738 -2.000 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.360 -4.681 -1.668 1.00 0.00 H new ATOM 0 HG21 THR A 81 73.488 -3.244 -3.973 1.00 0.00 H new ATOM 0 HG22 THR A 81 74.482 -4.685 -4.294 1.00 0.00 H new ATOM 0 HG23 THR A 81 72.834 -4.574 -4.958 1.00 0.00 H new ATOM 1292 N THR A 82 75.064 -7.010 -2.101 1.00 0.00 N ATOM 1293 CA THR A 82 76.476 -7.500 -2.111 1.00 0.00 C ATOM 1294 C THR A 82 76.494 -9.030 -2.205 1.00 0.00 C ATOM 1295 O THR A 82 77.487 -9.628 -2.565 1.00 0.00 O ATOM 1296 CB THR A 82 77.166 -7.054 -0.814 1.00 0.00 C ATOM 1297 OG1 THR A 82 76.827 -5.700 -0.545 1.00 0.00 O ATOM 1298 CG2 THR A 82 78.687 -7.182 -0.954 1.00 0.00 C ATOM 0 H THR A 82 74.747 -6.657 -1.198 1.00 0.00 H new ATOM 0 HA THR A 82 77.002 -7.087 -2.971 1.00 0.00 H new ATOM 0 HB THR A 82 76.832 -7.689 0.006 1.00 0.00 H new ATOM 0 HG1 THR A 82 76.202 -5.663 0.209 1.00 0.00 H new ATOM 0 HG21 THR A 82 79.166 -6.863 -0.028 1.00 0.00 H new ATOM 0 HG22 THR A 82 78.947 -8.221 -1.158 1.00 0.00 H new ATOM 0 HG23 THR A 82 79.031 -6.554 -1.776 1.00 0.00 H new ATOM 1306 N ALA A 83 75.398 -9.663 -1.892 1.00 0.00 N ATOM 1307 CA ALA A 83 75.347 -11.152 -1.970 1.00 0.00 C ATOM 1308 C ALA A 83 75.388 -11.593 -3.436 1.00 0.00 C ATOM 1309 O ALA A 83 76.028 -12.564 -3.788 1.00 0.00 O ATOM 1310 CB ALA A 83 74.054 -11.657 -1.321 1.00 0.00 C ATOM 0 H ALA A 83 74.535 -9.215 -1.585 1.00 0.00 H new ATOM 0 HA ALA A 83 76.205 -11.569 -1.442 1.00 0.00 H new ATOM 0 HB1 ALA A 83 74.019 -12.745 -1.379 1.00 0.00 H new ATOM 0 HB2 ALA A 83 74.027 -11.348 -0.276 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.196 -11.238 -1.846 1.00 0.00 H new ATOM 1316 N CYS A 84 74.704 -10.886 -4.293 1.00 0.00 N ATOM 1317 CA CYS A 84 74.693 -11.257 -5.740 1.00 0.00 C ATOM 1318 C CYS A 84 75.869 -10.591 -6.451 1.00 0.00 C ATOM 1319 O CYS A 84 76.096 -9.404 -6.319 1.00 0.00 O ATOM 1320 CB CYS A 84 73.386 -10.790 -6.381 1.00 0.00 C ATOM 1321 SG CYS A 84 73.387 -11.215 -8.141 1.00 0.00 S ATOM 0 H CYS A 84 74.150 -10.064 -4.054 1.00 0.00 H new ATOM 0 HA CYS A 84 74.778 -12.340 -5.832 1.00 0.00 H new ATOM 0 HB2 CYS A 84 72.537 -11.259 -5.884 1.00 0.00 H new ATOM 0 HB3 CYS A 84 73.273 -9.713 -6.257 1.00 0.00 H new ATOM 0 HG CYS A 84 72.274 -10.819 -8.684 1.00 0.00 H new ATOM 1450 N SER B 1 59.706 -6.760 -8.792 1.00 0.00 N ATOM 1451 CA SER B 1 59.331 -5.903 -7.628 1.00 0.00 C ATOM 1452 C SER B 1 59.968 -4.522 -7.786 1.00 0.00 C ATOM 1453 O SER B 1 60.978 -4.370 -8.452 1.00 0.00 O ATOM 1454 CB SER B 1 59.848 -6.537 -6.338 1.00 0.00 C ATOM 1455 OG SER B 1 61.260 -6.671 -6.417 1.00 0.00 O ATOM 0 H1 SER B 1 59.938 -7.717 -8.458 1.00 0.00 H new ATOM 0 H2 SER B 1 58.909 -6.809 -9.458 1.00 0.00 H new ATOM 0 H3 SER B 1 60.533 -6.351 -9.272 1.00 0.00 H new ATOM 0 HA SER B 1 58.246 -5.811 -7.587 1.00 0.00 H new ATOM 0 HB2 SER B 1 59.577 -5.920 -5.481 1.00 0.00 H new ATOM 0 HB3 SER B 1 59.386 -7.513 -6.188 1.00 0.00 H new ATOM 0 HG SER B 1 61.597 -7.076 -5.591 1.00 0.00 H new ATOM 1463 N GLU B 2 59.389 -3.506 -7.200 1.00 0.00 N ATOM 1464 CA GLU B 2 59.964 -2.139 -7.334 1.00 0.00 C ATOM 1465 C GLU B 2 61.319 -2.074 -6.627 1.00 0.00 C ATOM 1466 O GLU B 2 62.202 -1.342 -7.031 1.00 0.00 O ATOM 1467 CB GLU B 2 59.001 -1.126 -6.706 1.00 0.00 C ATOM 1468 CG GLU B 2 57.744 -1.010 -7.574 1.00 0.00 C ATOM 1469 CD GLU B 2 56.778 -0.004 -6.939 1.00 0.00 C ATOM 1470 OE1 GLU B 2 57.101 0.511 -5.880 1.00 0.00 O ATOM 1471 OE2 GLU B 2 55.735 0.237 -7.524 1.00 0.00 O ATOM 0 H GLU B 2 58.542 -3.566 -6.635 1.00 0.00 H new ATOM 0 HA GLU B 2 60.105 -1.904 -8.389 1.00 0.00 H new ATOM 0 HB2 GLU B 2 58.732 -1.441 -5.698 1.00 0.00 H new ATOM 0 HB3 GLU B 2 59.486 -0.154 -6.618 1.00 0.00 H new ATOM 0 HG2 GLU B 2 58.012 -0.688 -8.580 1.00 0.00 H new ATOM 0 HG3 GLU B 2 57.263 -1.983 -7.668 1.00 0.00 H new ATOM 1478 N LEU B 3 61.502 -2.833 -5.579 1.00 0.00 N ATOM 1479 CA LEU B 3 62.808 -2.813 -4.861 1.00 0.00 C ATOM 1480 C LEU B 3 63.886 -3.445 -5.747 1.00 0.00 C ATOM 1481 O LEU B 3 65.036 -3.053 -5.716 1.00 0.00 O ATOM 1482 CB LEU B 3 62.691 -3.633 -3.573 1.00 0.00 C ATOM 1483 CG LEU B 3 61.754 -2.931 -2.573 1.00 0.00 C ATOM 1484 CD1 LEU B 3 61.450 -3.882 -1.408 1.00 0.00 C ATOM 1485 CD2 LEU B 3 62.419 -1.651 -2.022 1.00 0.00 C ATOM 0 H LEU B 3 60.803 -3.466 -5.190 1.00 0.00 H new ATOM 0 HA LEU B 3 63.075 -1.783 -4.626 1.00 0.00 H new ATOM 0 HB2 LEU B 3 62.310 -4.628 -3.801 1.00 0.00 H new ATOM 0 HB3 LEU B 3 63.677 -3.764 -3.127 1.00 0.00 H new ATOM 0 HG LEU B 3 60.831 -2.660 -3.085 1.00 0.00 H new ATOM 0 HD11 LEU B 3 60.787 -3.388 -0.698 1.00 0.00 H new ATOM 0 HD12 LEU B 3 60.967 -4.782 -1.789 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.380 -4.153 -0.908 1.00 0.00 H new ATOM 0 HD21 LEU B 3 61.745 -1.166 -1.316 1.00 0.00 H new ATOM 0 HD22 LEU B 3 63.348 -1.913 -1.515 1.00 0.00 H new ATOM 0 HD23 LEU B 3 62.635 -0.970 -2.845 1.00 0.00 H new ATOM 1497 N GLU B 4 63.516 -4.417 -6.544 1.00 0.00 N ATOM 1498 CA GLU B 4 64.507 -5.073 -7.442 1.00 0.00 C ATOM 1499 C GLU B 4 65.092 -4.034 -8.398 1.00 0.00 C ATOM 1500 O GLU B 4 66.271 -4.044 -8.690 1.00 0.00 O ATOM 1501 CB GLU B 4 63.812 -6.187 -8.244 1.00 0.00 C ATOM 1502 CG GLU B 4 64.837 -6.913 -9.122 1.00 0.00 C ATOM 1503 CD GLU B 4 64.128 -7.986 -9.952 1.00 0.00 C ATOM 1504 OE1 GLU B 4 62.943 -8.185 -9.740 1.00 0.00 O ATOM 1505 OE2 GLU B 4 64.782 -8.588 -10.788 1.00 0.00 O ATOM 0 H GLU B 4 62.566 -4.783 -6.609 1.00 0.00 H new ATOM 0 HA GLU B 4 65.311 -5.507 -6.847 1.00 0.00 H new ATOM 0 HB2 GLU B 4 63.336 -6.894 -7.564 1.00 0.00 H new ATOM 0 HB3 GLU B 4 63.023 -5.762 -8.865 1.00 0.00 H new ATOM 0 HG2 GLU B 4 65.338 -6.202 -9.779 1.00 0.00 H new ATOM 0 HG3 GLU B 4 65.607 -7.369 -8.500 1.00 0.00 H new ATOM 1512 N LYS B 5 64.283 -3.142 -8.898 1.00 0.00 N ATOM 1513 CA LYS B 5 64.812 -2.117 -9.842 1.00 0.00 C ATOM 1514 C LYS B 5 65.816 -1.216 -9.120 1.00 0.00 C ATOM 1515 O LYS B 5 66.840 -0.854 -9.662 1.00 0.00 O ATOM 1516 CB LYS B 5 63.656 -1.263 -10.368 1.00 0.00 C ATOM 1517 CG LYS B 5 64.168 -0.290 -11.434 1.00 0.00 C ATOM 1518 CD LYS B 5 62.998 0.556 -11.947 1.00 0.00 C ATOM 1519 CE LYS B 5 63.496 1.558 -12.989 1.00 0.00 C ATOM 1520 NZ LYS B 5 62.329 2.267 -13.585 1.00 0.00 N ATOM 0 H LYS B 5 63.285 -3.078 -8.696 1.00 0.00 H new ATOM 0 HA LYS B 5 65.308 -2.618 -10.673 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.882 -1.904 -10.790 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.199 -0.709 -9.548 1.00 0.00 H new ATOM 0 HG2 LYS B 5 64.941 0.354 -11.015 1.00 0.00 H new ATOM 0 HG3 LYS B 5 64.623 -0.840 -12.257 1.00 0.00 H new ATOM 0 HD2 LYS B 5 62.237 -0.089 -12.385 1.00 0.00 H new ATOM 0 HD3 LYS B 5 62.529 1.084 -11.117 1.00 0.00 H new ATOM 0 HE2 LYS B 5 64.174 2.275 -12.526 1.00 0.00 H new ATOM 0 HE3 LYS B 5 64.059 1.042 -13.767 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 62.663 2.950 -14.295 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 61.698 1.576 -14.039 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 61.810 2.771 -12.838 1.00 0.00 H new ATOM 1534 N ALA B 6 65.532 -0.858 -7.898 1.00 0.00 N ATOM 1535 CA ALA B 6 66.473 0.012 -7.139 1.00 0.00 C ATOM 1536 C ALA B 6 67.822 -0.700 -7.002 1.00 0.00 C ATOM 1537 O ALA B 6 68.861 -0.141 -7.293 1.00 0.00 O ATOM 1538 CB ALA B 6 65.899 0.306 -5.751 1.00 0.00 C ATOM 0 H ALA B 6 64.689 -1.130 -7.393 1.00 0.00 H new ATOM 0 HA ALA B 6 66.611 0.952 -7.673 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.590 0.943 -5.199 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.940 0.815 -5.854 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.757 -0.630 -5.210 1.00 0.00 H new ATOM 1544 N MET B 7 67.814 -1.934 -6.571 1.00 0.00 N ATOM 1545 CA MET B 7 69.095 -2.686 -6.432 1.00 0.00 C ATOM 1546 C MET B 7 69.749 -2.809 -7.805 1.00 0.00 C ATOM 1547 O MET B 7 70.916 -2.521 -7.984 1.00 0.00 O ATOM 1548 CB MET B 7 68.798 -4.082 -5.889 1.00 0.00 C ATOM 1549 CG MET B 7 70.106 -4.780 -5.511 1.00 0.00 C ATOM 1550 SD MET B 7 69.752 -6.463 -4.937 1.00 0.00 S ATOM 1551 CE MET B 7 69.230 -6.068 -3.245 1.00 0.00 C ATOM 0 H MET B 7 66.976 -2.453 -6.309 1.00 0.00 H new ATOM 0 HA MET B 7 69.763 -2.161 -5.750 1.00 0.00 H new ATOM 0 HB2 MET B 7 68.147 -4.012 -5.017 1.00 0.00 H new ATOM 0 HB3 MET B 7 68.266 -4.668 -6.638 1.00 0.00 H new ATOM 0 HG2 MET B 7 70.775 -4.811 -6.371 1.00 0.00 H new ATOM 0 HG3 MET B 7 70.617 -4.218 -4.729 1.00 0.00 H new ATOM 0 HE1 MET B 7 69.975 -6.435 -2.539 1.00 0.00 H new ATOM 0 HE2 MET B 7 69.130 -4.988 -3.138 1.00 0.00 H new ATOM 0 HE3 MET B 7 68.271 -6.544 -3.040 1.00 0.00 H new ATOM 1561 N VAL B 8 68.997 -3.259 -8.773 1.00 0.00 N ATOM 1562 CA VAL B 8 69.552 -3.435 -10.142 1.00 0.00 C ATOM 1563 C VAL B 8 70.044 -2.082 -10.648 1.00 0.00 C ATOM 1564 O VAL B 8 71.079 -1.986 -11.276 1.00 0.00 O ATOM 1565 CB VAL B 8 68.451 -3.966 -11.062 1.00 0.00 C ATOM 1566 CG1 VAL B 8 68.919 -3.926 -12.518 1.00 0.00 C ATOM 1567 CG2 VAL B 8 68.116 -5.405 -10.675 1.00 0.00 C ATOM 0 H VAL B 8 68.015 -3.514 -8.671 1.00 0.00 H new ATOM 0 HA VAL B 8 70.381 -4.143 -10.128 1.00 0.00 H new ATOM 0 HB VAL B 8 67.565 -3.341 -10.955 1.00 0.00 H new ATOM 0 HG11 VAL B 8 68.128 -4.306 -13.165 1.00 0.00 H new ATOM 0 HG12 VAL B 8 69.154 -2.899 -12.797 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.809 -4.545 -12.631 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.332 -5.785 -11.330 1.00 0.00 H new ATOM 0 HG22 VAL B 8 69.006 -6.026 -10.777 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.771 -5.433 -9.641 1.00 0.00 H new ATOM 1577 N ALA B 9 69.322 -1.032 -10.381 1.00 0.00 N ATOM 1578 CA ALA B 9 69.774 0.300 -10.855 1.00 0.00 C ATOM 1579 C ALA B 9 71.147 0.613 -10.248 1.00 0.00 C ATOM 1580 O ALA B 9 72.025 1.120 -10.911 1.00 0.00 O ATOM 1581 CB ALA B 9 68.753 1.355 -10.421 1.00 0.00 C ATOM 0 H ALA B 9 68.446 -1.039 -9.859 1.00 0.00 H new ATOM 0 HA ALA B 9 69.857 0.305 -11.942 1.00 0.00 H new ATOM 0 HB1 ALA B 9 69.076 2.337 -10.765 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.781 1.121 -10.855 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.674 1.359 -9.334 1.00 0.00 H new ATOM 1587 N LEU B 10 71.335 0.331 -8.989 1.00 0.00 N ATOM 1588 CA LEU B 10 72.652 0.626 -8.346 1.00 0.00 C ATOM 1589 C LEU B 10 73.790 -0.136 -9.047 1.00 0.00 C ATOM 1590 O LEU B 10 74.810 0.435 -9.381 1.00 0.00 O ATOM 1591 CB LEU B 10 72.598 0.217 -6.872 1.00 0.00 C ATOM 1592 CG LEU B 10 71.661 1.164 -6.109 1.00 0.00 C ATOM 1593 CD1 LEU B 10 71.417 0.609 -4.700 1.00 0.00 C ATOM 1594 CD2 LEU B 10 72.267 2.583 -6.027 1.00 0.00 C ATOM 0 H LEU B 10 70.637 -0.090 -8.376 1.00 0.00 H new ATOM 0 HA LEU B 10 72.849 1.695 -8.432 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.245 -0.810 -6.782 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.597 0.250 -6.438 1.00 0.00 H new ATOM 0 HG LEU B 10 70.713 1.232 -6.643 1.00 0.00 H new ATOM 0 HD11 LEU B 10 70.752 1.279 -4.155 1.00 0.00 H new ATOM 0 HD12 LEU B 10 70.959 -0.378 -4.772 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.366 0.531 -4.170 1.00 0.00 H new ATOM 0 HD21 LEU B 10 71.587 3.238 -5.482 1.00 0.00 H new ATOM 0 HD22 LEU B 10 73.224 2.540 -5.507 1.00 0.00 H new ATOM 0 HD23 LEU B 10 72.418 2.973 -7.034 1.00 0.00 H new ATOM 1606 N ILE B 11 73.636 -1.419 -9.255 1.00 0.00 N ATOM 1607 CA ILE B 11 74.715 -2.206 -9.925 1.00 0.00 C ATOM 1608 C ILE B 11 74.960 -1.632 -11.316 1.00 0.00 C ATOM 1609 O ILE B 11 76.078 -1.374 -11.711 1.00 0.00 O ATOM 1610 CB ILE B 11 74.280 -3.667 -10.036 1.00 0.00 C ATOM 1611 CG1 ILE B 11 74.241 -4.286 -8.636 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.265 -4.443 -10.912 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.556 -5.653 -8.695 1.00 0.00 C ATOM 0 H ILE B 11 72.810 -1.955 -8.990 1.00 0.00 H new ATOM 0 HA ILE B 11 75.634 -2.149 -9.342 1.00 0.00 H new ATOM 0 HB ILE B 11 73.290 -3.716 -10.490 1.00 0.00 H new ATOM 0 HG12 ILE B 11 75.254 -4.392 -8.247 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.704 -3.629 -7.952 1.00 0.00 H new ATOM 0 HG21 ILE B 11 74.946 -5.483 -10.985 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.292 -4.001 -11.908 1.00 0.00 H new ATOM 0 HG23 ILE B 11 76.260 -4.399 -10.468 1.00 0.00 H new ATOM 0 HD11 ILE B 11 73.530 -6.090 -7.697 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.538 -5.534 -9.066 1.00 0.00 H new ATOM 0 HD13 ILE B 11 74.111 -6.310 -9.365 1.00 0.00 H new ATOM 1625 N ASP B 12 73.915 -1.450 -12.070 1.00 0.00 N ATOM 1626 CA ASP B 12 74.089 -0.918 -13.442 1.00 0.00 C ATOM 1627 C ASP B 12 74.747 0.460 -13.355 1.00 0.00 C ATOM 1628 O ASP B 12 75.610 0.794 -14.142 1.00 0.00 O ATOM 1629 CB ASP B 12 72.720 -0.786 -14.112 1.00 0.00 C ATOM 1630 CG ASP B 12 72.906 -0.307 -15.551 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.994 0.140 -15.869 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.960 -0.404 -16.313 1.00 0.00 O ATOM 0 H ASP B 12 72.953 -1.646 -11.795 1.00 0.00 H new ATOM 0 HA ASP B 12 74.714 -1.593 -14.027 1.00 0.00 H new ATOM 0 HB2 ASP B 12 72.202 -1.745 -14.100 1.00 0.00 H new ATOM 0 HB3 ASP B 12 72.098 -0.081 -13.560 1.00 0.00 H new ATOM 1637 N VAL B 13 74.359 1.259 -12.398 1.00 0.00 N ATOM 1638 CA VAL B 13 74.976 2.608 -12.266 1.00 0.00 C ATOM 1639 C VAL B 13 76.437 2.469 -11.791 1.00 0.00 C ATOM 1640 O VAL B 13 77.317 3.154 -12.266 1.00 0.00 O ATOM 1641 CB VAL B 13 74.172 3.447 -11.258 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.931 4.737 -10.932 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.805 3.812 -11.852 1.00 0.00 C ATOM 0 H VAL B 13 73.644 1.036 -11.705 1.00 0.00 H new ATOM 0 HA VAL B 13 74.965 3.107 -13.235 1.00 0.00 H new ATOM 0 HB VAL B 13 74.033 2.861 -10.349 1.00 0.00 H new ATOM 0 HG11 VAL B 13 74.356 5.327 -10.218 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.901 4.489 -10.501 1.00 0.00 H new ATOM 0 HG13 VAL B 13 75.076 5.314 -11.845 1.00 0.00 H new ATOM 0 HG21 VAL B 13 72.242 4.406 -11.132 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.948 4.389 -12.766 1.00 0.00 H new ATOM 0 HG23 VAL B 13 72.253 2.901 -12.081 1.00 0.00 H new ATOM 1653 N PHE B 14 76.702 1.601 -10.849 1.00 0.00 N ATOM 1654 CA PHE B 14 78.105 1.446 -10.341 1.00 0.00 C ATOM 1655 C PHE B 14 79.051 0.986 -11.459 1.00 0.00 C ATOM 1656 O PHE B 14 80.075 1.593 -11.706 1.00 0.00 O ATOM 1657 CB PHE B 14 78.099 0.402 -9.218 1.00 0.00 C ATOM 1658 CG PHE B 14 79.495 0.179 -8.674 1.00 0.00 C ATOM 1659 CD1 PHE B 14 80.318 -0.798 -9.246 1.00 0.00 C ATOM 1660 CD2 PHE B 14 79.954 0.925 -7.579 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.599 -1.028 -8.729 1.00 0.00 C ATOM 1662 CE2 PHE B 14 81.239 0.696 -7.063 1.00 0.00 C ATOM 1663 CZ PHE B 14 82.060 -0.281 -7.638 1.00 0.00 C ATOM 0 H PHE B 14 76.012 0.993 -10.408 1.00 0.00 H new ATOM 0 HA PHE B 14 78.459 2.409 -9.974 1.00 0.00 H new ATOM 0 HB2 PHE B 14 77.440 0.731 -8.414 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.697 -0.539 -9.594 1.00 0.00 H new ATOM 0 HD1 PHE B 14 79.965 -1.375 -10.087 1.00 0.00 H new ATOM 0 HD2 PHE B 14 79.319 1.676 -7.133 1.00 0.00 H new ATOM 0 HE1 PHE B 14 82.232 -1.782 -9.172 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.594 1.274 -6.222 1.00 0.00 H new ATOM 0 HZ PHE B 14 83.048 -0.459 -7.240 1.00 0.00 H new ATOM 1673 N HIS B 15 78.747 -0.113 -12.096 1.00 0.00 N ATOM 1674 CA HIS B 15 79.655 -0.665 -13.146 1.00 0.00 C ATOM 1675 C HIS B 15 79.868 0.332 -14.285 1.00 0.00 C ATOM 1676 O HIS B 15 80.964 0.458 -14.793 1.00 0.00 O ATOM 1677 CB HIS B 15 79.024 -1.935 -13.714 1.00 0.00 C ATOM 1678 CG HIS B 15 79.914 -2.517 -14.775 1.00 0.00 C ATOM 1679 ND1 HIS B 15 81.199 -2.961 -14.499 1.00 0.00 N ATOM 1680 CD2 HIS B 15 79.716 -2.748 -16.114 1.00 0.00 C ATOM 1681 CE1 HIS B 15 81.719 -3.432 -15.648 1.00 0.00 C ATOM 1682 NE2 HIS B 15 80.856 -3.325 -16.658 1.00 0.00 N ATOM 0 H HIS B 15 77.900 -0.658 -11.933 1.00 0.00 H new ATOM 0 HA HIS B 15 80.623 -0.874 -12.691 1.00 0.00 H new ATOM 0 HB2 HIS B 15 78.870 -2.663 -12.917 1.00 0.00 H new ATOM 0 HB3 HIS B 15 78.044 -1.708 -14.133 1.00 0.00 H new ATOM 0 HD2 HIS B 15 78.813 -2.517 -16.660 1.00 0.00 H new ATOM 0 HE1 HIS B 15 82.713 -3.845 -15.740 1.00 0.00 H new ATOM 0 HE2 HIS B 15 81.002 -3.608 -17.627 1.00 0.00 H new ATOM 1691 N GLN B 16 78.858 1.037 -14.706 1.00 0.00 N ATOM 1692 CA GLN B 16 79.054 2.006 -15.820 1.00 0.00 C ATOM 1693 C GLN B 16 79.924 3.174 -15.345 1.00 0.00 C ATOM 1694 O GLN B 16 80.720 3.713 -16.089 1.00 0.00 O ATOM 1695 CB GLN B 16 77.690 2.552 -16.267 1.00 0.00 C ATOM 1696 CG GLN B 16 76.868 1.456 -16.957 1.00 0.00 C ATOM 1697 CD GLN B 16 77.592 0.961 -18.209 1.00 0.00 C ATOM 1698 OE1 GLN B 16 77.744 -0.228 -18.401 1.00 0.00 O ATOM 1699 NE2 GLN B 16 78.058 1.825 -19.066 1.00 0.00 N ATOM 0 H GLN B 16 77.911 0.986 -14.331 1.00 0.00 H new ATOM 0 HA GLN B 16 79.544 1.499 -16.651 1.00 0.00 H new ATOM 0 HB2 GLN B 16 77.145 2.934 -15.404 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.834 3.390 -16.949 1.00 0.00 H new ATOM 0 HG2 GLN B 16 76.706 0.626 -16.270 1.00 0.00 H new ATOM 0 HG3 GLN B 16 75.885 1.843 -17.226 1.00 0.00 H new ATOM 0 HE21 GLN B 16 77.930 2.824 -18.904 1.00 0.00 H new ATOM 0 HE22 GLN B 16 78.551 1.502 -19.899 1.00 0.00 H new ATOM 1708 N TYR B 17 79.759 3.585 -14.113 1.00 0.00 N ATOM 1709 CA TYR B 17 80.557 4.735 -13.592 1.00 0.00 C ATOM 1710 C TYR B 17 81.934 4.268 -13.095 1.00 0.00 C ATOM 1711 O TYR B 17 82.934 4.910 -13.347 1.00 0.00 O ATOM 1712 CB TYR B 17 79.772 5.430 -12.459 1.00 0.00 C ATOM 1713 CG TYR B 17 78.875 6.505 -13.042 1.00 0.00 C ATOM 1714 CD1 TYR B 17 79.368 7.804 -13.199 1.00 0.00 C ATOM 1715 CD2 TYR B 17 77.563 6.205 -13.431 1.00 0.00 C ATOM 1716 CE1 TYR B 17 78.554 8.803 -13.744 1.00 0.00 C ATOM 1717 CE2 TYR B 17 76.748 7.204 -13.975 1.00 0.00 C ATOM 1718 CZ TYR B 17 77.242 8.503 -14.131 1.00 0.00 C ATOM 1719 OH TYR B 17 76.438 9.487 -14.668 1.00 0.00 O ATOM 0 H TYR B 17 79.106 3.174 -13.446 1.00 0.00 H new ATOM 0 HA TYR B 17 80.724 5.447 -14.401 1.00 0.00 H new ATOM 0 HB2 TYR B 17 79.173 4.698 -11.917 1.00 0.00 H new ATOM 0 HB3 TYR B 17 80.464 5.870 -11.741 1.00 0.00 H new ATOM 0 HD1 TYR B 17 80.379 8.037 -12.899 1.00 0.00 H new ATOM 0 HD2 TYR B 17 77.180 5.202 -13.311 1.00 0.00 H new ATOM 0 HE1 TYR B 17 78.937 9.805 -13.866 1.00 0.00 H new ATOM 0 HE2 TYR B 17 75.737 6.972 -14.275 1.00 0.00 H new ATOM 0 HH TYR B 17 75.559 9.110 -14.883 1.00 0.00 H new ATOM 1729 N SER B 18 82.014 3.169 -12.390 1.00 0.00 N ATOM 1730 CA SER B 18 83.342 2.702 -11.895 1.00 0.00 C ATOM 1731 C SER B 18 84.191 2.203 -13.065 1.00 0.00 C ATOM 1732 O SER B 18 85.401 2.124 -12.982 1.00 0.00 O ATOM 1733 CB SER B 18 83.142 1.563 -10.893 1.00 0.00 C ATOM 1734 OG SER B 18 84.394 1.222 -10.307 1.00 0.00 O ATOM 0 H SER B 18 81.222 2.578 -12.137 1.00 0.00 H new ATOM 0 HA SER B 18 83.853 3.534 -11.410 1.00 0.00 H new ATOM 0 HB2 SER B 18 82.436 1.865 -10.119 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.714 0.695 -11.394 1.00 0.00 H new ATOM 0 HG SER B 18 84.726 0.390 -10.705 1.00 0.00 H new ATOM 1740 N GLY B 19 83.561 1.850 -14.153 1.00 0.00 N ATOM 1741 CA GLY B 19 84.315 1.336 -15.334 1.00 0.00 C ATOM 1742 C GLY B 19 84.812 2.499 -16.188 1.00 0.00 C ATOM 1743 O GLY B 19 85.103 2.341 -17.358 1.00 0.00 O ATOM 0 H GLY B 19 82.549 1.896 -14.276 1.00 0.00 H new ATOM 0 HA2 GLY B 19 85.160 0.733 -15.001 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.674 0.686 -15.929 1.00 0.00 H new ATOM 1747 N ARG B 20 84.915 3.669 -15.622 1.00 0.00 N ATOM 1748 CA ARG B 20 85.398 4.840 -16.407 1.00 0.00 C ATOM 1749 C ARG B 20 86.931 4.898 -16.345 1.00 0.00 C ATOM 1750 O ARG B 20 87.600 4.956 -17.358 1.00 0.00 O ATOM 1751 CB ARG B 20 84.795 6.108 -15.806 1.00 0.00 C ATOM 1752 CG ARG B 20 85.020 7.289 -16.745 1.00 0.00 C ATOM 1753 CD ARG B 20 84.400 8.543 -16.127 1.00 0.00 C ATOM 1754 NE ARG B 20 84.539 9.679 -17.077 1.00 0.00 N ATOM 1755 CZ ARG B 20 83.732 9.776 -18.099 1.00 0.00 C ATOM 1756 NH1 ARG B 20 82.788 8.891 -18.268 1.00 0.00 N ATOM 1757 NH2 ARG B 20 83.873 10.758 -18.949 1.00 0.00 N ATOM 0 H ARG B 20 84.685 3.866 -14.648 1.00 0.00 H new ATOM 0 HA ARG B 20 85.094 4.751 -17.450 1.00 0.00 H new ATOM 0 HB2 ARG B 20 83.728 5.967 -15.635 1.00 0.00 H new ATOM 0 HB3 ARG B 20 85.249 6.312 -14.836 1.00 0.00 H new ATOM 0 HG2 ARG B 20 86.087 7.439 -16.911 1.00 0.00 H new ATOM 0 HG3 ARG B 20 84.571 7.087 -17.718 1.00 0.00 H new ATOM 0 HD2 ARG B 20 83.348 8.369 -15.901 1.00 0.00 H new ATOM 0 HD3 ARG B 20 84.893 8.780 -15.184 1.00 0.00 H new ATOM 0 HE ARG B 20 85.264 10.381 -16.930 1.00 0.00 H new ATOM 0 HH11 ARG B 20 82.682 8.125 -17.602 1.00 0.00 H new ATOM 0 HH12 ARG B 20 82.157 8.965 -19.066 1.00 0.00 H new ATOM 0 HH21 ARG B 20 84.613 11.447 -18.814 1.00 0.00 H new ATOM 0 HH22 ARG B 20 83.244 10.835 -19.748 1.00 0.00 H new ATOM 1771 N GLU B 21 87.491 4.875 -15.158 1.00 0.00 N ATOM 1772 CA GLU B 21 88.979 4.919 -15.005 1.00 0.00 C ATOM 1773 C GLU B 21 89.377 4.122 -13.760 1.00 0.00 C ATOM 1774 O GLU B 21 88.570 3.871 -12.888 1.00 0.00 O ATOM 1775 CB GLU B 21 89.458 6.368 -14.867 1.00 0.00 C ATOM 1776 CG GLU B 21 89.380 7.065 -16.227 1.00 0.00 C ATOM 1777 CD GLU B 21 89.858 8.511 -16.091 1.00 0.00 C ATOM 1778 OE1 GLU B 21 90.066 8.945 -14.969 1.00 0.00 O ATOM 1779 OE2 GLU B 21 90.014 9.160 -17.114 1.00 0.00 O ATOM 0 H GLU B 21 86.974 4.827 -14.280 1.00 0.00 H new ATOM 0 HA GLU B 21 89.444 4.483 -15.889 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.843 6.898 -14.140 1.00 0.00 H new ATOM 0 HB3 GLU B 21 90.482 6.389 -14.494 1.00 0.00 H new ATOM 0 HG2 GLU B 21 89.995 6.535 -16.954 1.00 0.00 H new ATOM 0 HG3 GLU B 21 88.356 7.043 -16.600 1.00 0.00 H new ATOM 1786 N GLY B 22 90.613 3.710 -13.675 1.00 0.00 N ATOM 1787 CA GLY B 22 91.052 2.919 -12.489 1.00 0.00 C ATOM 1788 C GLY B 22 90.662 1.457 -12.696 1.00 0.00 C ATOM 1789 O GLY B 22 90.445 1.018 -13.807 1.00 0.00 O ATOM 0 H GLY B 22 91.336 3.886 -14.373 1.00 0.00 H new ATOM 0 HA2 GLY B 22 92.130 3.006 -12.356 1.00 0.00 H new ATOM 0 HA3 GLY B 22 90.587 3.308 -11.583 1.00 0.00 H new ATOM 1793 N ASP B 23 90.562 0.697 -11.644 1.00 0.00 N ATOM 1794 CA ASP B 23 90.174 -0.727 -11.804 1.00 0.00 C ATOM 1795 C ASP B 23 88.663 -0.789 -12.019 1.00 0.00 C ATOM 1796 O ASP B 23 87.954 0.177 -11.818 1.00 0.00 O ATOM 1797 CB ASP B 23 90.557 -1.529 -10.551 1.00 0.00 C ATOM 1798 CG ASP B 23 90.660 -3.018 -10.902 1.00 0.00 C ATOM 1799 OD1 ASP B 23 90.189 -3.390 -11.964 1.00 0.00 O ATOM 1800 OD2 ASP B 23 91.209 -3.759 -10.101 1.00 0.00 O ATOM 0 H ASP B 23 90.732 0.999 -10.685 1.00 0.00 H new ATOM 0 HA ASP B 23 90.696 -1.159 -12.658 1.00 0.00 H new ATOM 0 HB2 ASP B 23 91.508 -1.172 -10.156 1.00 0.00 H new ATOM 0 HB3 ASP B 23 89.811 -1.380 -9.770 1.00 0.00 H new ATOM 1805 N LYS B 24 88.169 -1.909 -12.438 1.00 0.00 N ATOM 1806 CA LYS B 24 86.712 -2.039 -12.681 1.00 0.00 C ATOM 1807 C LYS B 24 85.903 -1.802 -11.397 1.00 0.00 C ATOM 1808 O LYS B 24 84.833 -1.227 -11.447 1.00 0.00 O ATOM 1809 CB LYS B 24 86.414 -3.444 -13.203 1.00 0.00 C ATOM 1810 CG LYS B 24 86.964 -3.600 -14.624 1.00 0.00 C ATOM 1811 CD LYS B 24 86.659 -5.009 -15.135 1.00 0.00 C ATOM 1812 CE LYS B 24 87.205 -5.170 -16.555 1.00 0.00 C ATOM 1813 NZ LYS B 24 86.952 -6.559 -17.031 1.00 0.00 N ATOM 0 H LYS B 24 88.715 -2.750 -12.625 1.00 0.00 H new ATOM 0 HA LYS B 24 86.422 -1.285 -13.413 1.00 0.00 H new ATOM 0 HB2 LYS B 24 86.864 -4.188 -12.546 1.00 0.00 H new ATOM 0 HB3 LYS B 24 85.339 -3.623 -13.198 1.00 0.00 H new ATOM 0 HG2 LYS B 24 86.515 -2.857 -15.283 1.00 0.00 H new ATOM 0 HG3 LYS B 24 88.040 -3.424 -14.631 1.00 0.00 H new ATOM 0 HD2 LYS B 24 87.109 -5.751 -14.475 1.00 0.00 H new ATOM 0 HD3 LYS B 24 85.583 -5.185 -15.126 1.00 0.00 H new ATOM 0 HE2 LYS B 24 86.728 -4.453 -17.223 1.00 0.00 H new ATOM 0 HE3 LYS B 24 88.274 -4.958 -16.571 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 87.323 -6.668 -17.996 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 87.427 -7.235 -16.399 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 85.929 -6.745 -17.031 1.00 0.00 H new ATOM 1827 N HIS B 25 86.359 -2.285 -10.256 1.00 0.00 N ATOM 1828 CA HIS B 25 85.559 -2.133 -8.992 1.00 0.00 C ATOM 1829 C HIS B 25 86.220 -1.188 -7.973 1.00 0.00 C ATOM 1830 O HIS B 25 85.687 -0.991 -6.898 1.00 0.00 O ATOM 1831 CB HIS B 25 85.414 -3.517 -8.353 1.00 0.00 C ATOM 1832 CG HIS B 25 84.709 -4.438 -9.308 1.00 0.00 C ATOM 1833 ND1 HIS B 25 84.781 -5.819 -9.195 1.00 0.00 N ATOM 1834 CD2 HIS B 25 83.931 -4.193 -10.413 1.00 0.00 C ATOM 1835 CE1 HIS B 25 84.066 -6.347 -10.204 1.00 0.00 C ATOM 1836 NE2 HIS B 25 83.530 -5.399 -10.973 1.00 0.00 N ATOM 0 H HIS B 25 87.247 -2.775 -10.148 1.00 0.00 H new ATOM 0 HA HIS B 25 84.595 -1.698 -9.257 1.00 0.00 H new ATOM 0 HB2 HIS B 25 86.396 -3.918 -8.102 1.00 0.00 H new ATOM 0 HB3 HIS B 25 84.853 -3.442 -7.422 1.00 0.00 H new ATOM 0 HD2 HIS B 25 83.671 -3.214 -10.788 1.00 0.00 H new ATOM 0 HE1 HIS B 25 83.941 -7.407 -10.371 1.00 0.00 H new ATOM 0 HE2 HIS B 25 82.947 -5.532 -11.800 1.00 0.00 H new ATOM 1845 N LYS B 26 87.357 -0.601 -8.273 1.00 0.00 N ATOM 1846 CA LYS B 26 88.013 0.323 -7.276 1.00 0.00 C ATOM 1847 C LYS B 26 87.854 1.773 -7.737 1.00 0.00 C ATOM 1848 O LYS B 26 88.196 2.120 -8.848 1.00 0.00 O ATOM 1849 CB LYS B 26 89.506 -0.002 -7.161 1.00 0.00 C ATOM 1850 CG LYS B 26 89.681 -1.451 -6.694 1.00 0.00 C ATOM 1851 CD LYS B 26 91.175 -1.799 -6.629 1.00 0.00 C ATOM 1852 CE LYS B 26 91.861 -1.043 -5.475 1.00 0.00 C ATOM 1853 NZ LYS B 26 92.309 0.295 -5.954 1.00 0.00 N ATOM 0 H LYS B 26 87.858 -0.717 -9.154 1.00 0.00 H new ATOM 0 HA LYS B 26 87.536 0.188 -6.305 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.995 0.142 -8.124 1.00 0.00 H new ATOM 0 HB3 LYS B 26 89.984 0.678 -6.456 1.00 0.00 H new ATOM 0 HG2 LYS B 26 89.224 -1.585 -5.713 1.00 0.00 H new ATOM 0 HG3 LYS B 26 89.170 -2.128 -7.379 1.00 0.00 H new ATOM 0 HD2 LYS B 26 91.297 -2.873 -6.490 1.00 0.00 H new ATOM 0 HD3 LYS B 26 91.654 -1.543 -7.574 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.170 -0.929 -4.639 1.00 0.00 H new ATOM 0 HE3 LYS B 26 92.714 -1.614 -5.108 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 93.295 0.455 -5.665 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 92.242 0.333 -6.991 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 91.703 1.032 -5.541 1.00 0.00 H new ATOM 1867 N LEU B 27 87.337 2.625 -6.888 1.00 0.00 N ATOM 1868 CA LEU B 27 87.152 4.060 -7.274 1.00 0.00 C ATOM 1869 C LEU B 27 88.304 4.888 -6.700 1.00 0.00 C ATOM 1870 O LEU B 27 88.642 4.789 -5.538 1.00 0.00 O ATOM 1871 CB LEU B 27 85.832 4.582 -6.706 1.00 0.00 C ATOM 1872 CG LEU B 27 84.660 3.753 -7.245 1.00 0.00 C ATOM 1873 CD1 LEU B 27 83.363 4.233 -6.584 1.00 0.00 C ATOM 1874 CD2 LEU B 27 84.550 3.911 -8.771 1.00 0.00 C ATOM 0 H LEU B 27 87.034 2.390 -5.943 1.00 0.00 H new ATOM 0 HA LEU B 27 87.138 4.142 -8.361 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.851 4.533 -5.617 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.700 5.630 -6.976 1.00 0.00 H new ATOM 0 HG LEU B 27 84.829 2.701 -7.015 1.00 0.00 H new ATOM 0 HD11 LEU B 27 82.524 3.649 -6.962 1.00 0.00 H new ATOM 0 HD12 LEU B 27 83.436 4.106 -5.504 1.00 0.00 H new ATOM 0 HD13 LEU B 27 83.205 5.286 -6.816 1.00 0.00 H new ATOM 0 HD21 LEU B 27 83.714 3.317 -9.139 1.00 0.00 H new ATOM 0 HD22 LEU B 27 84.386 4.960 -9.017 1.00 0.00 H new ATOM 0 HD23 LEU B 27 85.473 3.568 -9.240 1.00 0.00 H new ATOM 1886 N LYS B 28 88.908 5.705 -7.522 1.00 0.00 N ATOM 1887 CA LYS B 28 90.047 6.557 -7.062 1.00 0.00 C ATOM 1888 C LYS B 28 89.516 7.933 -6.631 1.00 0.00 C ATOM 1889 O LYS B 28 88.379 8.277 -6.882 1.00 0.00 O ATOM 1890 CB LYS B 28 91.054 6.718 -8.216 1.00 0.00 C ATOM 1891 CG LYS B 28 92.013 5.520 -8.253 1.00 0.00 C ATOM 1892 CD LYS B 28 91.240 4.244 -8.602 1.00 0.00 C ATOM 1893 CE LYS B 28 92.227 3.145 -9.009 1.00 0.00 C ATOM 1894 NZ LYS B 28 91.480 1.892 -9.307 1.00 0.00 N ATOM 0 H LYS B 28 88.658 5.820 -8.504 1.00 0.00 H new ATOM 0 HA LYS B 28 90.543 6.087 -6.213 1.00 0.00 H new ATOM 0 HB2 LYS B 28 90.522 6.797 -9.164 1.00 0.00 H new ATOM 0 HB3 LYS B 28 91.619 7.642 -8.089 1.00 0.00 H new ATOM 0 HG2 LYS B 28 92.797 5.693 -8.990 1.00 0.00 H new ATOM 0 HG3 LYS B 28 92.503 5.406 -7.286 1.00 0.00 H new ATOM 0 HD2 LYS B 28 90.649 3.918 -7.746 1.00 0.00 H new ATOM 0 HD3 LYS B 28 90.542 4.440 -9.416 1.00 0.00 H new ATOM 0 HE2 LYS B 28 92.796 3.459 -9.884 1.00 0.00 H new ATOM 0 HE3 LYS B 28 92.945 2.971 -8.207 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 92.028 1.311 -9.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 91.330 1.360 -8.426 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 90.560 2.129 -9.730 1.00 0.00 H new ATOM 1908 N LYS B 29 90.324 8.708 -5.956 1.00 0.00 N ATOM 1909 CA LYS B 29 89.862 10.045 -5.482 1.00 0.00 C ATOM 1910 C LYS B 29 89.420 10.908 -6.674 1.00 0.00 C ATOM 1911 O LYS B 29 88.350 11.484 -6.663 1.00 0.00 O ATOM 1912 CB LYS B 29 91.028 10.720 -4.756 1.00 0.00 C ATOM 1913 CG LYS B 29 90.598 12.082 -4.207 1.00 0.00 C ATOM 1914 CD LYS B 29 91.785 12.726 -3.485 1.00 0.00 C ATOM 1915 CE LYS B 29 91.381 14.091 -2.924 1.00 0.00 C ATOM 1916 NZ LYS B 29 90.518 14.803 -3.906 1.00 0.00 N ATOM 0 H LYS B 29 91.286 8.472 -5.712 1.00 0.00 H new ATOM 0 HA LYS B 29 89.011 9.929 -4.810 1.00 0.00 H new ATOM 0 HB2 LYS B 29 91.374 10.085 -3.940 1.00 0.00 H new ATOM 0 HB3 LYS B 29 91.867 10.845 -5.440 1.00 0.00 H new ATOM 0 HG2 LYS B 29 90.258 12.725 -5.019 1.00 0.00 H new ATOM 0 HG3 LYS B 29 89.759 11.964 -3.521 1.00 0.00 H new ATOM 0 HD2 LYS B 29 92.124 12.078 -2.677 1.00 0.00 H new ATOM 0 HD3 LYS B 29 92.621 12.840 -4.174 1.00 0.00 H new ATOM 0 HE2 LYS B 29 90.848 13.964 -1.982 1.00 0.00 H new ATOM 0 HE3 LYS B 29 92.270 14.684 -2.710 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 90.427 15.801 -3.628 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 90.947 14.745 -4.852 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 89.577 14.361 -3.925 1.00 0.00 H new ATOM 1930 N SER B 30 90.221 11.007 -7.698 1.00 0.00 N ATOM 1931 CA SER B 30 89.820 11.835 -8.877 1.00 0.00 C ATOM 1932 C SER B 30 88.518 11.285 -9.481 1.00 0.00 C ATOM 1933 O SER B 30 87.634 12.022 -9.872 1.00 0.00 O ATOM 1934 CB SER B 30 90.936 11.807 -9.918 1.00 0.00 C ATOM 1935 OG SER B 30 92.053 12.537 -9.425 1.00 0.00 O ATOM 0 H SER B 30 91.132 10.554 -7.773 1.00 0.00 H new ATOM 0 HA SER B 30 89.652 12.864 -8.560 1.00 0.00 H new ATOM 0 HB2 SER B 30 91.225 10.778 -10.132 1.00 0.00 H new ATOM 0 HB3 SER B 30 90.587 12.241 -10.855 1.00 0.00 H new ATOM 0 HG SER B 30 92.773 12.521 -10.089 1.00 0.00 H new ATOM 1941 N GLU B 31 88.401 9.989 -9.541 1.00 0.00 N ATOM 1942 CA GLU B 31 87.166 9.356 -10.091 1.00 0.00 C ATOM 1943 C GLU B 31 86.014 9.588 -9.108 1.00 0.00 C ATOM 1944 O GLU B 31 84.884 9.835 -9.486 1.00 0.00 O ATOM 1945 CB GLU B 31 87.406 7.852 -10.249 1.00 0.00 C ATOM 1946 CG GLU B 31 86.196 7.194 -10.920 1.00 0.00 C ATOM 1947 CD GLU B 31 86.494 5.712 -11.137 1.00 0.00 C ATOM 1948 OE1 GLU B 31 87.601 5.301 -10.836 1.00 0.00 O ATOM 1949 OE2 GLU B 31 85.611 5.014 -11.601 1.00 0.00 O ATOM 0 H GLU B 31 89.116 9.332 -9.229 1.00 0.00 H new ATOM 0 HA GLU B 31 86.918 9.790 -11.059 1.00 0.00 H new ATOM 0 HB2 GLU B 31 88.301 7.679 -10.846 1.00 0.00 H new ATOM 0 HB3 GLU B 31 87.581 7.399 -9.273 1.00 0.00 H new ATOM 0 HG2 GLU B 31 85.309 7.313 -10.297 1.00 0.00 H new ATOM 0 HG3 GLU B 31 85.984 7.679 -11.873 1.00 0.00 H new ATOM 1956 N LEU B 32 86.322 9.513 -7.844 1.00 0.00 N ATOM 1957 CA LEU B 32 85.281 9.729 -6.799 1.00 0.00 C ATOM 1958 C LEU B 32 84.712 11.141 -6.945 1.00 0.00 C ATOM 1959 O LEU B 32 83.515 11.345 -6.893 1.00 0.00 O ATOM 1960 CB LEU B 32 85.894 9.550 -5.403 1.00 0.00 C ATOM 1961 CG LEU B 32 84.822 9.751 -4.314 1.00 0.00 C ATOM 1962 CD1 LEU B 32 83.739 8.668 -4.427 1.00 0.00 C ATOM 1963 CD2 LEU B 32 85.487 9.672 -2.936 1.00 0.00 C ATOM 0 H LEU B 32 87.256 9.310 -7.487 1.00 0.00 H new ATOM 0 HA LEU B 32 84.481 8.999 -6.924 1.00 0.00 H new ATOM 0 HB2 LEU B 32 86.328 8.554 -5.315 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.704 10.265 -5.261 1.00 0.00 H new ATOM 0 HG LEU B 32 84.355 10.727 -4.445 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.988 8.822 -3.652 1.00 0.00 H new ATOM 0 HD12 LEU B 32 83.266 8.727 -5.407 1.00 0.00 H new ATOM 0 HD13 LEU B 32 84.193 7.685 -4.302 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.734 9.813 -2.160 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.955 8.695 -2.814 1.00 0.00 H new ATOM 0 HD23 LEU B 32 86.245 10.451 -2.853 1.00 0.00 H new ATOM 1975 N LYS B 33 85.562 12.116 -7.119 1.00 0.00 N ATOM 1976 CA LYS B 33 85.080 13.521 -7.260 1.00 0.00 C ATOM 1977 C LYS B 33 84.162 13.647 -8.477 1.00 0.00 C ATOM 1978 O LYS B 33 83.166 14.337 -8.437 1.00 0.00 O ATOM 1979 CB LYS B 33 86.280 14.465 -7.418 1.00 0.00 C ATOM 1980 CG LYS B 33 85.794 15.918 -7.497 1.00 0.00 C ATOM 1981 CD LYS B 33 86.997 16.848 -7.644 1.00 0.00 C ATOM 1982 CE LYS B 33 86.518 18.299 -7.725 1.00 0.00 C ATOM 1983 NZ LYS B 33 87.615 19.147 -8.272 1.00 0.00 N ATOM 0 H LYS B 33 86.574 12.000 -7.170 1.00 0.00 H new ATOM 0 HA LYS B 33 84.519 13.793 -6.366 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.961 14.345 -6.576 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.839 14.210 -8.318 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.119 16.042 -8.344 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.230 16.174 -6.600 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.671 16.724 -6.796 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.561 16.590 -8.540 1.00 0.00 H new ATOM 0 HE2 LYS B 33 85.636 18.368 -8.362 1.00 0.00 H new ATOM 0 HE3 LYS B 33 86.226 18.654 -6.737 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 87.289 20.132 -8.345 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 88.438 19.101 -7.638 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 87.884 18.801 -9.215 1.00 0.00 H new ATOM 1997 N GLU B 34 84.491 12.997 -9.559 1.00 0.00 N ATOM 1998 CA GLU B 34 83.631 13.107 -10.771 1.00 0.00 C ATOM 1999 C GLU B 34 82.236 12.537 -10.489 1.00 0.00 C ATOM 2000 O GLU B 34 81.232 13.135 -10.830 1.00 0.00 O ATOM 2001 CB GLU B 34 84.271 12.338 -11.932 1.00 0.00 C ATOM 2002 CG GLU B 34 85.538 13.062 -12.397 1.00 0.00 C ATOM 2003 CD GLU B 34 85.160 14.379 -13.078 1.00 0.00 C ATOM 2004 OE1 GLU B 34 84.131 14.412 -13.730 1.00 0.00 O ATOM 2005 OE2 GLU B 34 85.909 15.329 -12.944 1.00 0.00 O ATOM 0 H GLU B 34 85.311 12.399 -9.657 1.00 0.00 H new ATOM 0 HA GLU B 34 83.537 14.160 -11.037 1.00 0.00 H new ATOM 0 HB2 GLU B 34 84.515 11.323 -11.617 1.00 0.00 H new ATOM 0 HB3 GLU B 34 83.565 12.254 -12.758 1.00 0.00 H new ATOM 0 HG2 GLU B 34 86.191 13.256 -11.546 1.00 0.00 H new ATOM 0 HG3 GLU B 34 86.096 12.431 -13.089 1.00 0.00 H new ATOM 2012 N LEU B 35 82.162 11.387 -9.877 1.00 0.00 N ATOM 2013 CA LEU B 35 80.826 10.782 -9.585 1.00 0.00 C ATOM 2014 C LEU B 35 80.014 11.724 -8.690 1.00 0.00 C ATOM 2015 O LEU B 35 78.870 12.027 -8.968 1.00 0.00 O ATOM 2016 CB LEU B 35 81.029 9.437 -8.866 1.00 0.00 C ATOM 2017 CG LEU B 35 79.675 8.779 -8.541 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.958 8.372 -9.837 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.914 7.534 -7.684 1.00 0.00 C ATOM 0 H LEU B 35 82.965 10.840 -9.566 1.00 0.00 H new ATOM 0 HA LEU B 35 80.286 10.624 -10.518 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.621 8.770 -9.493 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.592 9.593 -7.946 1.00 0.00 H new ATOM 0 HG LEU B 35 79.053 9.492 -8.000 1.00 0.00 H new ATOM 0 HD11 LEU B 35 78.002 7.908 -9.594 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.786 9.256 -10.451 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.576 7.663 -10.387 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.959 7.064 -7.451 1.00 0.00 H new ATOM 0 HD22 LEU B 35 80.541 6.830 -8.232 1.00 0.00 H new ATOM 0 HD23 LEU B 35 80.413 7.820 -6.758 1.00 0.00 H new ATOM 2031 N ILE B 36 80.594 12.183 -7.616 1.00 0.00 N ATOM 2032 CA ILE B 36 79.853 13.098 -6.707 1.00 0.00 C ATOM 2033 C ILE B 36 79.451 14.363 -7.468 1.00 0.00 C ATOM 2034 O ILE B 36 78.313 14.773 -7.446 1.00 0.00 O ATOM 2035 CB ILE B 36 80.753 13.470 -5.522 1.00 0.00 C ATOM 2036 CG1 ILE B 36 81.102 12.199 -4.736 1.00 0.00 C ATOM 2037 CG2 ILE B 36 80.018 14.457 -4.610 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.164 12.518 -3.677 1.00 0.00 C ATOM 0 H ILE B 36 81.548 11.964 -7.330 1.00 0.00 H new ATOM 0 HA ILE B 36 78.955 12.602 -6.340 1.00 0.00 H new ATOM 0 HB ILE B 36 81.669 13.935 -5.887 1.00 0.00 H new ATOM 0 HG12 ILE B 36 80.208 11.799 -4.258 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.472 11.431 -5.415 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.658 14.721 -3.768 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.770 15.357 -5.173 1.00 0.00 H new ATOM 0 HG23 ILE B 36 79.102 13.997 -4.239 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.408 11.612 -3.122 1.00 0.00 H new ATOM 0 HD12 ILE B 36 83.062 12.898 -4.165 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.778 13.271 -2.990 1.00 0.00 H new ATOM 2050 N ASN B 37 80.376 14.980 -8.145 1.00 0.00 N ATOM 2051 CA ASN B 37 80.044 16.221 -8.901 1.00 0.00 C ATOM 2052 C ASN B 37 78.999 15.935 -9.984 1.00 0.00 C ATOM 2053 O ASN B 37 78.117 16.733 -10.230 1.00 0.00 O ATOM 2054 CB ASN B 37 81.311 16.770 -9.551 1.00 0.00 C ATOM 2055 CG ASN B 37 80.979 18.050 -10.324 1.00 0.00 C ATOM 2056 OD1 ASN B 37 80.318 18.926 -9.808 1.00 0.00 O ATOM 2057 ND2 ASN B 37 81.411 18.195 -11.548 1.00 0.00 N ATOM 0 H ASN B 37 81.349 14.680 -8.209 1.00 0.00 H new ATOM 0 HA ASN B 37 79.632 16.953 -8.206 1.00 0.00 H new ATOM 0 HB2 ASN B 37 82.062 16.978 -8.789 1.00 0.00 H new ATOM 0 HB3 ASN B 37 81.738 16.027 -10.225 1.00 0.00 H new ATOM 0 HD21 ASN B 37 81.192 19.044 -12.069 1.00 0.00 H new ATOM 0 HD22 ASN B 37 81.967 17.459 -11.983 1.00 0.00 H new ATOM 2064 N ASN B 38 79.108 14.821 -10.654 1.00 0.00 N ATOM 2065 CA ASN B 38 78.137 14.512 -11.741 1.00 0.00 C ATOM 2066 C ASN B 38 76.792 14.048 -11.170 1.00 0.00 C ATOM 2067 O ASN B 38 75.752 14.588 -11.494 1.00 0.00 O ATOM 2068 CB ASN B 38 78.718 13.404 -12.627 1.00 0.00 C ATOM 2069 CG ASN B 38 79.933 13.945 -13.385 1.00 0.00 C ATOM 2070 OD1 ASN B 38 80.052 15.137 -13.587 1.00 0.00 O ATOM 2071 ND2 ASN B 38 80.849 13.119 -13.809 1.00 0.00 N ATOM 0 H ASN B 38 79.825 14.113 -10.496 1.00 0.00 H new ATOM 0 HA ASN B 38 77.967 15.419 -12.322 1.00 0.00 H new ATOM 0 HB2 ASN B 38 79.008 12.549 -12.016 1.00 0.00 H new ATOM 0 HB3 ASN B 38 77.963 13.052 -13.331 1.00 0.00 H new ATOM 0 HD21 ASN B 38 81.664 13.474 -14.309 1.00 0.00 H new ATOM 0 HD22 ASN B 38 80.751 12.118 -13.640 1.00 0.00 H new ATOM 2078 N GLU B 39 76.791 13.020 -10.362 1.00 0.00 N ATOM 2079 CA GLU B 39 75.498 12.493 -9.826 1.00 0.00 C ATOM 2080 C GLU B 39 75.064 13.219 -8.547 1.00 0.00 C ATOM 2081 O GLU B 39 74.136 14.002 -8.561 1.00 0.00 O ATOM 2082 CB GLU B 39 75.652 11.004 -9.520 1.00 0.00 C ATOM 2083 CG GLU B 39 75.780 10.224 -10.831 1.00 0.00 C ATOM 2084 CD GLU B 39 75.936 8.734 -10.524 1.00 0.00 C ATOM 2085 OE1 GLU B 39 75.886 8.380 -9.359 1.00 0.00 O ATOM 2086 OE2 GLU B 39 76.105 7.972 -11.461 1.00 0.00 O ATOM 0 H GLU B 39 77.626 12.523 -10.050 1.00 0.00 H new ATOM 0 HA GLU B 39 74.733 12.660 -10.584 1.00 0.00 H new ATOM 0 HB2 GLU B 39 76.532 10.839 -8.899 1.00 0.00 H new ATOM 0 HB3 GLU B 39 74.791 10.647 -8.955 1.00 0.00 H new ATOM 0 HG2 GLU B 39 74.899 10.388 -11.452 1.00 0.00 H new ATOM 0 HG3 GLU B 39 76.640 10.582 -11.397 1.00 0.00 H new ATOM 2093 N LEU B 40 75.691 12.937 -7.434 1.00 0.00 N ATOM 2094 CA LEU B 40 75.257 13.585 -6.156 1.00 0.00 C ATOM 2095 C LEU B 40 75.869 14.980 -6.021 1.00 0.00 C ATOM 2096 O LEU B 40 76.982 15.145 -5.563 1.00 0.00 O ATOM 2097 CB LEU B 40 75.693 12.712 -4.970 1.00 0.00 C ATOM 2098 CG LEU B 40 75.220 13.327 -3.641 1.00 0.00 C ATOM 2099 CD1 LEU B 40 73.683 13.343 -3.577 1.00 0.00 C ATOM 2100 CD2 LEU B 40 75.773 12.485 -2.482 1.00 0.00 C ATOM 0 H LEU B 40 76.477 12.293 -7.353 1.00 0.00 H new ATOM 0 HA LEU B 40 74.172 13.684 -6.164 1.00 0.00 H new ATOM 0 HB2 LEU B 40 75.281 11.709 -5.079 1.00 0.00 H new ATOM 0 HB3 LEU B 40 76.778 12.612 -4.965 1.00 0.00 H new ATOM 0 HG LEU B 40 75.583 14.352 -3.567 1.00 0.00 H new ATOM 0 HD11 LEU B 40 73.363 13.781 -2.631 1.00 0.00 H new ATOM 0 HD12 LEU B 40 73.291 13.936 -4.403 1.00 0.00 H new ATOM 0 HD13 LEU B 40 73.305 12.323 -3.651 1.00 0.00 H new ATOM 0 HD21 LEU B 40 75.445 12.911 -1.534 1.00 0.00 H new ATOM 0 HD22 LEU B 40 75.405 11.462 -2.567 1.00 0.00 H new ATOM 0 HD23 LEU B 40 76.862 12.483 -2.521 1.00 0.00 H new ATOM 2112 N SER B 41 75.127 15.983 -6.390 1.00 0.00 N ATOM 2113 CA SER B 41 75.621 17.386 -6.271 1.00 0.00 C ATOM 2114 C SER B 41 74.424 18.301 -5.987 1.00 0.00 C ATOM 2115 O SER B 41 74.534 19.295 -5.300 1.00 0.00 O ATOM 2116 CB SER B 41 76.297 17.803 -7.576 1.00 0.00 C ATOM 2117 OG SER B 41 77.223 16.798 -7.962 1.00 0.00 O ATOM 0 H SER B 41 74.187 15.892 -6.774 1.00 0.00 H new ATOM 0 HA SER B 41 76.346 17.462 -5.460 1.00 0.00 H new ATOM 0 HB2 SER B 41 75.550 17.946 -8.357 1.00 0.00 H new ATOM 0 HB3 SER B 41 76.809 18.756 -7.446 1.00 0.00 H new ATOM 0 HG SER B 41 77.591 16.368 -7.162 1.00 0.00 H new ATOM 2123 N HIS B 42 73.280 17.964 -6.522 1.00 0.00 N ATOM 2124 CA HIS B 42 72.062 18.794 -6.308 1.00 0.00 C ATOM 2125 C HIS B 42 71.700 18.846 -4.819 1.00 0.00 C ATOM 2126 O HIS B 42 70.892 19.658 -4.409 1.00 0.00 O ATOM 2127 CB HIS B 42 70.894 18.182 -7.083 1.00 0.00 C ATOM 2128 CG HIS B 42 69.693 19.080 -6.977 1.00 0.00 C ATOM 2129 ND1 HIS B 42 68.670 18.843 -6.068 1.00 0.00 N ATOM 2130 CD2 HIS B 42 69.331 20.216 -7.660 1.00 0.00 C ATOM 2131 CE1 HIS B 42 67.752 19.815 -6.227 1.00 0.00 C ATOM 2132 NE2 HIS B 42 68.108 20.674 -7.183 1.00 0.00 N ATOM 0 H HIS B 42 73.138 17.139 -7.105 1.00 0.00 H new ATOM 0 HA HIS B 42 72.261 19.806 -6.660 1.00 0.00 H new ATOM 0 HB2 HIS B 42 71.169 18.048 -8.129 1.00 0.00 H new ATOM 0 HB3 HIS B 42 70.659 17.195 -6.686 1.00 0.00 H new ATOM 0 HD2 HIS B 42 69.907 20.681 -8.446 1.00 0.00 H new ATOM 0 HE1 HIS B 42 66.841 19.890 -5.652 1.00 0.00 H new ATOM 0 HE2 HIS B 42 67.591 21.495 -7.498 1.00 0.00 H new ATOM 2141 N PHE B 43 72.285 17.998 -4.003 1.00 0.00 N ATOM 2142 CA PHE B 43 71.973 18.009 -2.534 1.00 0.00 C ATOM 2143 C PHE B 43 73.196 18.496 -1.756 1.00 0.00 C ATOM 2144 O PHE B 43 73.113 18.804 -0.586 1.00 0.00 O ATOM 2145 CB PHE B 43 71.642 16.588 -2.073 1.00 0.00 C ATOM 2146 CG PHE B 43 70.332 16.139 -2.674 1.00 0.00 C ATOM 2147 CD1 PHE B 43 69.131 16.395 -1.999 1.00 0.00 C ATOM 2148 CD2 PHE B 43 70.315 15.462 -3.900 1.00 0.00 C ATOM 2149 CE1 PHE B 43 67.916 15.974 -2.550 1.00 0.00 C ATOM 2150 CE2 PHE B 43 69.099 15.040 -4.449 1.00 0.00 C ATOM 2151 CZ PHE B 43 67.900 15.296 -3.774 1.00 0.00 C ATOM 0 H PHE B 43 72.967 17.297 -4.292 1.00 0.00 H new ATOM 0 HA PHE B 43 71.126 18.670 -2.354 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.439 15.906 -2.369 1.00 0.00 H new ATOM 0 HB3 PHE B 43 71.582 16.555 -0.985 1.00 0.00 H new ATOM 0 HD1 PHE B 43 69.143 16.917 -1.054 1.00 0.00 H new ATOM 0 HD2 PHE B 43 71.240 15.266 -4.422 1.00 0.00 H new ATOM 0 HE1 PHE B 43 66.990 16.172 -2.031 1.00 0.00 H new ATOM 0 HE2 PHE B 43 69.086 14.517 -5.394 1.00 0.00 H new ATOM 0 HZ PHE B 43 66.962 14.970 -4.198 1.00 0.00 H new ATOM 2161 N LEU B 44 74.335 18.560 -2.401 1.00 0.00 N ATOM 2162 CA LEU B 44 75.587 19.016 -1.713 1.00 0.00 C ATOM 2163 C LEU B 44 75.988 20.389 -2.256 1.00 0.00 C ATOM 2164 O LEU B 44 75.592 21.411 -1.735 1.00 0.00 O ATOM 2165 CB LEU B 44 76.711 18.002 -1.997 1.00 0.00 C ATOM 2166 CG LEU B 44 76.629 16.837 -0.999 1.00 0.00 C ATOM 2167 CD1 LEU B 44 75.293 16.088 -1.166 1.00 0.00 C ATOM 2168 CD2 LEU B 44 77.803 15.881 -1.247 1.00 0.00 C ATOM 0 H LEU B 44 74.454 18.314 -3.384 1.00 0.00 H new ATOM 0 HA LEU B 44 75.418 19.086 -0.638 1.00 0.00 H new ATOM 0 HB2 LEU B 44 76.624 17.626 -3.016 1.00 0.00 H new ATOM 0 HB3 LEU B 44 77.682 18.491 -1.919 1.00 0.00 H new ATOM 0 HG LEU B 44 76.683 17.225 0.018 1.00 0.00 H new ATOM 0 HD11 LEU B 44 75.246 15.264 -0.454 1.00 0.00 H new ATOM 0 HD12 LEU B 44 74.466 16.774 -0.983 1.00 0.00 H new ATOM 0 HD13 LEU B 44 75.220 15.695 -2.180 1.00 0.00 H new ATOM 0 HD21 LEU B 44 77.752 15.051 -0.542 1.00 0.00 H new ATOM 0 HD22 LEU B 44 77.750 15.496 -2.265 1.00 0.00 H new ATOM 0 HD23 LEU B 44 78.743 16.416 -1.110 1.00 0.00 H new ATOM 2180 N GLU B 45 76.783 20.416 -3.291 1.00 0.00 N ATOM 2181 CA GLU B 45 77.230 21.713 -3.868 1.00 0.00 C ATOM 2182 C GLU B 45 78.039 22.474 -2.817 1.00 0.00 C ATOM 2183 O GLU B 45 78.390 23.624 -2.996 1.00 0.00 O ATOM 2184 CB GLU B 45 76.009 22.535 -4.298 1.00 0.00 C ATOM 2185 CG GLU B 45 76.434 23.604 -5.314 1.00 0.00 C ATOM 2186 CD GLU B 45 75.207 24.379 -5.792 1.00 0.00 C ATOM 2187 OE1 GLU B 45 74.883 25.377 -5.170 1.00 0.00 O ATOM 2188 OE2 GLU B 45 74.616 23.965 -6.773 1.00 0.00 O ATOM 0 H GLU B 45 77.144 19.588 -3.764 1.00 0.00 H new ATOM 0 HA GLU B 45 77.855 21.534 -4.743 1.00 0.00 H new ATOM 0 HB2 GLU B 45 75.256 21.881 -4.738 1.00 0.00 H new ATOM 0 HB3 GLU B 45 75.553 23.008 -3.428 1.00 0.00 H new ATOM 0 HG2 GLU B 45 77.152 24.286 -4.859 1.00 0.00 H new ATOM 0 HG3 GLU B 45 76.933 23.135 -6.162 1.00 0.00 H new ATOM 2195 N GLU B 46 78.347 21.835 -1.717 1.00 0.00 N ATOM 2196 CA GLU B 46 79.144 22.509 -0.650 1.00 0.00 C ATOM 2197 C GLU B 46 80.634 22.204 -0.859 1.00 0.00 C ATOM 2198 O GLU B 46 81.494 22.841 -0.283 1.00 0.00 O ATOM 2199 CB GLU B 46 78.686 22.000 0.721 1.00 0.00 C ATOM 2200 CG GLU B 46 79.489 22.689 1.829 1.00 0.00 C ATOM 2201 CD GLU B 46 78.912 22.311 3.196 1.00 0.00 C ATOM 2202 OE1 GLU B 46 77.921 21.601 3.223 1.00 0.00 O ATOM 2203 OE2 GLU B 46 79.472 22.739 4.192 1.00 0.00 O ATOM 0 H GLU B 46 78.079 20.872 -1.512 1.00 0.00 H new ATOM 0 HA GLU B 46 78.993 23.587 -0.698 1.00 0.00 H new ATOM 0 HB2 GLU B 46 77.622 22.197 0.855 1.00 0.00 H new ATOM 0 HB3 GLU B 46 78.820 20.920 0.781 1.00 0.00 H new ATOM 0 HG2 GLU B 46 80.536 22.392 1.771 1.00 0.00 H new ATOM 0 HG3 GLU B 46 79.456 23.770 1.696 1.00 0.00 H new ATOM 2210 N ILE B 47 80.951 21.235 -1.682 1.00 0.00 N ATOM 2211 CA ILE B 47 82.387 20.896 -1.923 1.00 0.00 C ATOM 2212 C ILE B 47 82.956 21.801 -3.015 1.00 0.00 C ATOM 2213 O ILE B 47 82.523 21.763 -4.150 1.00 0.00 O ATOM 2214 CB ILE B 47 82.505 19.438 -2.373 1.00 0.00 C ATOM 2215 CG1 ILE B 47 81.951 18.514 -1.284 1.00 0.00 C ATOM 2216 CG2 ILE B 47 83.975 19.109 -2.629 1.00 0.00 C ATOM 2217 CD1 ILE B 47 81.841 17.090 -1.833 1.00 0.00 C ATOM 0 H ILE B 47 80.279 20.665 -2.196 1.00 0.00 H new ATOM 0 HA ILE B 47 82.945 21.042 -0.998 1.00 0.00 H new ATOM 0 HB ILE B 47 81.933 19.291 -3.289 1.00 0.00 H new ATOM 0 HG12 ILE B 47 82.604 18.530 -0.412 1.00 0.00 H new ATOM 0 HG13 ILE B 47 80.973 18.866 -0.956 1.00 0.00 H new ATOM 0 HG21 ILE B 47 84.065 18.071 -2.950 1.00 0.00 H new ATOM 0 HG22 ILE B 47 84.364 19.765 -3.408 1.00 0.00 H new ATOM 0 HG23 ILE B 47 84.546 19.256 -1.712 1.00 0.00 H new ATOM 0 HD11 ILE B 47 81.447 16.431 -1.059 1.00 0.00 H new ATOM 0 HD12 ILE B 47 81.171 17.082 -2.692 1.00 0.00 H new ATOM 0 HD13 ILE B 47 82.827 16.741 -2.139 1.00 0.00 H new ATOM 2229 N LYS B 48 83.932 22.611 -2.677 1.00 0.00 N ATOM 2230 CA LYS B 48 84.555 23.529 -3.685 1.00 0.00 C ATOM 2231 C LYS B 48 86.074 23.322 -3.720 1.00 0.00 C ATOM 2232 O LYS B 48 86.714 23.562 -4.725 1.00 0.00 O ATOM 2233 CB LYS B 48 84.261 24.980 -3.300 1.00 0.00 C ATOM 2234 CG LYS B 48 82.772 25.267 -3.493 1.00 0.00 C ATOM 2235 CD LYS B 48 82.476 26.718 -3.111 1.00 0.00 C ATOM 2236 CE LYS B 48 80.987 27.004 -3.302 1.00 0.00 C ATOM 2237 NZ LYS B 48 80.200 26.156 -2.368 1.00 0.00 N ATOM 0 H LYS B 48 84.327 22.676 -1.739 1.00 0.00 H new ATOM 0 HA LYS B 48 84.138 23.310 -4.668 1.00 0.00 H new ATOM 0 HB2 LYS B 48 84.545 25.157 -2.263 1.00 0.00 H new ATOM 0 HB3 LYS B 48 84.855 25.658 -3.913 1.00 0.00 H new ATOM 0 HG2 LYS B 48 82.488 25.088 -4.530 1.00 0.00 H new ATOM 0 HG3 LYS B 48 82.178 24.590 -2.879 1.00 0.00 H new ATOM 0 HD2 LYS B 48 82.761 26.897 -2.074 1.00 0.00 H new ATOM 0 HD3 LYS B 48 83.069 27.395 -3.726 1.00 0.00 H new ATOM 0 HE2 LYS B 48 80.781 28.058 -3.116 1.00 0.00 H new ATOM 0 HE3 LYS B 48 80.695 26.799 -4.332 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 79.474 26.736 -1.901 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 79.741 25.388 -2.899 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 80.834 25.750 -1.650 1.00 0.00 H new ATOM 2251 N GLU B 49 86.658 22.895 -2.623 1.00 0.00 N ATOM 2252 CA GLU B 49 88.146 22.689 -2.575 1.00 0.00 C ATOM 2253 C GLU B 49 88.484 21.200 -2.468 1.00 0.00 C ATOM 2254 O GLU B 49 87.755 20.419 -1.888 1.00 0.00 O ATOM 2255 CB GLU B 49 88.721 23.411 -1.350 1.00 0.00 C ATOM 2256 CG GLU B 49 88.610 24.930 -1.542 1.00 0.00 C ATOM 2257 CD GLU B 49 87.162 25.373 -1.322 1.00 0.00 C ATOM 2258 OE1 GLU B 49 86.375 24.563 -0.863 1.00 0.00 O ATOM 2259 OE2 GLU B 49 86.865 26.519 -1.624 1.00 0.00 O ATOM 0 H GLU B 49 86.167 22.679 -1.755 1.00 0.00 H new ATOM 0 HA GLU B 49 88.578 23.089 -3.492 1.00 0.00 H new ATOM 0 HB2 GLU B 49 88.182 23.108 -0.452 1.00 0.00 H new ATOM 0 HB3 GLU B 49 89.764 23.129 -1.206 1.00 0.00 H new ATOM 0 HG2 GLU B 49 89.268 25.444 -0.841 1.00 0.00 H new ATOM 0 HG3 GLU B 49 88.936 25.204 -2.545 1.00 0.00 H new ATOM 2266 N GLN B 50 89.604 20.815 -3.016 1.00 0.00 N ATOM 2267 CA GLN B 50 90.033 19.390 -2.946 1.00 0.00 C ATOM 2268 C GLN B 50 90.195 18.970 -1.483 1.00 0.00 C ATOM 2269 O GLN B 50 89.871 17.861 -1.106 1.00 0.00 O ATOM 2270 CB GLN B 50 91.364 19.219 -3.685 1.00 0.00 C ATOM 2271 CG GLN B 50 91.136 19.381 -5.189 1.00 0.00 C ATOM 2272 CD GLN B 50 90.379 18.161 -5.723 1.00 0.00 C ATOM 2273 OE1 GLN B 50 89.373 18.300 -6.391 1.00 0.00 O ATOM 2274 NE2 GLN B 50 90.827 16.965 -5.460 1.00 0.00 N ATOM 0 H GLN B 50 90.246 21.433 -3.513 1.00 0.00 H new ATOM 0 HA GLN B 50 89.276 18.761 -3.416 1.00 0.00 H new ATOM 0 HB2 GLN B 50 92.085 19.957 -3.334 1.00 0.00 H new ATOM 0 HB3 GLN B 50 91.786 18.236 -3.474 1.00 0.00 H new ATOM 0 HG2 GLN B 50 90.568 20.290 -5.386 1.00 0.00 H new ATOM 0 HG3 GLN B 50 92.091 19.484 -5.704 1.00 0.00 H new ATOM 0 HE21 GLN B 50 91.671 16.848 -4.899 1.00 0.00 H new ATOM 0 HE22 GLN B 50 90.333 16.146 -5.815 1.00 0.00 H new ATOM 2283 N GLU B 51 90.729 19.834 -0.666 1.00 0.00 N ATOM 2284 CA GLU B 51 90.955 19.477 0.765 1.00 0.00 C ATOM 2285 C GLU B 51 89.648 19.006 1.409 1.00 0.00 C ATOM 2286 O GLU B 51 89.652 18.142 2.265 1.00 0.00 O ATOM 2287 CB GLU B 51 91.476 20.700 1.527 1.00 0.00 C ATOM 2288 CG GLU B 51 92.902 21.024 1.076 1.00 0.00 C ATOM 2289 CD GLU B 51 93.411 22.246 1.842 1.00 0.00 C ATOM 2290 OE1 GLU B 51 92.611 22.877 2.513 1.00 0.00 O ATOM 2291 OE2 GLU B 51 94.598 22.521 1.758 1.00 0.00 O ATOM 0 H GLU B 51 91.020 20.776 -0.927 1.00 0.00 H new ATOM 0 HA GLU B 51 91.688 18.672 0.810 1.00 0.00 H new ATOM 0 HB2 GLU B 51 90.825 21.556 1.348 1.00 0.00 H new ATOM 0 HB3 GLU B 51 91.459 20.506 2.599 1.00 0.00 H new ATOM 0 HG2 GLU B 51 93.555 20.170 1.256 1.00 0.00 H new ATOM 0 HG3 GLU B 51 92.921 21.219 0.004 1.00 0.00 H new ATOM 2298 N VAL B 52 88.534 19.538 0.999 1.00 0.00 N ATOM 2299 CA VAL B 52 87.236 19.097 1.582 1.00 0.00 C ATOM 2300 C VAL B 52 87.003 17.627 1.229 1.00 0.00 C ATOM 2301 O VAL B 52 86.457 16.865 2.003 1.00 0.00 O ATOM 2302 CB VAL B 52 86.106 19.961 1.011 1.00 0.00 C ATOM 2303 CG1 VAL B 52 84.756 19.427 1.487 1.00 0.00 C ATOM 2304 CG2 VAL B 52 86.286 21.402 1.496 1.00 0.00 C ATOM 0 H VAL B 52 88.464 20.261 0.283 1.00 0.00 H new ATOM 0 HA VAL B 52 87.256 19.207 2.666 1.00 0.00 H new ATOM 0 HB VAL B 52 86.137 19.931 -0.078 1.00 0.00 H new ATOM 0 HG11 VAL B 52 83.956 20.044 1.079 1.00 0.00 H new ATOM 0 HG12 VAL B 52 84.631 18.399 1.147 1.00 0.00 H new ATOM 0 HG13 VAL B 52 84.717 19.456 2.576 1.00 0.00 H new ATOM 0 HG21 VAL B 52 85.486 22.024 1.094 1.00 0.00 H new ATOM 0 HG22 VAL B 52 86.252 21.426 2.585 1.00 0.00 H new ATOM 0 HG23 VAL B 52 87.248 21.783 1.154 1.00 0.00 H new ATOM 2314 N VAL B 53 87.435 17.224 0.064 1.00 0.00 N ATOM 2315 CA VAL B 53 87.269 15.801 -0.350 1.00 0.00 C ATOM 2316 C VAL B 53 88.214 14.923 0.476 1.00 0.00 C ATOM 2317 O VAL B 53 87.880 13.822 0.867 1.00 0.00 O ATOM 2318 CB VAL B 53 87.591 15.640 -1.841 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.569 14.150 -2.211 1.00 0.00 C ATOM 2320 CG2 VAL B 53 86.549 16.392 -2.676 1.00 0.00 C ATOM 0 H VAL B 53 87.897 17.822 -0.621 1.00 0.00 H new ATOM 0 HA VAL B 53 86.236 15.497 -0.179 1.00 0.00 H new ATOM 0 HB VAL B 53 88.580 16.050 -2.045 1.00 0.00 H new ATOM 0 HG11 VAL B 53 87.798 14.035 -3.270 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.313 13.617 -1.619 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.580 13.739 -2.006 1.00 0.00 H new ATOM 0 HG21 VAL B 53 86.779 16.277 -3.735 1.00 0.00 H new ATOM 0 HG22 VAL B 53 85.558 15.985 -2.474 1.00 0.00 H new ATOM 0 HG23 VAL B 53 86.567 17.450 -2.414 1.00 0.00 H new ATOM 2330 N ASP B 54 89.406 15.399 0.714 1.00 0.00 N ATOM 2331 CA ASP B 54 90.404 14.596 1.478 1.00 0.00 C ATOM 2332 C ASP B 54 89.870 14.275 2.872 1.00 0.00 C ATOM 2333 O ASP B 54 89.965 13.156 3.336 1.00 0.00 O ATOM 2334 CB ASP B 54 91.689 15.413 1.621 1.00 0.00 C ATOM 2335 CG ASP B 54 92.289 15.668 0.240 1.00 0.00 C ATOM 2336 OD1 ASP B 54 91.523 15.865 -0.691 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.504 15.664 0.135 1.00 0.00 O ATOM 0 H ASP B 54 89.734 16.316 0.410 1.00 0.00 H new ATOM 0 HA ASP B 54 90.597 13.665 0.945 1.00 0.00 H new ATOM 0 HB2 ASP B 54 91.477 16.360 2.117 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.404 14.879 2.247 1.00 0.00 H new ATOM 2342 N LYS B 55 89.298 15.232 3.538 1.00 0.00 N ATOM 2343 CA LYS B 55 88.748 14.956 4.892 1.00 0.00 C ATOM 2344 C LYS B 55 87.621 13.928 4.761 1.00 0.00 C ATOM 2345 O LYS B 55 87.577 12.939 5.466 1.00 0.00 O ATOM 2346 CB LYS B 55 88.214 16.262 5.494 1.00 0.00 C ATOM 2347 CG LYS B 55 87.712 16.019 6.918 1.00 0.00 C ATOM 2348 CD LYS B 55 87.215 17.346 7.504 1.00 0.00 C ATOM 2349 CE LYS B 55 86.807 17.154 8.964 1.00 0.00 C ATOM 2350 NZ LYS B 55 86.708 18.486 9.629 1.00 0.00 N ATOM 0 H LYS B 55 89.187 16.190 3.207 1.00 0.00 H new ATOM 0 HA LYS B 55 89.524 14.559 5.547 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.001 17.016 5.501 1.00 0.00 H new ATOM 0 HB3 LYS B 55 87.405 16.652 4.877 1.00 0.00 H new ATOM 0 HG2 LYS B 55 86.907 15.284 6.913 1.00 0.00 H new ATOM 0 HG3 LYS B 55 88.512 15.611 7.535 1.00 0.00 H new ATOM 0 HD2 LYS B 55 87.999 18.100 7.433 1.00 0.00 H new ATOM 0 HD3 LYS B 55 86.367 17.713 6.926 1.00 0.00 H new ATOM 0 HE2 LYS B 55 85.850 16.635 9.021 1.00 0.00 H new ATOM 0 HE3 LYS B 55 87.539 16.531 9.479 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 86.430 18.358 10.623 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 87.630 18.965 9.586 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 85.994 19.065 9.142 1.00 0.00 H new ATOM 2364 N VAL B 56 86.714 14.162 3.852 1.00 0.00 N ATOM 2365 CA VAL B 56 85.578 13.218 3.653 1.00 0.00 C ATOM 2366 C VAL B 56 86.090 11.857 3.164 1.00 0.00 C ATOM 2367 O VAL B 56 85.632 10.824 3.598 1.00 0.00 O ATOM 2368 CB VAL B 56 84.618 13.814 2.613 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.529 12.798 2.257 1.00 0.00 C ATOM 2370 CG2 VAL B 56 83.972 15.074 3.190 1.00 0.00 C ATOM 0 H VAL B 56 86.712 14.973 3.234 1.00 0.00 H new ATOM 0 HA VAL B 56 85.061 13.070 4.601 1.00 0.00 H new ATOM 0 HB VAL B 56 85.176 14.064 1.711 1.00 0.00 H new ATOM 0 HG11 VAL B 56 82.854 13.232 1.519 1.00 0.00 H new ATOM 0 HG12 VAL B 56 83.990 11.900 1.844 1.00 0.00 H new ATOM 0 HG13 VAL B 56 82.967 12.538 3.154 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.289 15.502 2.456 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.419 14.818 4.094 1.00 0.00 H new ATOM 0 HG23 VAL B 56 84.747 15.802 3.432 1.00 0.00 H new ATOM 2380 N MET B 57 87.026 11.844 2.261 1.00 0.00 N ATOM 2381 CA MET B 57 87.543 10.541 1.743 1.00 0.00 C ATOM 2382 C MET B 57 88.147 9.698 2.875 1.00 0.00 C ATOM 2383 O MET B 57 87.867 8.521 2.993 1.00 0.00 O ATOM 2384 CB MET B 57 88.603 10.805 0.673 1.00 0.00 C ATOM 2385 CG MET B 57 88.975 9.492 -0.018 1.00 0.00 C ATOM 2386 SD MET B 57 90.114 9.833 -1.381 1.00 0.00 S ATOM 2387 CE MET B 57 89.919 8.247 -2.225 1.00 0.00 C ATOM 0 H MET B 57 87.458 12.675 1.857 1.00 0.00 H new ATOM 0 HA MET B 57 86.711 9.985 1.311 1.00 0.00 H new ATOM 0 HB2 MET B 57 88.225 11.518 -0.059 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.488 11.252 1.126 1.00 0.00 H new ATOM 0 HG2 MET B 57 89.438 8.811 0.696 1.00 0.00 H new ATOM 0 HG3 MET B 57 88.078 8.999 -0.393 1.00 0.00 H new ATOM 0 HE1 MET B 57 90.761 8.087 -2.899 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.887 7.444 -1.488 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.992 8.251 -2.798 1.00 0.00 H new ATOM 2397 N GLU B 58 88.978 10.278 3.694 1.00 0.00 N ATOM 2398 CA GLU B 58 89.605 9.495 4.805 1.00 0.00 C ATOM 2399 C GLU B 58 88.514 8.939 5.722 1.00 0.00 C ATOM 2400 O GLU B 58 88.523 7.782 6.089 1.00 0.00 O ATOM 2401 CB GLU B 58 90.535 10.413 5.608 1.00 0.00 C ATOM 2402 CG GLU B 58 91.239 9.610 6.703 1.00 0.00 C ATOM 2403 CD GLU B 58 92.163 10.538 7.496 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.310 11.683 7.094 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.712 10.087 8.488 1.00 0.00 O ATOM 0 H GLU B 58 89.253 11.259 3.646 1.00 0.00 H new ATOM 0 HA GLU B 58 90.179 8.667 4.389 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.273 10.867 4.946 1.00 0.00 H new ATOM 0 HB3 GLU B 58 89.962 11.227 6.053 1.00 0.00 H new ATOM 0 HG2 GLU B 58 90.503 9.156 7.367 1.00 0.00 H new ATOM 0 HG3 GLU B 58 91.814 8.796 6.261 1.00 0.00 H new ATOM 2412 N THR B 59 87.580 9.762 6.092 1.00 0.00 N ATOM 2413 CA THR B 59 86.476 9.308 6.984 1.00 0.00 C ATOM 2414 C THR B 59 85.681 8.186 6.317 1.00 0.00 C ATOM 2415 O THR B 59 85.251 7.250 6.961 1.00 0.00 O ATOM 2416 CB THR B 59 85.544 10.484 7.290 1.00 0.00 C ATOM 2417 OG1 THR B 59 86.279 11.507 7.945 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.403 10.010 8.190 1.00 0.00 C ATOM 0 H THR B 59 87.531 10.742 5.813 1.00 0.00 H new ATOM 0 HA THR B 59 86.907 8.932 7.912 1.00 0.00 H new ATOM 0 HB THR B 59 85.129 10.875 6.361 1.00 0.00 H new ATOM 0 HG1 THR B 59 86.751 12.049 7.278 1.00 0.00 H new ATOM 0 HG21 THR B 59 83.740 10.847 8.408 1.00 0.00 H new ATOM 0 HG22 THR B 59 83.842 9.225 7.683 1.00 0.00 H new ATOM 0 HG23 THR B 59 84.813 9.620 9.122 1.00 0.00 H new ATOM 2426 N LEU B 60 85.468 8.280 5.032 1.00 0.00 N ATOM 2427 CA LEU B 60 84.683 7.221 4.334 1.00 0.00 C ATOM 2428 C LEU B 60 85.476 5.917 4.270 1.00 0.00 C ATOM 2429 O LEU B 60 84.924 4.846 4.428 1.00 0.00 O ATOM 2430 CB LEU B 60 84.358 7.670 2.908 1.00 0.00 C ATOM 2431 CG LEU B 60 83.343 8.818 2.917 1.00 0.00 C ATOM 2432 CD1 LEU B 60 83.240 9.386 1.498 1.00 0.00 C ATOM 2433 CD2 LEU B 60 81.959 8.321 3.377 1.00 0.00 C ATOM 0 H LEU B 60 85.801 9.039 4.438 1.00 0.00 H new ATOM 0 HA LEU B 60 83.762 7.055 4.893 1.00 0.00 H new ATOM 0 HB2 LEU B 60 85.271 7.990 2.406 1.00 0.00 H new ATOM 0 HB3 LEU B 60 83.959 6.830 2.340 1.00 0.00 H new ATOM 0 HG LEU B 60 83.676 9.588 3.613 1.00 0.00 H new ATOM 0 HD11 LEU B 60 82.521 10.205 1.485 1.00 0.00 H new ATOM 0 HD12 LEU B 60 84.216 9.755 1.182 1.00 0.00 H new ATOM 0 HD13 LEU B 60 82.910 8.603 0.816 1.00 0.00 H new ATOM 0 HD21 LEU B 60 81.255 9.153 3.376 1.00 0.00 H new ATOM 0 HD22 LEU B 60 81.606 7.546 2.697 1.00 0.00 H new ATOM 0 HD23 LEU B 60 82.036 7.912 4.385 1.00 0.00 H new ATOM 2445 N ASP B 61 86.754 5.979 4.017 1.00 0.00 N ATOM 2446 CA ASP B 61 87.546 4.722 3.917 1.00 0.00 C ATOM 2447 C ASP B 61 87.616 4.047 5.287 1.00 0.00 C ATOM 2448 O ASP B 61 88.365 4.451 6.155 1.00 0.00 O ATOM 2449 CB ASP B 61 88.959 5.056 3.432 1.00 0.00 C ATOM 2450 CG ASP B 61 88.904 5.491 1.966 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.949 5.134 1.298 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.817 6.177 1.537 1.00 0.00 O ATOM 0 H ASP B 61 87.281 6.841 3.876 1.00 0.00 H new ATOM 0 HA ASP B 61 87.068 4.043 3.210 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.387 5.851 4.043 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.608 4.187 3.541 1.00 0.00 H new ATOM 2457 N GLU B 62 86.826 3.029 5.487 1.00 0.00 N ATOM 2458 CA GLU B 62 86.828 2.336 6.805 1.00 0.00 C ATOM 2459 C GLU B 62 88.224 1.781 7.088 1.00 0.00 C ATOM 2460 O GLU B 62 88.703 1.825 8.203 1.00 0.00 O ATOM 2461 CB GLU B 62 85.824 1.179 6.781 1.00 0.00 C ATOM 2462 CG GLU B 62 84.398 1.734 6.735 1.00 0.00 C ATOM 2463 CD GLU B 62 83.398 0.577 6.709 1.00 0.00 C ATOM 2464 OE1 GLU B 62 83.840 -0.559 6.747 1.00 0.00 O ATOM 2465 OE2 GLU B 62 82.210 0.847 6.652 1.00 0.00 O ATOM 0 H GLU B 62 86.180 2.648 4.796 1.00 0.00 H new ATOM 0 HA GLU B 62 86.549 3.046 7.583 1.00 0.00 H new ATOM 0 HB2 GLU B 62 86.006 0.545 5.913 1.00 0.00 H new ATOM 0 HB3 GLU B 62 85.953 0.554 7.665 1.00 0.00 H new ATOM 0 HG2 GLU B 62 84.215 2.367 7.603 1.00 0.00 H new ATOM 0 HG3 GLU B 62 84.269 2.360 5.852 1.00 0.00 H new ATOM 2472 N ASP B 63 88.877 1.241 6.089 1.00 0.00 N ATOM 2473 CA ASP B 63 90.239 0.655 6.302 1.00 0.00 C ATOM 2474 C ASP B 63 91.344 1.650 5.912 1.00 0.00 C ATOM 2475 O ASP B 63 92.514 1.383 6.098 1.00 0.00 O ATOM 2476 CB ASP B 63 90.368 -0.616 5.459 1.00 0.00 C ATOM 2477 CG ASP B 63 90.234 -0.271 3.976 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.920 0.869 3.677 1.00 0.00 O ATOM 2479 OD2 ASP B 63 90.435 -1.157 3.165 1.00 0.00 O ATOM 0 H ASP B 63 88.526 1.180 5.133 1.00 0.00 H new ATOM 0 HA ASP B 63 90.358 0.422 7.360 1.00 0.00 H new ATOM 0 HB2 ASP B 63 91.331 -1.091 5.646 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.599 -1.333 5.746 1.00 0.00 H new ATOM 2484 N GLY B 64 91.000 2.792 5.377 1.00 0.00 N ATOM 2485 CA GLY B 64 92.058 3.774 4.995 1.00 0.00 C ATOM 2486 C GLY B 64 92.860 3.244 3.798 1.00 0.00 C ATOM 2487 O GLY B 64 94.031 3.531 3.656 1.00 0.00 O ATOM 0 H GLY B 64 90.041 3.086 5.189 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.603 4.732 4.743 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.724 3.950 5.840 1.00 0.00 H new ATOM 2491 N ASP B 65 92.250 2.462 2.944 1.00 0.00 N ATOM 2492 CA ASP B 65 92.994 1.903 1.773 1.00 0.00 C ATOM 2493 C ASP B 65 93.297 2.994 0.746 1.00 0.00 C ATOM 2494 O ASP B 65 94.000 2.764 -0.216 1.00 0.00 O ATOM 2495 CB ASP B 65 92.143 0.827 1.099 1.00 0.00 C ATOM 2496 CG ASP B 65 90.864 1.461 0.544 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.486 2.513 1.032 1.00 0.00 O ATOM 2498 OD2 ASP B 65 90.284 0.882 -0.362 1.00 0.00 O ATOM 0 H ASP B 65 91.270 2.186 3.006 1.00 0.00 H new ATOM 0 HA ASP B 65 93.932 1.483 2.135 1.00 0.00 H new ATOM 0 HB2 ASP B 65 92.706 0.354 0.294 1.00 0.00 H new ATOM 0 HB3 ASP B 65 91.893 0.045 1.815 1.00 0.00 H new ATOM 2503 N GLY B 66 92.796 4.183 0.940 1.00 0.00 N ATOM 2504 CA GLY B 66 93.085 5.280 -0.032 1.00 0.00 C ATOM 2505 C GLY B 66 92.038 5.308 -1.156 1.00 0.00 C ATOM 2506 O GLY B 66 91.909 6.294 -1.852 1.00 0.00 O ATOM 0 H GLY B 66 92.201 4.444 1.726 1.00 0.00 H new ATOM 0 HA2 GLY B 66 93.092 6.238 0.487 1.00 0.00 H new ATOM 0 HA3 GLY B 66 94.078 5.141 -0.459 1.00 0.00 H new ATOM 2510 N GLU B 67 91.285 4.248 -1.336 1.00 0.00 N ATOM 2511 CA GLU B 67 90.242 4.219 -2.416 1.00 0.00 C ATOM 2512 C GLU B 67 88.918 3.742 -1.815 1.00 0.00 C ATOM 2513 O GLU B 67 88.876 3.288 -0.688 1.00 0.00 O ATOM 2514 CB GLU B 67 90.671 3.250 -3.522 1.00 0.00 C ATOM 2515 CG GLU B 67 91.864 3.829 -4.287 1.00 0.00 C ATOM 2516 CD GLU B 67 93.130 3.703 -3.433 1.00 0.00 C ATOM 2517 OE1 GLU B 67 93.093 2.977 -2.451 1.00 0.00 O ATOM 2518 OE2 GLU B 67 94.114 4.341 -3.773 1.00 0.00 O ATOM 0 H GLU B 67 91.347 3.396 -0.779 1.00 0.00 H new ATOM 0 HA GLU B 67 90.124 5.218 -2.837 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.938 2.286 -3.089 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.840 3.073 -4.205 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.995 3.300 -5.231 1.00 0.00 H new ATOM 0 HG3 GLU B 67 91.680 4.875 -4.531 1.00 0.00 H new ATOM 2525 N CYS B 68 87.835 3.848 -2.550 1.00 0.00 N ATOM 2526 CA CYS B 68 86.506 3.404 -2.011 1.00 0.00 C ATOM 2527 C CYS B 68 86.093 2.083 -2.668 1.00 0.00 C ATOM 2528 O CYS B 68 85.695 2.042 -3.816 1.00 0.00 O ATOM 2529 CB CYS B 68 85.457 4.476 -2.312 1.00 0.00 C ATOM 2530 SG CYS B 68 85.906 6.011 -1.465 1.00 0.00 S ATOM 0 H CYS B 68 87.813 4.222 -3.499 1.00 0.00 H new ATOM 0 HA CYS B 68 86.583 3.257 -0.934 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.393 4.646 -3.387 1.00 0.00 H new ATOM 0 HB3 CYS B 68 84.473 4.141 -1.983 1.00 0.00 H new ATOM 0 HG CYS B 68 86.639 5.736 -0.427 1.00 0.00 H new ATOM 2536 N ASP B 69 86.207 1.002 -1.939 1.00 0.00 N ATOM 2537 CA ASP B 69 85.851 -0.340 -2.487 1.00 0.00 C ATOM 2538 C ASP B 69 84.339 -0.472 -2.681 1.00 0.00 C ATOM 2539 O ASP B 69 83.568 0.398 -2.327 1.00 0.00 O ATOM 2540 CB ASP B 69 86.328 -1.419 -1.510 1.00 0.00 C ATOM 2541 CG ASP B 69 87.858 -1.509 -1.550 1.00 0.00 C ATOM 2542 OD1 ASP B 69 88.428 -1.120 -2.557 1.00 0.00 O ATOM 2543 OD2 ASP B 69 88.433 -1.964 -0.575 1.00 0.00 O ATOM 0 H ASP B 69 86.536 0.994 -0.974 1.00 0.00 H new ATOM 0 HA ASP B 69 86.335 -0.460 -3.456 1.00 0.00 H new ATOM 0 HB2 ASP B 69 85.994 -1.183 -0.500 1.00 0.00 H new ATOM 0 HB3 ASP B 69 85.890 -2.382 -1.773 1.00 0.00 H new ATOM 2548 N PHE B 70 83.921 -1.574 -3.245 1.00 0.00 N ATOM 2549 CA PHE B 70 82.465 -1.803 -3.471 1.00 0.00 C ATOM 2550 C PHE B 70 81.724 -1.785 -2.130 1.00 0.00 C ATOM 2551 O PHE B 70 80.714 -1.129 -1.971 1.00 0.00 O ATOM 2552 CB PHE B 70 82.245 -3.154 -4.154 1.00 0.00 C ATOM 2553 CG PHE B 70 80.766 -3.344 -4.390 1.00 0.00 C ATOM 2554 CD1 PHE B 70 80.184 -2.869 -5.569 1.00 0.00 C ATOM 2555 CD2 PHE B 70 79.975 -3.983 -3.427 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.813 -3.032 -5.789 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.601 -4.146 -3.647 1.00 0.00 C ATOM 2558 CZ PHE B 70 78.020 -3.670 -4.829 1.00 0.00 C ATOM 0 H PHE B 70 84.530 -2.329 -3.560 1.00 0.00 H new ATOM 0 HA PHE B 70 82.079 -1.010 -4.112 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.786 -3.192 -5.099 1.00 0.00 H new ATOM 0 HB3 PHE B 70 82.635 -3.960 -3.532 1.00 0.00 H new ATOM 0 HD1 PHE B 70 80.794 -2.375 -6.311 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.424 -4.350 -2.516 1.00 0.00 H new ATOM 0 HE1 PHE B 70 78.366 -2.665 -6.701 1.00 0.00 H new ATOM 0 HE2 PHE B 70 77.990 -4.639 -2.905 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.961 -3.795 -4.999 1.00 0.00 H new ATOM 2568 N GLN B 71 82.202 -2.525 -1.173 1.00 0.00 N ATOM 2569 CA GLN B 71 81.504 -2.562 0.140 1.00 0.00 C ATOM 2570 C GLN B 71 81.403 -1.135 0.682 1.00 0.00 C ATOM 2571 O GLN B 71 80.331 -0.664 1.004 1.00 0.00 O ATOM 2572 CB GLN B 71 82.297 -3.435 1.116 1.00 0.00 C ATOM 2573 CG GLN B 71 82.229 -4.900 0.670 1.00 0.00 C ATOM 2574 CD GLN B 71 83.046 -5.083 -0.611 1.00 0.00 C ATOM 2575 OE1 GLN B 71 84.111 -4.514 -0.755 1.00 0.00 O ATOM 2576 NE2 GLN B 71 82.585 -5.861 -1.554 1.00 0.00 N ATOM 0 H GLN B 71 83.040 -3.103 -1.241 1.00 0.00 H new ATOM 0 HA GLN B 71 80.505 -2.982 0.022 1.00 0.00 H new ATOM 0 HB2 GLN B 71 83.335 -3.104 1.154 1.00 0.00 H new ATOM 0 HB3 GLN B 71 81.892 -3.332 2.123 1.00 0.00 H new ATOM 0 HG2 GLN B 71 82.616 -5.549 1.456 1.00 0.00 H new ATOM 0 HG3 GLN B 71 81.193 -5.191 0.498 1.00 0.00 H new ATOM 0 HE21 GLN B 71 81.691 -6.337 -1.431 1.00 0.00 H new ATOM 0 HE22 GLN B 71 83.119 -5.992 -2.413 1.00 0.00 H new ATOM 2585 N GLU B 72 82.503 -0.438 0.787 1.00 0.00 N ATOM 2586 CA GLU B 72 82.440 0.959 1.309 1.00 0.00 C ATOM 2587 C GLU B 72 81.539 1.792 0.387 1.00 0.00 C ATOM 2588 O GLU B 72 80.742 2.595 0.829 1.00 0.00 O ATOM 2589 CB GLU B 72 83.848 1.558 1.329 1.00 0.00 C ATOM 2590 CG GLU B 72 84.686 0.856 2.403 1.00 0.00 C ATOM 2591 CD GLU B 72 86.096 1.451 2.429 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.413 2.214 1.533 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.837 1.126 3.344 1.00 0.00 O ATOM 0 H GLU B 72 83.434 -0.771 0.537 1.00 0.00 H new ATOM 0 HA GLU B 72 82.035 0.961 2.321 1.00 0.00 H new ATOM 0 HB2 GLU B 72 84.318 1.442 0.352 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.797 2.627 1.533 1.00 0.00 H new ATOM 0 HG2 GLU B 72 84.214 0.971 3.379 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.736 -0.213 2.198 1.00 0.00 H new ATOM 2600 N PHE B 73 81.688 1.612 -0.894 1.00 0.00 N ATOM 2601 CA PHE B 73 80.863 2.403 -1.856 1.00 0.00 C ATOM 2602 C PHE B 73 79.393 2.332 -1.422 1.00 0.00 C ATOM 2603 O PHE B 73 78.674 3.311 -1.461 1.00 0.00 O ATOM 2604 CB PHE B 73 81.005 1.837 -3.275 1.00 0.00 C ATOM 2605 CG PHE B 73 80.005 2.512 -4.185 1.00 0.00 C ATOM 2606 CD1 PHE B 73 78.723 1.970 -4.329 1.00 0.00 C ATOM 2607 CD2 PHE B 73 80.354 3.678 -4.870 1.00 0.00 C ATOM 2608 CE1 PHE B 73 77.787 2.596 -5.161 1.00 0.00 C ATOM 2609 CE2 PHE B 73 79.420 4.304 -5.705 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.136 3.762 -5.851 1.00 0.00 C ATOM 0 H PHE B 73 82.342 0.955 -1.319 1.00 0.00 H new ATOM 0 HA PHE B 73 81.206 3.438 -1.858 1.00 0.00 H new ATOM 0 HB2 PHE B 73 82.018 2.000 -3.644 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.838 0.760 -3.268 1.00 0.00 H new ATOM 0 HD1 PHE B 73 78.455 1.068 -3.798 1.00 0.00 H new ATOM 0 HD2 PHE B 73 81.343 4.096 -4.756 1.00 0.00 H new ATOM 0 HE1 PHE B 73 76.797 2.179 -5.270 1.00 0.00 H new ATOM 0 HE2 PHE B 73 79.689 5.205 -6.237 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.416 4.244 -6.496 1.00 0.00 H new ATOM 2620 N MET B 74 78.950 1.185 -0.996 1.00 0.00 N ATOM 2621 CA MET B 74 77.535 1.050 -0.543 1.00 0.00 C ATOM 2622 C MET B 74 77.338 1.865 0.740 1.00 0.00 C ATOM 2623 O MET B 74 76.281 2.409 0.990 1.00 0.00 O ATOM 2624 CB MET B 74 77.213 -0.421 -0.274 1.00 0.00 C ATOM 2625 CG MET B 74 75.709 -0.582 -0.029 1.00 0.00 C ATOM 2626 SD MET B 74 74.811 -0.292 -1.573 1.00 0.00 S ATOM 2627 CE MET B 74 73.304 0.388 -0.837 1.00 0.00 C ATOM 0 H MET B 74 79.506 0.332 -0.941 1.00 0.00 H new ATOM 0 HA MET B 74 76.867 1.422 -1.320 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.521 -1.032 -1.122 1.00 0.00 H new ATOM 0 HB3 MET B 74 77.773 -0.774 0.592 1.00 0.00 H new ATOM 0 HG2 MET B 74 75.496 -1.583 0.345 1.00 0.00 H new ATOM 0 HG3 MET B 74 75.377 0.121 0.735 1.00 0.00 H new ATOM 0 HE1 MET B 74 72.596 0.641 -1.626 1.00 0.00 H new ATOM 0 HE2 MET B 74 72.857 -0.352 -0.173 1.00 0.00 H new ATOM 0 HE3 MET B 74 73.550 1.285 -0.268 1.00 0.00 H new ATOM 2637 N ALA B 75 78.362 1.976 1.543 1.00 0.00 N ATOM 2638 CA ALA B 75 78.238 2.784 2.788 1.00 0.00 C ATOM 2639 C ALA B 75 77.921 4.221 2.370 1.00 0.00 C ATOM 2640 O ALA B 75 76.968 4.823 2.821 1.00 0.00 O ATOM 2641 CB ALA B 75 79.557 2.740 3.563 1.00 0.00 C ATOM 0 H ALA B 75 79.274 1.544 1.391 1.00 0.00 H new ATOM 0 HA ALA B 75 77.451 2.391 3.431 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.464 3.332 4.474 1.00 0.00 H new ATOM 0 HB2 ALA B 75 79.792 1.708 3.823 1.00 0.00 H new ATOM 0 HB3 ALA B 75 80.356 3.149 2.945 1.00 0.00 H new ATOM 2647 N PHE B 76 78.732 4.766 1.506 1.00 0.00 N ATOM 2648 CA PHE B 76 78.511 6.165 1.038 1.00 0.00 C ATOM 2649 C PHE B 76 77.081 6.267 0.521 1.00 0.00 C ATOM 2650 O PHE B 76 76.378 7.226 0.765 1.00 0.00 O ATOM 2651 CB PHE B 76 79.484 6.480 -0.102 1.00 0.00 C ATOM 2652 CG PHE B 76 79.277 7.898 -0.586 1.00 0.00 C ATOM 2653 CD1 PHE B 76 79.987 8.938 0.016 1.00 0.00 C ATOM 2654 CD2 PHE B 76 78.395 8.170 -1.639 1.00 0.00 C ATOM 2655 CE1 PHE B 76 79.821 10.253 -0.424 1.00 0.00 C ATOM 2656 CE2 PHE B 76 78.223 9.490 -2.081 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.938 10.532 -1.472 1.00 0.00 C ATOM 0 H PHE B 76 79.544 4.300 1.101 1.00 0.00 H new ATOM 0 HA PHE B 76 78.675 6.870 1.853 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.511 6.351 0.240 1.00 0.00 H new ATOM 0 HB3 PHE B 76 79.331 5.781 -0.924 1.00 0.00 H new ATOM 0 HD1 PHE B 76 80.668 8.725 0.826 1.00 0.00 H new ATOM 0 HD2 PHE B 76 77.849 7.366 -2.109 1.00 0.00 H new ATOM 0 HE1 PHE B 76 80.374 11.054 0.045 1.00 0.00 H new ATOM 0 HE2 PHE B 76 77.540 9.704 -2.890 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.807 11.549 -1.812 1.00 0.00 H new ATOM 2667 N VAL B 77 76.639 5.255 -0.164 1.00 0.00 N ATOM 2668 CA VAL B 77 75.243 5.267 -0.665 1.00 0.00 C ATOM 2669 C VAL B 77 74.319 5.288 0.556 1.00 0.00 C ATOM 2670 O VAL B 77 73.349 6.015 0.600 1.00 0.00 O ATOM 2671 CB VAL B 77 74.973 4.025 -1.522 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.475 3.915 -1.830 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.745 4.147 -2.838 1.00 0.00 C ATOM 0 H VAL B 77 77.182 4.423 -0.398 1.00 0.00 H new ATOM 0 HA VAL B 77 75.067 6.142 -1.291 1.00 0.00 H new ATOM 0 HB VAL B 77 75.295 3.137 -0.978 1.00 0.00 H new ATOM 0 HG11 VAL B 77 73.293 3.030 -2.439 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.917 3.835 -0.897 1.00 0.00 H new ATOM 0 HG13 VAL B 77 73.149 4.802 -2.373 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.558 3.267 -3.453 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.416 5.039 -3.371 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.812 4.223 -2.628 1.00 0.00 H new ATOM 2683 N SER B 78 74.625 4.497 1.554 1.00 0.00 N ATOM 2684 CA SER B 78 73.778 4.468 2.783 1.00 0.00 C ATOM 2685 C SER B 78 73.922 5.782 3.558 1.00 0.00 C ATOM 2686 O SER B 78 72.951 6.365 3.989 1.00 0.00 O ATOM 2687 CB SER B 78 74.223 3.312 3.678 1.00 0.00 C ATOM 2688 OG SER B 78 73.514 3.367 4.911 1.00 0.00 O ATOM 0 H SER B 78 75.428 3.868 1.569 1.00 0.00 H new ATOM 0 HA SER B 78 72.736 4.336 2.490 1.00 0.00 H new ATOM 0 HB2 SER B 78 74.036 2.360 3.181 1.00 0.00 H new ATOM 0 HB3 SER B 78 75.296 3.371 3.860 1.00 0.00 H new ATOM 0 HG SER B 78 73.798 2.625 5.485 1.00 0.00 H new ATOM 2694 N MET B 79 75.126 6.233 3.768 1.00 0.00 N ATOM 2695 CA MET B 79 75.324 7.489 4.556 1.00 0.00 C ATOM 2696 C MET B 79 74.464 8.602 3.958 1.00 0.00 C ATOM 2697 O MET B 79 73.789 9.325 4.663 1.00 0.00 O ATOM 2698 CB MET B 79 76.801 7.889 4.500 1.00 0.00 C ATOM 2699 CG MET B 79 77.057 9.059 5.451 1.00 0.00 C ATOM 2700 SD MET B 79 78.815 9.489 5.410 1.00 0.00 S ATOM 2701 CE MET B 79 78.737 10.895 6.547 1.00 0.00 C ATOM 0 H MET B 79 75.981 5.791 3.431 1.00 0.00 H new ATOM 0 HA MET B 79 75.031 7.326 5.593 1.00 0.00 H new ATOM 0 HB2 MET B 79 77.428 7.041 4.775 1.00 0.00 H new ATOM 0 HB3 MET B 79 77.073 8.169 3.482 1.00 0.00 H new ATOM 0 HG2 MET B 79 76.454 9.919 5.159 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.760 8.790 6.465 1.00 0.00 H new ATOM 0 HE1 MET B 79 79.733 11.320 6.669 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.066 11.653 6.143 1.00 0.00 H new ATOM 0 HE3 MET B 79 78.365 10.560 7.515 1.00 0.00 H new ATOM 2711 N VAL B 80 74.456 8.726 2.668 1.00 0.00 N ATOM 2712 CA VAL B 80 73.610 9.769 2.026 1.00 0.00 C ATOM 2713 C VAL B 80 72.149 9.461 2.355 1.00 0.00 C ATOM 2714 O VAL B 80 71.321 10.343 2.469 1.00 0.00 O ATOM 2715 CB VAL B 80 73.833 9.739 0.510 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.947 10.790 -0.169 1.00 0.00 C ATOM 2717 CG2 VAL B 80 75.307 10.041 0.204 1.00 0.00 C ATOM 0 H VAL B 80 74.999 8.150 2.024 1.00 0.00 H new ATOM 0 HA VAL B 80 73.870 10.761 2.395 1.00 0.00 H new ATOM 0 HB VAL B 80 73.574 8.751 0.130 1.00 0.00 H new ATOM 0 HG11 VAL B 80 73.111 10.763 -1.246 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.900 10.576 0.044 1.00 0.00 H new ATOM 0 HG13 VAL B 80 73.200 11.780 0.212 1.00 0.00 H new ATOM 0 HG21 VAL B 80 75.467 10.020 -0.874 1.00 0.00 H new ATOM 0 HG22 VAL B 80 75.564 11.028 0.590 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.938 9.290 0.679 1.00 0.00 H new ATOM 2727 N THR B 81 71.843 8.206 2.537 1.00 0.00 N ATOM 2728 CA THR B 81 70.451 7.812 2.898 1.00 0.00 C ATOM 2729 C THR B 81 70.256 7.994 4.410 1.00 0.00 C ATOM 2730 O THR B 81 69.302 8.592 4.862 1.00 0.00 O ATOM 2731 CB THR B 81 70.224 6.346 2.528 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.524 6.153 1.152 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.764 5.971 2.793 1.00 0.00 C ATOM 0 H THR B 81 72.501 7.432 2.451 1.00 0.00 H new ATOM 0 HA THR B 81 69.739 8.435 2.356 1.00 0.00 H new ATOM 0 HB THR B 81 70.874 5.714 3.133 1.00 0.00 H new ATOM 0 HG1 THR B 81 71.496 6.116 1.031 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.603 4.926 2.529 1.00 0.00 H new ATOM 0 HG22 THR B 81 68.537 6.118 3.849 1.00 0.00 H new ATOM 0 HG23 THR B 81 68.111 6.602 2.190 1.00 0.00 H new ATOM 2741 N THR B 82 71.167 7.468 5.185 1.00 0.00 N ATOM 2742 CA THR B 82 71.082 7.578 6.672 1.00 0.00 C ATOM 2743 C THR B 82 71.384 9.017 7.104 1.00 0.00 C ATOM 2744 O THR B 82 71.063 9.426 8.202 1.00 0.00 O ATOM 2745 CB THR B 82 72.111 6.623 7.294 1.00 0.00 C ATOM 2746 OG1 THR B 82 72.076 5.387 6.596 1.00 0.00 O ATOM 2747 CG2 THR B 82 71.809 6.376 8.778 1.00 0.00 C ATOM 0 H THR B 82 71.982 6.957 4.844 1.00 0.00 H new ATOM 0 HA THR B 82 70.079 7.314 7.007 1.00 0.00 H new ATOM 0 HB THR B 82 73.099 7.077 7.216 1.00 0.00 H new ATOM 0 HG1 THR B 82 72.894 5.288 6.065 1.00 0.00 H new ATOM 0 HG21 THR B 82 72.553 5.696 9.193 1.00 0.00 H new ATOM 0 HG22 THR B 82 71.841 7.322 9.318 1.00 0.00 H new ATOM 0 HG23 THR B 82 70.818 5.934 8.879 1.00 0.00 H new ATOM 2755 N ALA B 83 71.998 9.786 6.249 1.00 0.00 N ATOM 2756 CA ALA B 83 72.313 11.198 6.607 1.00 0.00 C ATOM 2757 C ALA B 83 71.015 12.010 6.668 1.00 0.00 C ATOM 2758 O ALA B 83 70.828 12.842 7.532 1.00 0.00 O ATOM 2759 CB ALA B 83 73.247 11.797 5.555 1.00 0.00 C ATOM 0 H ALA B 83 72.296 9.498 5.317 1.00 0.00 H new ATOM 0 HA ALA B 83 72.803 11.226 7.580 1.00 0.00 H new ATOM 0 HB1 ALA B 83 73.477 12.830 5.818 1.00 0.00 H new ATOM 0 HB2 ALA B 83 74.170 11.219 5.516 1.00 0.00 H new ATOM 0 HB3 ALA B 83 72.761 11.770 4.580 1.00 0.00 H new ATOM 2765 N CYS B 84 70.113 11.768 5.754 1.00 0.00 N ATOM 2766 CA CYS B 84 68.822 12.523 5.754 1.00 0.00 C ATOM 2767 C CYS B 84 67.812 11.821 6.662 1.00 0.00 C ATOM 2768 O CYS B 84 67.604 10.627 6.568 1.00 0.00 O ATOM 2769 CB CYS B 84 68.258 12.580 4.336 1.00 0.00 C ATOM 2770 SG CYS B 84 66.701 13.509 4.345 1.00 0.00 S ATOM 0 H CYS B 84 70.213 11.081 5.007 1.00 0.00 H new ATOM 0 HA CYS B 84 69.004 13.534 6.119 1.00 0.00 H new ATOM 0 HB2 CYS B 84 68.975 13.056 3.667 1.00 0.00 H new ATOM 0 HB3 CYS B 84 68.090 11.571 3.958 1.00 0.00 H new ATOM 0 HG CYS B 84 66.220 13.561 3.138 1.00 0.00 H new