USER MOD reduce.3.24.130724 H: found=0, std=0, add=1254, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1254 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 43 ASN : amide:sc= 0.139 X(o=-0.098,f=-0.074!) USER MOD Set 1.2: B 71 HIS : no HD1:sc= -0.237 K(o=-0.098,f=-3.3) USER MOD Set 2.1: B 62 LYS NZ :NH3+ -109:sc= 0.0283 (180deg=0) USER MOD Set 2.2: B 66 GLN : amide:sc= -1.36! K(o=-1.3!,f=-0.087) USER MOD Set 3.1: B 43 ASN : amide:sc= -0.148 X(o=-0.11,f=0.19) USER MOD Set 3.2: B 47 GLN : amide:sc= 0.0427 X(o=-0.11,f=-0.46) USER MOD Set 4.1: A 67 SER OG : rot 137:sc= 0.875 USER MOD Set 4.2: B 42 THR OG1 : rot 72:sc= 1.55 USER MOD Set 5.1: A 61 THR OG1 : rot 4:sc= 1.86 USER MOD Set 5.2: B 65 LYS NZ :NH3+ -127:sc= 1.19 (180deg=-0.0163) USER MOD Set 6.1: A 29 THR OG1 : rot -140:sc= 0.104 USER MOD Set 6.2: B 7 TYR OH : rot -5:sc= 0.885 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= -0.183 USER MOD Single : A 6 LYS NZ :NH3+ 149:sc= 0.146 (180deg=-0.235) USER MOD Single : A 7 TYR OH : rot 166:sc= 0.479 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 GLN : amide:sc= -0.717 K(o=-0.72,f=-0.0075) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 151:sc= -0.115 (180deg=-2.16) USER MOD Single : A 36 CYS SG : rot 80:sc= 1.23 USER MOD Single : A 39 ASN : amide:sc= -0.0301 X(o=-0.03,f=-0.03) USER MOD Single : A 42 THR OG1 : rot -100:sc= -0.502 USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -0.0514 K(o=-0.051,f=-1.2!) USER MOD Single : A 62 LYS NZ :NH3+ -166:sc= -0.0159 (180deg=-0.197) USER MOD Single : A 65 LYS NZ :NH3+ -107:sc= 1.19 (180deg=0.609) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 74 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 HIS : no HD1:sc= -0.0315 X(o=-0.032,f=0) USER MOD Single : A 76 HIS : no HD1:sc= -0.673 K(o=-0.67,f=-0.0013) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -120:sc= -0.328 (180deg=-1.41) USER MOD Single : B 5 SER OG : rot 180:sc= -0.113 USER MOD Single : B 6 LYS NZ :NH3+ -140:sc= -0.293 (180deg=-1.99!) USER MOD Single : B 8 SER OG : rot 180:sc= 0 USER MOD Single : B 9 ASN : amide:sc= -0.0224 K(o=-0.022,f=-1.7!) USER MOD Single : B 14 LYS NZ :NH3+ 163:sc= -0.0293 (180deg=-0.247) USER MOD Single : B 17 GLN : amide:sc= -0.464 K(o=-0.46,f=-1.4) USER MOD Single : B 25 LYS NZ :NH3+ 163:sc= 1.16 (180deg=0.925) USER MOD Single : B 29 THR OG1 : rot 180:sc= -0.758 USER MOD Single : B 35 MET CE :methyl 162:sc= -0.125 (180deg=-0.613) USER MOD Single : B 36 CYS SG : rot 77:sc= 1.2 USER MOD Single : B 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ -161:sc= -0.0598 (180deg=-0.642) USER MOD Single : B 59 ASN : amide:sc= -0.0293 K(o=-0.029,f=-1.1) USER MOD Single : B 61 THR OG1 : rot -80:sc= 0.957 USER MOD Single : B 67 SER OG : rot 78:sc= 1.28 USER MOD Single : B 72 HIS : no HD1:sc= -0.0422 K(o=-0.042,f=-4.6!) USER MOD Single : B 73 HIS : no HD1:sc= -0.0149 X(o=-0.015,f=0) USER MOD Single : B 74 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Single : B 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 76 HIS : no HE2:sc= 1.13 K(o=1.1,f=-4.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -17.625 -11.337 -17.672 1.00 0.00 N ATOM 2 CA MET A 1 -17.403 -11.563 -16.225 1.00 0.00 C ATOM 3 C MET A 1 -17.089 -13.027 -15.953 1.00 0.00 C ATOM 4 O MET A 1 -17.809 -13.917 -16.408 1.00 0.00 O ATOM 5 CB MET A 1 -18.636 -11.148 -15.418 1.00 0.00 C ATOM 6 CG MET A 1 -18.806 -9.646 -15.278 1.00 0.00 C ATOM 7 SD MET A 1 -17.431 -8.874 -14.404 1.00 0.00 S ATOM 8 CE MET A 1 -18.043 -7.199 -14.219 1.00 0.00 C ATOM 0 H1 MET A 1 -17.838 -10.333 -17.838 1.00 0.00 H new ATOM 0 H2 MET A 1 -16.769 -11.601 -18.200 1.00 0.00 H new ATOM 0 H3 MET A 1 -18.424 -11.918 -17.996 1.00 0.00 H new ATOM 0 HA MET A 1 -16.554 -10.953 -15.918 1.00 0.00 H new ATOM 0 HB2 MET A 1 -19.525 -11.561 -15.894 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.572 -11.590 -14.424 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.899 -9.200 -16.268 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.734 -9.437 -14.746 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.301 -6.596 -13.695 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.230 -6.769 -15.203 1.00 0.00 H new ATOM 0 HE3 MET A 1 -18.971 -7.212 -13.647 1.00 0.00 H new ATOM 20 N PRO A 2 -16.001 -13.300 -15.221 1.00 0.00 N ATOM 21 CA PRO A 2 -15.647 -14.654 -14.813 1.00 0.00 C ATOM 22 C PRO A 2 -16.374 -15.056 -13.531 1.00 0.00 C ATOM 23 O PRO A 2 -17.302 -14.370 -13.101 1.00 0.00 O ATOM 24 CB PRO A 2 -14.142 -14.550 -14.578 1.00 0.00 C ATOM 25 CG PRO A 2 -13.923 -13.146 -14.120 1.00 0.00 C ATOM 26 CD PRO A 2 -15.024 -12.308 -14.730 1.00 0.00 C ATOM 0 HA PRO A 2 -15.922 -15.410 -15.548 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -13.808 -15.267 -13.828 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -13.584 -14.760 -15.490 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -13.950 -13.086 -13.032 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -12.944 -12.785 -14.435 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -15.470 -11.639 -13.994 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -14.648 -11.684 -15.541 1.00 0.00 H new ATOM 34 N ILE A 3 -15.965 -16.168 -12.932 1.00 0.00 N ATOM 35 CA ILE A 3 -16.538 -16.594 -11.663 1.00 0.00 C ATOM 36 C ILE A 3 -16.144 -15.617 -10.559 1.00 0.00 C ATOM 37 O ILE A 3 -15.007 -15.624 -10.077 1.00 0.00 O ATOM 38 CB ILE A 3 -16.090 -18.022 -11.279 1.00 0.00 C ATOM 39 CG1 ILE A 3 -16.525 -19.027 -12.349 1.00 0.00 C ATOM 40 CG2 ILE A 3 -16.650 -18.420 -9.919 1.00 0.00 C ATOM 41 CD1 ILE A 3 -18.023 -19.089 -12.561 1.00 0.00 C ATOM 0 H ILE A 3 -15.244 -16.787 -13.302 1.00 0.00 H new ATOM 0 HA ILE A 3 -17.622 -16.604 -11.779 1.00 0.00 H new ATOM 0 HB ILE A 3 -15.002 -18.030 -11.216 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -16.045 -18.768 -13.293 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -16.166 -20.018 -12.070 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -16.321 -19.429 -9.671 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -16.291 -17.725 -9.160 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -17.739 -18.392 -9.952 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -18.251 -19.823 -13.334 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -18.511 -19.379 -11.630 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -18.387 -18.110 -12.872 1.00 0.00 H new ATOM 53 N VAL A 4 -17.082 -14.751 -10.198 1.00 0.00 N ATOM 54 CA VAL A 4 -16.850 -13.749 -9.172 1.00 0.00 C ATOM 55 C VAL A 4 -16.896 -14.375 -7.786 1.00 0.00 C ATOM 56 O VAL A 4 -17.965 -14.671 -7.256 1.00 0.00 O ATOM 57 CB VAL A 4 -17.881 -12.601 -9.249 1.00 0.00 C ATOM 58 CG1 VAL A 4 -17.566 -11.519 -8.224 1.00 0.00 C ATOM 59 CG2 VAL A 4 -17.924 -12.012 -10.652 1.00 0.00 C ATOM 0 H VAL A 4 -18.017 -14.725 -10.606 1.00 0.00 H new ATOM 0 HA VAL A 4 -15.858 -13.335 -9.351 1.00 0.00 H new ATOM 0 HB VAL A 4 -18.864 -13.012 -9.018 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -18.306 -10.722 -8.298 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -17.593 -11.948 -7.222 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -16.573 -11.112 -8.418 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -18.656 -11.205 -10.686 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -16.941 -11.621 -10.913 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -18.206 -12.788 -11.364 1.00 0.00 H new ATOM 69 N SER A 5 -15.726 -14.607 -7.224 1.00 0.00 N ATOM 70 CA SER A 5 -15.610 -15.140 -5.877 1.00 0.00 C ATOM 71 C SER A 5 -14.623 -14.299 -5.082 1.00 0.00 C ATOM 72 O SER A 5 -13.925 -14.797 -4.196 1.00 0.00 O ATOM 73 CB SER A 5 -15.139 -16.594 -5.934 1.00 0.00 C ATOM 74 OG SER A 5 -15.973 -17.363 -6.779 1.00 0.00 O ATOM 0 H SER A 5 -14.832 -14.433 -7.684 1.00 0.00 H new ATOM 0 HA SER A 5 -16.583 -15.106 -5.387 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.112 -16.634 -6.297 1.00 0.00 H new ATOM 0 HB3 SER A 5 -15.139 -17.020 -4.931 1.00 0.00 H new ATOM 0 HG SER A 5 -15.652 -18.289 -6.801 1.00 0.00 H new ATOM 80 N LYS A 6 -14.585 -13.012 -5.390 1.00 0.00 N ATOM 81 CA LYS A 6 -13.588 -12.132 -4.811 1.00 0.00 C ATOM 82 C LYS A 6 -14.089 -11.507 -3.507 1.00 0.00 C ATOM 83 O LYS A 6 -14.404 -10.317 -3.455 1.00 0.00 O ATOM 84 CB LYS A 6 -13.181 -11.041 -5.807 1.00 0.00 C ATOM 85 CG LYS A 6 -11.771 -10.524 -5.576 1.00 0.00 C ATOM 86 CD LYS A 6 -11.429 -9.355 -6.484 1.00 0.00 C ATOM 87 CE LYS A 6 -9.961 -8.980 -6.355 1.00 0.00 C ATOM 88 NZ LYS A 6 -9.069 -9.996 -6.979 1.00 0.00 N ATOM 0 H LYS A 6 -15.231 -12.557 -6.035 1.00 0.00 H new ATOM 0 HA LYS A 6 -12.709 -12.734 -4.580 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -13.256 -11.435 -6.820 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -13.883 -10.210 -5.735 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -11.665 -10.216 -4.536 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -11.058 -11.332 -5.743 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.653 -9.615 -7.519 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -12.051 -8.497 -6.229 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.792 -8.011 -6.825 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -9.706 -8.872 -5.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -8.214 -9.530 -7.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -8.799 -10.705 -6.268 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -9.570 -10.464 -7.761 1.00 0.00 H new ATOM 102 N TYR A 7 -14.174 -12.348 -2.472 1.00 0.00 N ATOM 103 CA TYR A 7 -14.447 -11.918 -1.092 1.00 0.00 C ATOM 104 C TYR A 7 -15.803 -11.224 -0.955 1.00 0.00 C ATOM 105 O TYR A 7 -16.613 -11.215 -1.883 1.00 0.00 O ATOM 106 CB TYR A 7 -13.328 -10.989 -0.594 1.00 0.00 C ATOM 107 CG TYR A 7 -11.963 -11.370 -1.121 1.00 0.00 C ATOM 108 CD1 TYR A 7 -11.299 -12.502 -0.662 1.00 0.00 C ATOM 109 CD2 TYR A 7 -11.354 -10.608 -2.107 1.00 0.00 C ATOM 110 CE1 TYR A 7 -10.069 -12.862 -1.182 1.00 0.00 C ATOM 111 CE2 TYR A 7 -10.127 -10.958 -2.624 1.00 0.00 C ATOM 112 CZ TYR A 7 -9.489 -12.081 -2.162 1.00 0.00 C ATOM 113 OH TYR A 7 -8.274 -12.436 -2.702 1.00 0.00 O ATOM 0 H TYR A 7 -14.055 -13.357 -2.567 1.00 0.00 H new ATOM 0 HA TYR A 7 -14.479 -12.817 -0.476 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -13.554 -9.965 -0.893 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -13.308 -11.006 0.496 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -11.749 -13.108 0.110 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -11.852 -9.723 -2.476 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -9.566 -13.748 -0.824 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -9.669 -10.351 -3.390 1.00 0.00 H new ATOM 0 HH TYR A 7 -8.116 -11.919 -3.519 1.00 0.00 H new ATOM 123 N SER A 8 -16.054 -10.675 0.225 1.00 0.00 N ATOM 124 CA SER A 8 -17.272 -9.927 0.476 1.00 0.00 C ATOM 125 C SER A 8 -16.974 -8.434 0.436 1.00 0.00 C ATOM 126 O SER A 8 -16.025 -7.969 1.074 1.00 0.00 O ATOM 127 CB SER A 8 -17.858 -10.315 1.835 1.00 0.00 C ATOM 128 OG SER A 8 -19.145 -9.750 2.022 1.00 0.00 O ATOM 0 H SER A 8 -15.425 -10.736 1.026 1.00 0.00 H new ATOM 0 HA SER A 8 -18.003 -10.164 -0.297 1.00 0.00 H new ATOM 0 HB2 SER A 8 -17.921 -11.401 1.910 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.192 -9.979 2.630 1.00 0.00 H new ATOM 0 HG SER A 8 -19.495 -10.016 2.898 1.00 0.00 H new ATOM 134 N ASN A 9 -17.787 -7.686 -0.308 1.00 0.00 N ATOM 135 CA ASN A 9 -17.582 -6.247 -0.466 1.00 0.00 C ATOM 136 C ASN A 9 -17.595 -5.543 0.884 1.00 0.00 C ATOM 137 O ASN A 9 -16.783 -4.653 1.128 1.00 0.00 O ATOM 138 CB ASN A 9 -18.645 -5.629 -1.386 1.00 0.00 C ATOM 139 CG ASN A 9 -18.491 -6.055 -2.836 1.00 0.00 C ATOM 140 OD1 ASN A 9 -17.734 -5.451 -3.599 1.00 0.00 O ATOM 141 ND2 ASN A 9 -19.229 -7.081 -3.231 1.00 0.00 N ATOM 0 H ASN A 9 -18.595 -8.053 -0.811 1.00 0.00 H new ATOM 0 HA ASN A 9 -16.604 -6.108 -0.926 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -19.635 -5.915 -1.032 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -18.585 -4.542 -1.323 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -19.184 -7.399 -4.199 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -19.843 -7.553 -2.567 1.00 0.00 H new ATOM 148 N GLU A 10 -18.506 -5.964 1.762 1.00 0.00 N ATOM 149 CA GLU A 10 -18.610 -5.388 3.101 1.00 0.00 C ATOM 150 C GLU A 10 -17.284 -5.498 3.844 1.00 0.00 C ATOM 151 O GLU A 10 -16.845 -4.552 4.502 1.00 0.00 O ATOM 152 CB GLU A 10 -19.713 -6.087 3.905 1.00 0.00 C ATOM 153 CG GLU A 10 -19.849 -5.569 5.331 1.00 0.00 C ATOM 154 CD GLU A 10 -20.955 -6.253 6.105 1.00 0.00 C ATOM 155 OE1 GLU A 10 -20.708 -7.335 6.677 1.00 0.00 O ATOM 156 OE2 GLU A 10 -22.076 -5.705 6.157 1.00 0.00 O ATOM 0 H GLU A 10 -19.183 -6.702 1.569 1.00 0.00 H new ATOM 0 HA GLU A 10 -18.864 -4.334 2.992 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -20.664 -5.959 3.388 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -19.507 -7.157 3.934 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -18.904 -5.712 5.855 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -20.041 -4.496 5.305 1.00 0.00 H new ATOM 163 N ARG A 11 -16.636 -6.647 3.721 1.00 0.00 N ATOM 164 CA ARG A 11 -15.391 -6.881 4.427 1.00 0.00 C ATOM 165 C ARG A 11 -14.258 -6.086 3.789 1.00 0.00 C ATOM 166 O ARG A 11 -13.387 -5.567 4.484 1.00 0.00 O ATOM 167 CB ARG A 11 -15.051 -8.369 4.450 1.00 0.00 C ATOM 168 CG ARG A 11 -13.883 -8.693 5.360 1.00 0.00 C ATOM 169 CD ARG A 11 -13.646 -10.184 5.465 1.00 0.00 C ATOM 170 NE ARG A 11 -12.644 -10.492 6.480 1.00 0.00 N ATOM 171 CZ ARG A 11 -11.753 -11.469 6.380 1.00 0.00 C ATOM 172 NH1 ARG A 11 -11.741 -12.264 5.314 1.00 0.00 N ATOM 173 NH2 ARG A 11 -10.883 -11.655 7.358 1.00 0.00 N ATOM 0 H ARG A 11 -16.951 -7.426 3.142 1.00 0.00 H new ATOM 0 HA ARG A 11 -15.515 -6.544 5.456 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -15.926 -8.931 4.776 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -14.819 -8.699 3.438 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.983 -8.208 4.982 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.072 -8.285 6.353 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.582 -10.687 5.710 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.320 -10.571 4.500 1.00 0.00 H new ATOM 0 HE ARG A 11 -12.628 -9.917 7.323 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -12.420 -12.124 4.566 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -11.052 -13.013 5.244 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -10.902 -11.050 8.179 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -10.193 -12.404 7.292 1.00 0.00 H new ATOM 187 N VAL A 12 -14.284 -5.980 2.465 1.00 0.00 N ATOM 188 CA VAL A 12 -13.283 -5.205 1.741 1.00 0.00 C ATOM 189 C VAL A 12 -13.313 -3.746 2.191 1.00 0.00 C ATOM 190 O VAL A 12 -12.272 -3.152 2.477 1.00 0.00 O ATOM 191 CB VAL A 12 -13.500 -5.279 0.212 1.00 0.00 C ATOM 192 CG1 VAL A 12 -12.471 -4.430 -0.523 1.00 0.00 C ATOM 193 CG2 VAL A 12 -13.439 -6.723 -0.265 1.00 0.00 C ATOM 0 H VAL A 12 -14.987 -6.421 1.872 1.00 0.00 H new ATOM 0 HA VAL A 12 -12.309 -5.638 1.969 1.00 0.00 H new ATOM 0 HB VAL A 12 -14.490 -4.882 -0.011 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -12.644 -4.498 -1.597 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -12.563 -3.391 -0.206 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -11.469 -4.792 -0.293 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -13.594 -6.757 -1.343 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -12.463 -7.145 -0.025 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -14.217 -7.303 0.231 1.00 0.00 H new ATOM 203 N GLU A 13 -14.514 -3.184 2.282 1.00 0.00 N ATOM 204 CA GLU A 13 -14.684 -1.808 2.734 1.00 0.00 C ATOM 205 C GLU A 13 -14.151 -1.644 4.151 1.00 0.00 C ATOM 206 O GLU A 13 -13.554 -0.622 4.486 1.00 0.00 O ATOM 207 CB GLU A 13 -16.158 -1.398 2.687 1.00 0.00 C ATOM 208 CG GLU A 13 -16.792 -1.534 1.316 1.00 0.00 C ATOM 209 CD GLU A 13 -18.244 -1.105 1.305 1.00 0.00 C ATOM 210 OE1 GLU A 13 -18.988 -1.477 2.238 1.00 0.00 O ATOM 211 OE2 GLU A 13 -18.653 -0.404 0.355 1.00 0.00 O ATOM 0 H GLU A 13 -15.385 -3.661 2.048 1.00 0.00 H new ATOM 0 HA GLU A 13 -14.119 -1.161 2.063 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -16.717 -2.008 3.397 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -16.247 -0.363 3.016 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -16.233 -0.932 0.599 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -16.720 -2.571 0.987 1.00 0.00 H new ATOM 218 N LYS A 14 -14.358 -2.668 4.971 1.00 0.00 N ATOM 219 CA LYS A 14 -13.899 -2.655 6.351 1.00 0.00 C ATOM 220 C LYS A 14 -12.389 -2.652 6.442 1.00 0.00 C ATOM 221 O LYS A 14 -11.825 -1.896 7.216 1.00 0.00 O ATOM 222 CB LYS A 14 -14.451 -3.848 7.119 1.00 0.00 C ATOM 223 CG LYS A 14 -15.818 -3.593 7.704 1.00 0.00 C ATOM 224 CD LYS A 14 -16.352 -4.826 8.401 1.00 0.00 C ATOM 225 CE LYS A 14 -17.731 -4.581 8.977 1.00 0.00 C ATOM 226 NZ LYS A 14 -18.291 -5.807 9.592 1.00 0.00 N ATOM 0 H LYS A 14 -14.844 -3.522 4.699 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.272 -1.734 6.799 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.502 -4.709 6.453 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -13.761 -4.107 7.922 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -15.765 -2.766 8.412 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -16.505 -3.293 6.913 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.393 -5.656 7.695 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -15.670 -5.119 9.199 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -17.678 -3.790 9.725 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.398 -4.231 8.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -19.236 -5.602 9.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.364 -6.554 8.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -17.667 -6.126 10.360 1.00 0.00 H new ATOM 240 N ILE A 15 -11.738 -3.495 5.656 1.00 0.00 N ATOM 241 CA ILE A 15 -10.284 -3.571 5.683 1.00 0.00 C ATOM 242 C ILE A 15 -9.679 -2.230 5.286 1.00 0.00 C ATOM 243 O ILE A 15 -8.773 -1.725 5.947 1.00 0.00 O ATOM 244 CB ILE A 15 -9.753 -4.687 4.760 1.00 0.00 C ATOM 245 CG1 ILE A 15 -10.363 -6.034 5.166 1.00 0.00 C ATOM 246 CG2 ILE A 15 -8.231 -4.746 4.826 1.00 0.00 C ATOM 247 CD1 ILE A 15 -10.004 -7.175 4.241 1.00 0.00 C ATOM 0 H ILE A 15 -12.187 -4.131 4.997 1.00 0.00 H new ATOM 0 HA ILE A 15 -9.985 -3.814 6.703 1.00 0.00 H new ATOM 0 HB ILE A 15 -10.043 -4.468 3.733 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -10.034 -6.281 6.175 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -11.448 -5.935 5.200 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.869 -5.538 4.170 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.816 -3.791 4.505 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -7.919 -4.952 5.850 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -10.473 -8.093 4.596 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -10.358 -6.952 3.234 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -8.922 -7.304 4.225 1.00 0.00 H new ATOM 259 N ILE A 16 -10.209 -1.643 4.218 1.00 0.00 N ATOM 260 CA ILE A 16 -9.762 -0.335 3.760 1.00 0.00 C ATOM 261 C ILE A 16 -10.017 0.727 4.830 1.00 0.00 C ATOM 262 O ILE A 16 -9.138 1.529 5.145 1.00 0.00 O ATOM 263 CB ILE A 16 -10.472 0.076 2.450 1.00 0.00 C ATOM 264 CG1 ILE A 16 -10.234 -0.975 1.363 1.00 0.00 C ATOM 265 CG2 ILE A 16 -9.983 1.442 1.984 1.00 0.00 C ATOM 266 CD1 ILE A 16 -10.974 -0.695 0.072 1.00 0.00 C ATOM 0 H ILE A 16 -10.951 -2.055 3.653 1.00 0.00 H new ATOM 0 HA ILE A 16 -8.691 -0.406 3.569 1.00 0.00 H new ATOM 0 HB ILE A 16 -11.543 0.140 2.643 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -9.166 -1.033 1.154 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -10.538 -1.951 1.741 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -10.493 1.716 1.061 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -10.197 2.186 2.751 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -8.908 1.403 1.807 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.756 -1.482 -0.650 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -12.046 -0.667 0.266 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -10.653 0.266 -0.331 1.00 0.00 H new ATOM 278 N GLN A 17 -11.220 0.714 5.396 1.00 0.00 N ATOM 279 CA GLN A 17 -11.597 1.677 6.426 1.00 0.00 C ATOM 280 C GLN A 17 -10.717 1.525 7.664 1.00 0.00 C ATOM 281 O GLN A 17 -10.204 2.508 8.181 1.00 0.00 O ATOM 282 CB GLN A 17 -13.074 1.513 6.801 1.00 0.00 C ATOM 283 CG GLN A 17 -13.531 2.411 7.944 1.00 0.00 C ATOM 284 CD GLN A 17 -13.330 3.893 7.667 1.00 0.00 C ATOM 285 OE1 GLN A 17 -13.088 4.675 8.584 1.00 0.00 O ATOM 286 NE2 GLN A 17 -13.450 4.295 6.412 1.00 0.00 N ATOM 0 H GLN A 17 -11.953 0.045 5.158 1.00 0.00 H new ATOM 0 HA GLN A 17 -11.448 2.678 6.022 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.686 1.721 5.923 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.254 0.474 7.076 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -14.587 2.226 8.141 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -12.986 2.141 8.848 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -13.651 3.618 5.677 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -13.341 5.282 6.180 1.00 0.00 H new ATOM 295 N ASP A 18 -10.561 0.294 8.129 1.00 0.00 N ATOM 296 CA ASP A 18 -9.732 -0.006 9.297 1.00 0.00 C ATOM 297 C ASP A 18 -8.300 0.504 9.102 1.00 0.00 C ATOM 298 O ASP A 18 -7.723 1.124 10.000 1.00 0.00 O ATOM 299 CB ASP A 18 -9.729 -1.517 9.553 1.00 0.00 C ATOM 300 CG ASP A 18 -9.434 -1.876 10.994 1.00 0.00 C ATOM 301 OD1 ASP A 18 -10.206 -1.451 11.882 1.00 0.00 O ATOM 302 OD2 ASP A 18 -8.465 -2.621 11.244 1.00 0.00 O ATOM 0 H ASP A 18 -11.002 -0.526 7.712 1.00 0.00 H new ATOM 0 HA ASP A 18 -10.154 0.505 10.162 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -10.699 -1.928 9.274 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -8.986 -1.987 8.909 1.00 0.00 H new ATOM 307 N LEU A 19 -7.745 0.264 7.914 1.00 0.00 N ATOM 308 CA LEU A 19 -6.403 0.743 7.582 1.00 0.00 C ATOM 309 C LEU A 19 -6.349 2.269 7.600 1.00 0.00 C ATOM 310 O LEU A 19 -5.430 2.866 8.170 1.00 0.00 O ATOM 311 CB LEU A 19 -5.977 0.231 6.204 1.00 0.00 C ATOM 312 CG LEU A 19 -5.777 -1.283 6.096 1.00 0.00 C ATOM 313 CD1 LEU A 19 -5.514 -1.682 4.653 1.00 0.00 C ATOM 314 CD2 LEU A 19 -4.631 -1.733 6.990 1.00 0.00 C ATOM 0 H LEU A 19 -8.203 -0.258 7.167 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.716 0.359 8.336 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -6.729 0.533 5.475 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.046 0.724 5.925 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.689 -1.777 6.430 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -5.374 -2.761 4.594 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -6.363 -1.392 4.035 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.616 -1.179 4.294 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.502 -2.812 6.901 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.713 -1.232 6.684 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -4.856 -1.478 8.026 1.00 0.00 H new ATOM 326 N LEU A 20 -7.339 2.899 6.974 1.00 0.00 N ATOM 327 CA LEU A 20 -7.413 4.357 6.934 1.00 0.00 C ATOM 328 C LEU A 20 -7.598 4.925 8.337 1.00 0.00 C ATOM 329 O LEU A 20 -7.042 5.970 8.665 1.00 0.00 O ATOM 330 CB LEU A 20 -8.554 4.820 6.024 1.00 0.00 C ATOM 331 CG LEU A 20 -8.361 4.521 4.536 1.00 0.00 C ATOM 332 CD1 LEU A 20 -9.568 4.985 3.740 1.00 0.00 C ATOM 333 CD2 LEU A 20 -7.096 5.188 4.019 1.00 0.00 C ATOM 0 H LEU A 20 -8.100 2.424 6.488 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.473 4.730 6.527 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -9.478 4.347 6.357 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -8.684 5.895 6.149 1.00 0.00 H new ATOM 0 HG LEU A 20 -8.259 3.443 4.412 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -9.414 4.765 2.684 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -10.458 4.465 4.093 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -9.699 6.059 3.871 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -6.974 4.965 2.959 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -7.171 6.267 4.156 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -6.235 4.811 4.570 1.00 0.00 H new ATOM 345 N ASP A 21 -8.373 4.223 9.153 1.00 0.00 N ATOM 346 CA ASP A 21 -8.612 4.614 10.540 1.00 0.00 C ATOM 347 C ASP A 21 -7.293 4.787 11.273 1.00 0.00 C ATOM 348 O ASP A 21 -7.101 5.763 11.992 1.00 0.00 O ATOM 349 CB ASP A 21 -9.454 3.558 11.257 1.00 0.00 C ATOM 350 CG ASP A 21 -9.986 4.028 12.598 1.00 0.00 C ATOM 351 OD1 ASP A 21 -9.210 4.090 13.573 1.00 0.00 O ATOM 352 OD2 ASP A 21 -11.196 4.324 12.686 1.00 0.00 O ATOM 0 H ASP A 21 -8.854 3.368 8.875 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.152 5.561 10.538 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -10.292 3.276 10.619 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.852 2.662 11.406 1.00 0.00 H new ATOM 357 N VAL A 22 -6.385 3.835 11.073 1.00 0.00 N ATOM 358 CA VAL A 22 -5.057 3.898 11.678 1.00 0.00 C ATOM 359 C VAL A 22 -4.293 5.127 11.182 1.00 0.00 C ATOM 360 O VAL A 22 -3.704 5.869 11.972 1.00 0.00 O ATOM 361 CB VAL A 22 -4.233 2.628 11.369 1.00 0.00 C ATOM 362 CG1 VAL A 22 -2.846 2.711 12.000 1.00 0.00 C ATOM 363 CG2 VAL A 22 -4.968 1.385 11.851 1.00 0.00 C ATOM 0 H VAL A 22 -6.545 3.009 10.496 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.199 3.969 12.756 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.108 2.558 10.288 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.286 1.805 11.768 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -2.317 3.577 11.602 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.943 2.810 13.081 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -4.373 0.500 11.625 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -5.127 1.451 12.927 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.931 1.313 11.346 1.00 0.00 H new ATOM 373 N LEU A 23 -4.325 5.343 9.871 1.00 0.00 N ATOM 374 CA LEU A 23 -3.628 6.470 9.256 1.00 0.00 C ATOM 375 C LEU A 23 -4.180 7.799 9.764 1.00 0.00 C ATOM 376 O LEU A 23 -3.423 8.715 10.101 1.00 0.00 O ATOM 377 CB LEU A 23 -3.760 6.399 7.733 1.00 0.00 C ATOM 378 CG LEU A 23 -3.167 5.144 7.087 1.00 0.00 C ATOM 379 CD1 LEU A 23 -3.384 5.168 5.582 1.00 0.00 C ATOM 380 CD2 LEU A 23 -1.685 5.024 7.408 1.00 0.00 C ATOM 0 H LEU A 23 -4.828 4.750 9.211 1.00 0.00 H new ATOM 0 HA LEU A 23 -2.575 6.410 9.531 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.817 6.458 7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -3.276 7.275 7.301 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.678 4.273 7.497 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.956 4.269 5.138 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -4.452 5.205 5.369 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.899 6.047 5.158 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.283 4.126 6.940 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.158 5.899 7.027 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.551 4.961 8.488 1.00 0.00 H new ATOM 392 N VAL A 24 -5.501 7.894 9.821 1.00 0.00 N ATOM 393 CA VAL A 24 -6.167 9.098 10.306 1.00 0.00 C ATOM 394 C VAL A 24 -5.936 9.266 11.804 1.00 0.00 C ATOM 395 O VAL A 24 -5.750 10.380 12.291 1.00 0.00 O ATOM 396 CB VAL A 24 -7.687 9.071 10.010 1.00 0.00 C ATOM 397 CG1 VAL A 24 -8.372 10.319 10.549 1.00 0.00 C ATOM 398 CG2 VAL A 24 -7.938 8.936 8.514 1.00 0.00 C ATOM 0 H VAL A 24 -6.137 7.149 9.536 1.00 0.00 H new ATOM 0 HA VAL A 24 -5.735 9.946 9.775 1.00 0.00 H new ATOM 0 HB VAL A 24 -8.112 8.204 10.516 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.438 10.273 10.327 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -8.228 10.376 11.628 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -7.941 11.203 10.078 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -9.011 8.919 8.325 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -7.491 9.782 7.992 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -7.491 8.010 8.152 1.00 0.00 H new ATOM 408 N LYS A 25 -5.927 8.150 12.528 1.00 0.00 N ATOM 409 CA LYS A 25 -5.677 8.166 13.966 1.00 0.00 C ATOM 410 C LYS A 25 -4.334 8.829 14.275 1.00 0.00 C ATOM 411 O LYS A 25 -4.226 9.638 15.199 1.00 0.00 O ATOM 412 CB LYS A 25 -5.688 6.737 14.510 1.00 0.00 C ATOM 413 CG LYS A 25 -5.600 6.645 16.025 1.00 0.00 C ATOM 414 CD LYS A 25 -5.594 5.199 16.491 1.00 0.00 C ATOM 415 CE LYS A 25 -6.820 4.447 15.996 1.00 0.00 C ATOM 416 NZ LYS A 25 -6.794 3.019 16.401 1.00 0.00 N ATOM 0 H LYS A 25 -6.091 7.221 12.141 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.466 8.743 14.448 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -6.601 6.242 14.180 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -4.853 6.188 14.075 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -4.694 7.144 16.370 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.444 7.170 16.473 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -4.692 4.704 16.131 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.562 5.167 17.580 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.720 4.920 16.390 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.874 4.515 14.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.646 2.541 16.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.949 2.561 16.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -6.769 2.953 17.439 1.00 0.00 H new ATOM 430 N GLU A 26 -3.325 8.492 13.481 1.00 0.00 N ATOM 431 CA GLU A 26 -1.982 9.028 13.667 1.00 0.00 C ATOM 432 C GLU A 26 -1.830 10.405 13.031 1.00 0.00 C ATOM 433 O GLU A 26 -0.851 11.104 13.294 1.00 0.00 O ATOM 434 CB GLU A 26 -0.943 8.077 13.071 1.00 0.00 C ATOM 435 CG GLU A 26 -0.766 6.794 13.858 1.00 0.00 C ATOM 436 CD GLU A 26 -0.259 7.051 15.258 1.00 0.00 C ATOM 437 OE1 GLU A 26 0.957 7.284 15.423 1.00 0.00 O ATOM 438 OE2 GLU A 26 -1.073 7.024 16.202 1.00 0.00 O ATOM 0 H GLU A 26 -3.413 7.846 12.697 1.00 0.00 H new ATOM 0 HA GLU A 26 -1.819 9.127 14.740 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -1.234 7.829 12.050 1.00 0.00 H new ATOM 0 HB3 GLU A 26 0.016 8.592 13.013 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.718 6.266 13.909 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -0.068 6.141 13.334 1.00 0.00 H new ATOM 445 N GLU A 27 -2.809 10.792 12.211 1.00 0.00 N ATOM 446 CA GLU A 27 -2.731 12.033 11.442 1.00 0.00 C ATOM 447 C GLU A 27 -1.477 12.038 10.581 1.00 0.00 C ATOM 448 O GLU A 27 -0.732 13.020 10.543 1.00 0.00 O ATOM 449 CB GLU A 27 -2.752 13.251 12.368 1.00 0.00 C ATOM 450 CG GLU A 27 -4.152 13.684 12.763 1.00 0.00 C ATOM 451 CD GLU A 27 -4.963 14.145 11.569 1.00 0.00 C ATOM 452 OE1 GLU A 27 -4.555 15.124 10.912 1.00 0.00 O ATOM 453 OE2 GLU A 27 -6.015 13.538 11.283 1.00 0.00 O ATOM 0 H GLU A 27 -3.667 10.261 12.063 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.603 12.090 10.791 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -2.182 13.023 13.269 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -2.248 14.082 11.874 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -4.664 12.854 13.250 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -4.089 14.492 13.492 1.00 0.00 H new ATOM 460 N VAL A 28 -1.260 10.930 9.884 1.00 0.00 N ATOM 461 CA VAL A 28 -0.070 10.756 9.066 1.00 0.00 C ATOM 462 C VAL A 28 -0.013 11.775 7.933 1.00 0.00 C ATOM 463 O VAL A 28 -1.023 12.075 7.292 1.00 0.00 O ATOM 464 CB VAL A 28 0.018 9.331 8.470 1.00 0.00 C ATOM 465 CG1 VAL A 28 0.129 8.297 9.576 1.00 0.00 C ATOM 466 CG2 VAL A 28 -1.181 9.035 7.578 1.00 0.00 C ATOM 0 H VAL A 28 -1.898 10.134 9.870 1.00 0.00 H new ATOM 0 HA VAL A 28 0.780 10.912 9.730 1.00 0.00 H new ATOM 0 HB VAL A 28 0.916 9.278 7.855 1.00 0.00 H new ATOM 0 HG11 VAL A 28 0.190 7.301 9.138 1.00 0.00 H new ATOM 0 HG12 VAL A 28 1.025 8.490 10.165 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -0.748 8.357 10.220 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -1.093 8.027 7.173 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -2.098 9.112 8.163 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -1.212 9.754 6.759 1.00 0.00 H new ATOM 476 N THR A 29 1.170 12.323 7.723 1.00 0.00 N ATOM 477 CA THR A 29 1.425 13.207 6.603 1.00 0.00 C ATOM 478 C THR A 29 1.592 12.385 5.324 1.00 0.00 C ATOM 479 O THR A 29 1.936 11.207 5.396 1.00 0.00 O ATOM 480 CB THR A 29 2.696 14.031 6.875 1.00 0.00 C ATOM 481 OG1 THR A 29 3.355 13.509 8.037 1.00 0.00 O ATOM 482 CG2 THR A 29 2.362 15.501 7.092 1.00 0.00 C ATOM 0 H THR A 29 1.979 12.167 8.324 1.00 0.00 H new ATOM 0 HA THR A 29 0.582 13.886 6.477 1.00 0.00 H new ATOM 0 HB THR A 29 3.351 13.957 6.007 1.00 0.00 H new ATOM 0 HG1 THR A 29 3.700 14.250 8.578 1.00 0.00 H new ATOM 0 HG21 THR A 29 3.279 16.058 7.282 1.00 0.00 H new ATOM 0 HG22 THR A 29 1.874 15.898 6.202 1.00 0.00 H new ATOM 0 HG23 THR A 29 1.694 15.600 7.947 1.00 0.00 H new ATOM 490 N PRO A 30 1.332 12.981 4.147 1.00 0.00 N ATOM 491 CA PRO A 30 1.460 12.290 2.853 1.00 0.00 C ATOM 492 C PRO A 30 2.753 11.483 2.734 1.00 0.00 C ATOM 493 O PRO A 30 2.725 10.295 2.407 1.00 0.00 O ATOM 494 CB PRO A 30 1.451 13.440 1.850 1.00 0.00 C ATOM 495 CG PRO A 30 0.623 14.495 2.500 1.00 0.00 C ATOM 496 CD PRO A 30 0.875 14.374 3.980 1.00 0.00 C ATOM 0 HA PRO A 30 0.667 11.558 2.702 1.00 0.00 H new ATOM 0 HB2 PRO A 30 2.461 13.797 1.646 1.00 0.00 H new ATOM 0 HB3 PRO A 30 1.023 13.131 0.896 1.00 0.00 H new ATOM 0 HG2 PRO A 30 0.899 15.485 2.138 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -0.434 14.356 2.272 1.00 0.00 H new ATOM 0 HD2 PRO A 30 1.629 15.085 4.317 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -0.029 14.570 4.557 1.00 0.00 H new ATOM 504 N ASP A 31 3.878 12.130 3.023 1.00 0.00 N ATOM 505 CA ASP A 31 5.188 11.479 2.972 1.00 0.00 C ATOM 506 C ASP A 31 5.253 10.286 3.928 1.00 0.00 C ATOM 507 O ASP A 31 5.689 9.194 3.553 1.00 0.00 O ATOM 508 CB ASP A 31 6.284 12.490 3.319 1.00 0.00 C ATOM 509 CG ASP A 31 7.648 11.847 3.499 1.00 0.00 C ATOM 510 OD1 ASP A 31 8.391 11.716 2.505 1.00 0.00 O ATOM 511 OD2 ASP A 31 7.991 11.484 4.644 1.00 0.00 O ATOM 0 H ASP A 31 3.911 13.112 3.297 1.00 0.00 H new ATOM 0 HA ASP A 31 5.344 11.107 1.959 1.00 0.00 H new ATOM 0 HB2 ASP A 31 6.343 13.239 2.530 1.00 0.00 H new ATOM 0 HB3 ASP A 31 6.011 13.013 4.235 1.00 0.00 H new ATOM 516 N LEU A 32 4.800 10.504 5.157 1.00 0.00 N ATOM 517 CA LEU A 32 4.807 9.467 6.180 1.00 0.00 C ATOM 518 C LEU A 32 3.919 8.295 5.770 1.00 0.00 C ATOM 519 O LEU A 32 4.303 7.132 5.917 1.00 0.00 O ATOM 520 CB LEU A 32 4.332 10.043 7.519 1.00 0.00 C ATOM 521 CG LEU A 32 4.298 9.055 8.688 1.00 0.00 C ATOM 522 CD1 LEU A 32 5.686 8.501 8.968 1.00 0.00 C ATOM 523 CD2 LEU A 32 3.737 9.728 9.931 1.00 0.00 C ATOM 0 H LEU A 32 4.420 11.397 5.470 1.00 0.00 H new ATOM 0 HA LEU A 32 5.828 9.103 6.291 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.983 10.875 7.788 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.331 10.453 7.383 1.00 0.00 H new ATOM 0 HG LEU A 32 3.648 8.224 8.415 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.637 7.801 9.802 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.057 7.985 8.083 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.360 9.319 9.220 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.719 9.014 10.754 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.366 10.577 10.201 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.724 10.077 9.730 1.00 0.00 H new ATOM 535 N ALA A 33 2.745 8.616 5.240 1.00 0.00 N ATOM 536 CA ALA A 33 1.786 7.606 4.815 1.00 0.00 C ATOM 537 C ALA A 33 2.365 6.716 3.724 1.00 0.00 C ATOM 538 O ALA A 33 2.339 5.492 3.838 1.00 0.00 O ATOM 539 CB ALA A 33 0.504 8.264 4.330 1.00 0.00 C ATOM 0 H ALA A 33 2.433 9.576 5.094 1.00 0.00 H new ATOM 0 HA ALA A 33 1.559 6.978 5.677 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -0.203 7.496 4.016 1.00 0.00 H new ATOM 0 HB2 ALA A 33 0.067 8.850 5.139 1.00 0.00 H new ATOM 0 HB3 ALA A 33 0.727 8.918 3.487 1.00 0.00 H new ATOM 545 N LEU A 34 2.906 7.337 2.680 1.00 0.00 N ATOM 546 CA LEU A 34 3.460 6.597 1.548 1.00 0.00 C ATOM 547 C LEU A 34 4.583 5.668 2.002 1.00 0.00 C ATOM 548 O LEU A 34 4.645 4.508 1.596 1.00 0.00 O ATOM 549 CB LEU A 34 3.982 7.562 0.478 1.00 0.00 C ATOM 550 CG LEU A 34 2.933 8.497 -0.130 1.00 0.00 C ATOM 551 CD1 LEU A 34 3.571 9.422 -1.154 1.00 0.00 C ATOM 552 CD2 LEU A 34 1.807 7.696 -0.766 1.00 0.00 C ATOM 0 H LEU A 34 2.973 8.351 2.593 1.00 0.00 H new ATOM 0 HA LEU A 34 2.661 5.992 1.120 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.775 8.169 0.915 1.00 0.00 H new ATOM 0 HB3 LEU A 34 4.433 6.979 -0.325 1.00 0.00 H new ATOM 0 HG LEU A 34 2.513 9.106 0.670 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.810 10.079 -1.575 1.00 0.00 H new ATOM 0 HD12 LEU A 34 4.342 10.023 -0.671 1.00 0.00 H new ATOM 0 HD13 LEU A 34 4.019 8.829 -1.951 1.00 0.00 H new ATOM 0 HD21 LEU A 34 1.071 8.378 -1.193 1.00 0.00 H new ATOM 0 HD22 LEU A 34 2.212 7.061 -1.553 1.00 0.00 H new ATOM 0 HD23 LEU A 34 1.329 7.075 -0.008 1.00 0.00 H new ATOM 564 N MET A 35 5.455 6.184 2.862 1.00 0.00 N ATOM 565 CA MET A 35 6.587 5.414 3.374 1.00 0.00 C ATOM 566 C MET A 35 6.120 4.191 4.164 1.00 0.00 C ATOM 567 O MET A 35 6.724 3.123 4.077 1.00 0.00 O ATOM 568 CB MET A 35 7.477 6.312 4.242 1.00 0.00 C ATOM 569 CG MET A 35 8.662 5.595 4.869 1.00 0.00 C ATOM 570 SD MET A 35 9.814 6.737 5.664 1.00 0.00 S ATOM 571 CE MET A 35 8.717 7.621 6.772 1.00 0.00 C ATOM 0 H MET A 35 5.400 7.137 3.222 1.00 0.00 H new ATOM 0 HA MET A 35 7.166 5.052 2.525 1.00 0.00 H new ATOM 0 HB2 MET A 35 7.847 7.137 3.632 1.00 0.00 H new ATOM 0 HB3 MET A 35 6.870 6.749 5.035 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.301 4.876 5.605 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.188 5.028 4.101 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.275 7.955 7.647 1.00 0.00 H new ATOM 0 HE2 MET A 35 8.298 8.485 6.257 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.909 6.961 7.088 1.00 0.00 H new ATOM 581 N CYS A 36 5.041 4.344 4.917 1.00 0.00 N ATOM 582 CA CYS A 36 4.511 3.245 5.715 1.00 0.00 C ATOM 583 C CYS A 36 3.744 2.255 4.839 1.00 0.00 C ATOM 584 O CYS A 36 3.946 1.042 4.931 1.00 0.00 O ATOM 585 CB CYS A 36 3.599 3.785 6.819 1.00 0.00 C ATOM 586 SG CYS A 36 4.406 4.968 7.924 1.00 0.00 S ATOM 0 H CYS A 36 4.516 5.215 4.993 1.00 0.00 H new ATOM 0 HA CYS A 36 5.350 2.720 6.171 1.00 0.00 H new ATOM 0 HB2 CYS A 36 2.734 4.263 6.360 1.00 0.00 H new ATOM 0 HB3 CYS A 36 3.225 2.948 7.409 1.00 0.00 H new ATOM 0 HG CYS A 36 4.437 6.138 7.359 1.00 0.00 H new ATOM 592 N LEU A 37 2.875 2.784 3.979 1.00 0.00 N ATOM 593 CA LEU A 37 2.044 1.954 3.111 1.00 0.00 C ATOM 594 C LEU A 37 2.898 1.099 2.185 1.00 0.00 C ATOM 595 O LEU A 37 2.742 -0.120 2.140 1.00 0.00 O ATOM 596 CB LEU A 37 1.092 2.826 2.285 1.00 0.00 C ATOM 597 CG LEU A 37 0.034 3.582 3.091 1.00 0.00 C ATOM 598 CD1 LEU A 37 -0.741 4.533 2.192 1.00 0.00 C ATOM 599 CD2 LEU A 37 -0.911 2.604 3.771 1.00 0.00 C ATOM 0 H LEU A 37 2.729 3.787 3.865 1.00 0.00 H new ATOM 0 HA LEU A 37 1.458 1.291 3.748 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.683 3.549 1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.586 2.193 1.556 1.00 0.00 H new ATOM 0 HG LEU A 37 0.538 4.169 3.859 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.489 5.062 2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.055 5.253 1.746 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.235 3.966 1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.658 3.156 4.341 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.408 1.994 3.017 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.345 1.960 4.444 1.00 0.00 H new ATOM 611 N GLY A 38 3.812 1.740 1.466 1.00 0.00 N ATOM 612 CA GLY A 38 4.640 1.030 0.507 1.00 0.00 C ATOM 613 C GLY A 38 5.486 -0.049 1.150 1.00 0.00 C ATOM 614 O GLY A 38 5.707 -1.108 0.564 1.00 0.00 O ATOM 0 H GLY A 38 3.995 2.741 1.530 1.00 0.00 H new ATOM 0 HA2 GLY A 38 4.003 0.580 -0.254 1.00 0.00 H new ATOM 0 HA3 GLY A 38 5.291 1.741 -0.002 1.00 0.00 H new ATOM 618 N ASN A 39 5.944 0.221 2.363 1.00 0.00 N ATOM 619 CA ASN A 39 6.782 -0.717 3.096 1.00 0.00 C ATOM 620 C ASN A 39 5.983 -1.963 3.461 1.00 0.00 C ATOM 621 O ASN A 39 6.454 -3.088 3.305 1.00 0.00 O ATOM 622 CB ASN A 39 7.312 -0.055 4.363 1.00 0.00 C ATOM 623 CG ASN A 39 8.623 -0.650 4.838 1.00 0.00 C ATOM 624 OD1 ASN A 39 8.646 -1.630 5.580 1.00 0.00 O ATOM 625 ND2 ASN A 39 9.727 -0.037 4.433 1.00 0.00 N ATOM 0 H ASN A 39 5.748 1.088 2.864 1.00 0.00 H new ATOM 0 HA ASN A 39 7.621 -1.008 2.464 1.00 0.00 H new ATOM 0 HB2 ASN A 39 7.448 1.011 4.180 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.568 -0.150 5.154 1.00 0.00 H new ATOM 0 HD21 ASN A 39 10.640 -0.376 4.737 1.00 0.00 H new ATOM 0 HD22 ASN A 39 9.664 0.773 3.817 1.00 0.00 H new ATOM 632 N ALA A 40 4.761 -1.751 3.935 1.00 0.00 N ATOM 633 CA ALA A 40 3.881 -2.853 4.288 1.00 0.00 C ATOM 634 C ALA A 40 3.517 -3.665 3.051 1.00 0.00 C ATOM 635 O ALA A 40 3.546 -4.898 3.075 1.00 0.00 O ATOM 636 CB ALA A 40 2.629 -2.329 4.977 1.00 0.00 C ATOM 0 H ALA A 40 4.359 -0.825 4.083 1.00 0.00 H new ATOM 0 HA ALA A 40 4.407 -3.509 4.982 1.00 0.00 H new ATOM 0 HB1 ALA A 40 1.979 -3.165 5.236 1.00 0.00 H new ATOM 0 HB2 ALA A 40 2.910 -1.794 5.884 1.00 0.00 H new ATOM 0 HB3 ALA A 40 2.100 -1.653 4.305 1.00 0.00 H new ATOM 642 N VAL A 41 3.203 -2.967 1.966 1.00 0.00 N ATOM 643 CA VAL A 41 2.837 -3.617 0.715 1.00 0.00 C ATOM 644 C VAL A 41 3.988 -4.461 0.178 1.00 0.00 C ATOM 645 O VAL A 41 3.795 -5.618 -0.197 1.00 0.00 O ATOM 646 CB VAL A 41 2.420 -2.596 -0.368 1.00 0.00 C ATOM 647 CG1 VAL A 41 2.102 -3.301 -1.678 1.00 0.00 C ATOM 648 CG2 VAL A 41 1.228 -1.771 0.089 1.00 0.00 C ATOM 0 H VAL A 41 3.195 -1.948 1.928 1.00 0.00 H new ATOM 0 HA VAL A 41 1.984 -4.258 0.940 1.00 0.00 H new ATOM 0 HB VAL A 41 3.260 -1.921 -0.531 1.00 0.00 H new ATOM 0 HG11 VAL A 41 1.811 -2.564 -2.426 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.983 -3.841 -2.024 1.00 0.00 H new ATOM 0 HG13 VAL A 41 1.284 -4.004 -1.523 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.956 -1.061 -0.692 1.00 0.00 H new ATOM 0 HG22 VAL A 41 0.384 -2.431 0.289 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.488 -1.228 0.998 1.00 0.00 H new ATOM 658 N THR A 42 5.190 -3.895 0.178 1.00 0.00 N ATOM 659 CA THR A 42 6.333 -4.561 -0.433 1.00 0.00 C ATOM 660 C THR A 42 6.749 -5.789 0.379 1.00 0.00 C ATOM 661 O THR A 42 7.399 -6.702 -0.134 1.00 0.00 O ATOM 662 CB THR A 42 7.530 -3.592 -0.599 1.00 0.00 C ATOM 663 OG1 THR A 42 8.483 -4.141 -1.512 1.00 0.00 O ATOM 664 CG2 THR A 42 8.217 -3.313 0.728 1.00 0.00 C ATOM 0 H THR A 42 5.397 -2.985 0.590 1.00 0.00 H new ATOM 0 HA THR A 42 6.026 -4.891 -1.426 1.00 0.00 H new ATOM 0 HB THR A 42 7.137 -2.653 -0.987 1.00 0.00 H new ATOM 0 HG1 THR A 42 9.222 -4.545 -1.010 1.00 0.00 H new ATOM 0 HG21 THR A 42 9.051 -2.629 0.569 1.00 0.00 H new ATOM 0 HG22 THR A 42 7.505 -2.862 1.419 1.00 0.00 H new ATOM 0 HG23 THR A 42 8.589 -4.247 1.149 1.00 0.00 H new ATOM 672 N ASN A 43 6.351 -5.818 1.646 1.00 0.00 N ATOM 673 CA ASN A 43 6.666 -6.939 2.512 1.00 0.00 C ATOM 674 C ASN A 43 5.659 -8.067 2.301 1.00 0.00 C ATOM 675 O ASN A 43 5.993 -9.243 2.429 1.00 0.00 O ATOM 676 CB ASN A 43 6.671 -6.502 3.978 1.00 0.00 C ATOM 677 CG ASN A 43 7.452 -7.459 4.856 1.00 0.00 C ATOM 678 OD1 ASN A 43 8.416 -8.079 4.406 1.00 0.00 O ATOM 679 ND2 ASN A 43 7.053 -7.578 6.112 1.00 0.00 N ATOM 0 H ASN A 43 5.810 -5.077 2.092 1.00 0.00 H new ATOM 0 HA ASN A 43 7.661 -7.303 2.257 1.00 0.00 H new ATOM 0 HB2 ASN A 43 7.103 -5.504 4.057 1.00 0.00 H new ATOM 0 HB3 ASN A 43 5.645 -6.435 4.339 1.00 0.00 H new ATOM 0 HD21 ASN A 43 7.550 -8.202 6.748 1.00 0.00 H new ATOM 0 HD22 ASN A 43 6.249 -7.046 6.444 1.00 0.00 H new ATOM 686 N ILE A 44 4.428 -7.699 1.957 1.00 0.00 N ATOM 687 CA ILE A 44 3.382 -8.679 1.686 1.00 0.00 C ATOM 688 C ILE A 44 3.640 -9.377 0.352 1.00 0.00 C ATOM 689 O ILE A 44 3.443 -10.586 0.219 1.00 0.00 O ATOM 690 CB ILE A 44 1.979 -8.024 1.673 1.00 0.00 C ATOM 691 CG1 ILE A 44 1.655 -7.431 3.050 1.00 0.00 C ATOM 692 CG2 ILE A 44 0.908 -9.031 1.267 1.00 0.00 C ATOM 693 CD1 ILE A 44 1.663 -8.452 4.171 1.00 0.00 C ATOM 0 H ILE A 44 4.131 -6.728 1.859 1.00 0.00 H new ATOM 0 HA ILE A 44 3.405 -9.415 2.489 1.00 0.00 H new ATOM 0 HB ILE A 44 1.988 -7.221 0.936 1.00 0.00 H new ATOM 0 HG12 ILE A 44 2.379 -6.649 3.278 1.00 0.00 H new ATOM 0 HG13 ILE A 44 0.675 -6.956 3.010 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -0.067 -8.544 1.266 1.00 0.00 H new ATOM 0 HG22 ILE A 44 1.125 -9.410 0.268 1.00 0.00 H new ATOM 0 HG23 ILE A 44 0.900 -9.859 1.976 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.426 -7.959 5.114 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.919 -9.222 3.967 1.00 0.00 H new ATOM 0 HD13 ILE A 44 2.650 -8.910 4.239 1.00 0.00 H new ATOM 705 N ILE A 45 4.112 -8.611 -0.625 1.00 0.00 N ATOM 706 CA ILE A 45 4.438 -9.155 -1.941 1.00 0.00 C ATOM 707 C ILE A 45 5.585 -10.172 -1.840 1.00 0.00 C ATOM 708 O ILE A 45 5.790 -10.996 -2.729 1.00 0.00 O ATOM 709 CB ILE A 45 4.811 -8.022 -2.930 1.00 0.00 C ATOM 710 CG1 ILE A 45 3.643 -7.040 -3.067 1.00 0.00 C ATOM 711 CG2 ILE A 45 5.190 -8.581 -4.295 1.00 0.00 C ATOM 712 CD1 ILE A 45 3.957 -5.837 -3.930 1.00 0.00 C ATOM 0 H ILE A 45 4.278 -7.609 -0.532 1.00 0.00 H new ATOM 0 HA ILE A 45 3.553 -9.666 -2.321 1.00 0.00 H new ATOM 0 HB ILE A 45 5.678 -7.496 -2.531 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.786 -7.565 -3.489 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.350 -6.697 -2.075 1.00 0.00 H new ATOM 0 HG21 ILE A 45 5.446 -7.761 -4.966 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.047 -9.246 -4.191 1.00 0.00 H new ATOM 0 HG23 ILE A 45 4.348 -9.137 -4.707 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.083 -5.187 -3.980 1.00 0.00 H new ATOM 0 HD12 ILE A 45 4.793 -5.288 -3.498 1.00 0.00 H new ATOM 0 HD13 ILE A 45 4.221 -6.169 -4.934 1.00 0.00 H new ATOM 724 N ALA A 46 6.304 -10.139 -0.723 1.00 0.00 N ATOM 725 CA ALA A 46 7.402 -11.071 -0.497 1.00 0.00 C ATOM 726 C ALA A 46 6.877 -12.468 -0.173 1.00 0.00 C ATOM 727 O ALA A 46 7.640 -13.435 -0.134 1.00 0.00 O ATOM 728 CB ALA A 46 8.304 -10.565 0.617 1.00 0.00 C ATOM 0 H ALA A 46 6.146 -9.478 0.038 1.00 0.00 H new ATOM 0 HA ALA A 46 7.987 -11.138 -1.414 1.00 0.00 H new ATOM 0 HB1 ALA A 46 9.119 -11.271 0.774 1.00 0.00 H new ATOM 0 HB2 ALA A 46 8.714 -9.594 0.340 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.727 -10.467 1.536 1.00 0.00 H new ATOM 734 N GLN A 47 5.572 -12.564 0.049 1.00 0.00 N ATOM 735 CA GLN A 47 4.931 -13.843 0.320 1.00 0.00 C ATOM 736 C GLN A 47 4.258 -14.367 -0.943 1.00 0.00 C ATOM 737 O GLN A 47 3.546 -15.372 -0.919 1.00 0.00 O ATOM 738 CB GLN A 47 3.909 -13.692 1.447 1.00 0.00 C ATOM 739 CG GLN A 47 4.495 -13.071 2.703 1.00 0.00 C ATOM 740 CD GLN A 47 3.498 -12.967 3.837 1.00 0.00 C ATOM 741 OE1 GLN A 47 2.593 -13.790 3.967 1.00 0.00 O ATOM 742 NE2 GLN A 47 3.656 -11.950 4.666 1.00 0.00 N ATOM 0 H GLN A 47 4.935 -11.767 0.046 1.00 0.00 H new ATOM 0 HA GLN A 47 5.689 -14.560 0.634 1.00 0.00 H new ATOM 0 HB2 GLN A 47 3.080 -13.077 1.098 1.00 0.00 H new ATOM 0 HB3 GLN A 47 3.498 -14.672 1.691 1.00 0.00 H new ATOM 0 HG2 GLN A 47 5.348 -13.666 3.031 1.00 0.00 H new ATOM 0 HG3 GLN A 47 4.872 -12.076 2.467 1.00 0.00 H new ATOM 0 HE21 GLN A 47 4.420 -11.289 4.523 1.00 0.00 H new ATOM 0 HE22 GLN A 47 3.014 -11.826 5.449 1.00 0.00 H new ATOM 751 N VAL A 48 4.492 -13.670 -2.045 1.00 0.00 N ATOM 752 CA VAL A 48 3.946 -14.054 -3.336 1.00 0.00 C ATOM 753 C VAL A 48 5.032 -14.714 -4.181 1.00 0.00 C ATOM 754 O VAL A 48 6.090 -14.127 -4.386 1.00 0.00 O ATOM 755 CB VAL A 48 3.390 -12.828 -4.096 1.00 0.00 C ATOM 756 CG1 VAL A 48 2.743 -13.246 -5.406 1.00 0.00 C ATOM 757 CG2 VAL A 48 2.406 -12.060 -3.227 1.00 0.00 C ATOM 0 H VAL A 48 5.064 -12.826 -2.069 1.00 0.00 H new ATOM 0 HA VAL A 48 3.130 -14.755 -3.160 1.00 0.00 H new ATOM 0 HB VAL A 48 4.225 -12.168 -4.331 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.360 -12.364 -5.920 1.00 0.00 H new ATOM 0 HG12 VAL A 48 3.483 -13.741 -6.035 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.921 -13.933 -5.203 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.026 -11.201 -3.780 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.576 -12.712 -2.954 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.910 -11.716 -2.324 1.00 0.00 H new ATOM 767 N PRO A 49 4.796 -15.943 -4.664 1.00 0.00 N ATOM 768 CA PRO A 49 5.773 -16.679 -5.480 1.00 0.00 C ATOM 769 C PRO A 49 6.282 -15.867 -6.671 1.00 0.00 C ATOM 770 O PRO A 49 5.493 -15.255 -7.392 1.00 0.00 O ATOM 771 CB PRO A 49 4.981 -17.895 -5.965 1.00 0.00 C ATOM 772 CG PRO A 49 3.927 -18.093 -4.933 1.00 0.00 C ATOM 773 CD PRO A 49 3.563 -16.719 -4.448 1.00 0.00 C ATOM 0 HA PRO A 49 6.668 -16.929 -4.910 1.00 0.00 H new ATOM 0 HB2 PRO A 49 4.545 -17.718 -6.948 1.00 0.00 H new ATOM 0 HB3 PRO A 49 5.619 -18.774 -6.053 1.00 0.00 H new ATOM 0 HG2 PRO A 49 3.059 -18.601 -5.353 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.293 -18.712 -4.114 1.00 0.00 H new ATOM 0 HD2 PRO A 49 2.724 -16.305 -5.007 1.00 0.00 H new ATOM 0 HD3 PRO A 49 3.272 -16.728 -3.397 1.00 0.00 H new ATOM 781 N GLU A 50 7.606 -15.881 -6.862 1.00 0.00 N ATOM 782 CA GLU A 50 8.281 -15.155 -7.951 1.00 0.00 C ATOM 783 C GLU A 50 7.582 -15.298 -9.301 1.00 0.00 C ATOM 784 O GLU A 50 7.576 -14.356 -10.094 1.00 0.00 O ATOM 785 CB GLU A 50 9.725 -15.641 -8.077 1.00 0.00 C ATOM 786 CG GLU A 50 10.621 -15.164 -6.952 1.00 0.00 C ATOM 787 CD GLU A 50 11.158 -13.765 -7.183 1.00 0.00 C ATOM 788 OE1 GLU A 50 10.346 -12.823 -7.264 1.00 0.00 O ATOM 789 OE2 GLU A 50 12.395 -13.606 -7.270 1.00 0.00 O ATOM 0 H GLU A 50 8.247 -16.400 -6.262 1.00 0.00 H new ATOM 0 HA GLU A 50 8.248 -14.098 -7.686 1.00 0.00 H new ATOM 0 HB2 GLU A 50 9.733 -16.731 -8.101 1.00 0.00 H new ATOM 0 HB3 GLU A 50 10.134 -15.299 -9.027 1.00 0.00 H new ATOM 0 HG2 GLU A 50 10.063 -15.184 -6.016 1.00 0.00 H new ATOM 0 HG3 GLU A 50 11.456 -15.855 -6.841 1.00 0.00 H new ATOM 796 N SER A 51 6.990 -16.462 -9.552 1.00 0.00 N ATOM 797 CA SER A 51 6.297 -16.723 -10.811 1.00 0.00 C ATOM 798 C SER A 51 5.212 -15.669 -11.078 1.00 0.00 C ATOM 799 O SER A 51 4.861 -15.403 -12.229 1.00 0.00 O ATOM 800 CB SER A 51 5.683 -18.128 -10.790 1.00 0.00 C ATOM 801 OG SER A 51 5.203 -18.509 -12.071 1.00 0.00 O ATOM 0 H SER A 51 6.976 -17.244 -8.897 1.00 0.00 H new ATOM 0 HA SER A 51 7.026 -16.664 -11.620 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.430 -18.847 -10.452 1.00 0.00 H new ATOM 0 HB3 SER A 51 4.864 -18.157 -10.071 1.00 0.00 H new ATOM 0 HG SER A 51 4.820 -19.410 -12.022 1.00 0.00 H new ATOM 807 N LYS A 52 4.686 -15.068 -10.016 1.00 0.00 N ATOM 808 CA LYS A 52 3.704 -14.004 -10.160 1.00 0.00 C ATOM 809 C LYS A 52 4.071 -12.788 -9.310 1.00 0.00 C ATOM 810 O LYS A 52 3.349 -11.796 -9.310 1.00 0.00 O ATOM 811 CB LYS A 52 2.300 -14.495 -9.784 1.00 0.00 C ATOM 812 CG LYS A 52 2.212 -15.117 -8.399 1.00 0.00 C ATOM 813 CD LYS A 52 0.769 -15.263 -7.935 1.00 0.00 C ATOM 814 CE LYS A 52 -0.051 -16.144 -8.868 1.00 0.00 C ATOM 815 NZ LYS A 52 -1.454 -16.292 -8.393 1.00 0.00 N ATOM 0 H LYS A 52 4.923 -15.299 -9.051 1.00 0.00 H new ATOM 0 HA LYS A 52 3.704 -13.706 -11.209 1.00 0.00 H new ATOM 0 HB2 LYS A 52 1.606 -13.656 -9.839 1.00 0.00 H new ATOM 0 HB3 LYS A 52 1.973 -15.228 -10.522 1.00 0.00 H new ATOM 0 HG2 LYS A 52 2.691 -16.096 -8.409 1.00 0.00 H new ATOM 0 HG3 LYS A 52 2.762 -14.500 -7.688 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.754 -15.687 -6.931 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.308 -14.277 -7.871 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.049 -15.714 -9.870 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.414 -17.127 -8.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -1.982 -16.898 -9.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.457 -16.725 -7.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.905 -15.356 -8.346 1.00 0.00 H new ATOM 829 N ARG A 53 5.199 -12.854 -8.603 1.00 0.00 N ATOM 830 CA ARG A 53 5.613 -11.758 -7.729 1.00 0.00 C ATOM 831 C ARG A 53 5.871 -10.501 -8.548 1.00 0.00 C ATOM 832 O ARG A 53 5.392 -9.419 -8.214 1.00 0.00 O ATOM 833 CB ARG A 53 6.876 -12.124 -6.945 1.00 0.00 C ATOM 834 CG ARG A 53 7.127 -11.221 -5.745 1.00 0.00 C ATOM 835 CD ARG A 53 8.481 -11.480 -5.109 1.00 0.00 C ATOM 836 NE ARG A 53 8.756 -12.905 -4.946 1.00 0.00 N ATOM 837 CZ ARG A 53 8.906 -13.512 -3.773 1.00 0.00 C ATOM 838 NH1 ARG A 53 8.783 -12.823 -2.653 1.00 0.00 N ATOM 839 NH2 ARG A 53 9.184 -14.808 -3.720 1.00 0.00 N ATOM 0 H ARG A 53 5.838 -13.649 -8.618 1.00 0.00 H new ATOM 0 HA ARG A 53 4.805 -11.573 -7.021 1.00 0.00 H new ATOM 0 HB2 ARG A 53 6.796 -13.156 -6.603 1.00 0.00 H new ATOM 0 HB3 ARG A 53 7.736 -12.075 -7.613 1.00 0.00 H new ATOM 0 HG2 ARG A 53 7.067 -10.178 -6.058 1.00 0.00 H new ATOM 0 HG3 ARG A 53 6.343 -11.377 -5.004 1.00 0.00 H new ATOM 0 HD2 ARG A 53 9.260 -11.030 -5.724 1.00 0.00 H new ATOM 0 HD3 ARG A 53 8.522 -10.991 -4.136 1.00 0.00 H new ATOM 0 HE ARG A 53 8.839 -13.473 -5.789 1.00 0.00 H new ATOM 0 HH11 ARG A 53 8.573 -11.825 -2.688 1.00 0.00 H new ATOM 0 HH12 ARG A 53 8.898 -13.288 -1.753 1.00 0.00 H new ATOM 0 HH21 ARG A 53 9.284 -15.344 -4.582 1.00 0.00 H new ATOM 0 HH22 ARG A 53 9.298 -15.269 -2.817 1.00 0.00 H new ATOM 853 N VAL A 54 6.617 -10.661 -9.632 1.00 0.00 N ATOM 854 CA VAL A 54 6.927 -9.548 -10.520 1.00 0.00 C ATOM 855 C VAL A 54 5.660 -9.060 -11.220 1.00 0.00 C ATOM 856 O VAL A 54 5.520 -7.878 -11.539 1.00 0.00 O ATOM 857 CB VAL A 54 7.982 -9.951 -11.574 1.00 0.00 C ATOM 858 CG1 VAL A 54 8.395 -8.754 -12.416 1.00 0.00 C ATOM 859 CG2 VAL A 54 9.196 -10.577 -10.904 1.00 0.00 C ATOM 0 H VAL A 54 7.020 -11.553 -9.919 1.00 0.00 H new ATOM 0 HA VAL A 54 7.338 -8.742 -9.913 1.00 0.00 H new ATOM 0 HB VAL A 54 7.532 -10.691 -12.236 1.00 0.00 H new ATOM 0 HG11 VAL A 54 9.138 -9.065 -13.150 1.00 0.00 H new ATOM 0 HG12 VAL A 54 7.522 -8.353 -12.931 1.00 0.00 H new ATOM 0 HG13 VAL A 54 8.821 -7.985 -11.771 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.928 -10.854 -11.663 1.00 0.00 H new ATOM 0 HG22 VAL A 54 9.642 -9.860 -10.215 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.890 -11.466 -10.354 1.00 0.00 H new ATOM 869 N ALA A 55 4.729 -9.978 -11.432 1.00 0.00 N ATOM 870 CA ALA A 55 3.472 -9.655 -12.082 1.00 0.00 C ATOM 871 C ALA A 55 2.577 -8.831 -11.161 1.00 0.00 C ATOM 872 O ALA A 55 2.063 -7.789 -11.559 1.00 0.00 O ATOM 873 CB ALA A 55 2.759 -10.924 -12.524 1.00 0.00 C ATOM 0 H ALA A 55 4.823 -10.957 -11.161 1.00 0.00 H new ATOM 0 HA ALA A 55 3.692 -9.055 -12.965 1.00 0.00 H new ATOM 0 HB1 ALA A 55 1.819 -10.663 -13.009 1.00 0.00 H new ATOM 0 HB2 ALA A 55 3.390 -11.470 -13.225 1.00 0.00 H new ATOM 0 HB3 ALA A 55 2.557 -11.550 -11.655 1.00 0.00 H new ATOM 879 N VAL A 56 2.412 -9.287 -9.920 1.00 0.00 N ATOM 880 CA VAL A 56 1.528 -8.611 -8.979 1.00 0.00 C ATOM 881 C VAL A 56 2.080 -7.249 -8.560 1.00 0.00 C ATOM 882 O VAL A 56 1.317 -6.303 -8.377 1.00 0.00 O ATOM 883 CB VAL A 56 1.231 -9.465 -7.720 1.00 0.00 C ATOM 884 CG1 VAL A 56 0.503 -10.746 -8.095 1.00 0.00 C ATOM 885 CG2 VAL A 56 2.504 -9.778 -6.946 1.00 0.00 C ATOM 0 H VAL A 56 2.876 -10.115 -9.547 1.00 0.00 H new ATOM 0 HA VAL A 56 0.589 -8.462 -9.512 1.00 0.00 H new ATOM 0 HB VAL A 56 0.583 -8.878 -7.070 1.00 0.00 H new ATOM 0 HG11 VAL A 56 0.305 -11.329 -7.195 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.440 -10.499 -8.582 1.00 0.00 H new ATOM 0 HG13 VAL A 56 1.121 -11.330 -8.777 1.00 0.00 H new ATOM 0 HG21 VAL A 56 2.259 -10.378 -6.070 1.00 0.00 H new ATOM 0 HG22 VAL A 56 3.191 -10.333 -7.585 1.00 0.00 H new ATOM 0 HG23 VAL A 56 2.975 -8.848 -6.628 1.00 0.00 H new ATOM 895 N VAL A 57 3.402 -7.137 -8.422 1.00 0.00 N ATOM 896 CA VAL A 57 4.007 -5.861 -8.059 1.00 0.00 C ATOM 897 C VAL A 57 3.872 -4.855 -9.203 1.00 0.00 C ATOM 898 O VAL A 57 3.654 -3.665 -8.969 1.00 0.00 O ATOM 899 CB VAL A 57 5.497 -5.998 -7.648 1.00 0.00 C ATOM 900 CG1 VAL A 57 6.360 -6.486 -8.801 1.00 0.00 C ATOM 901 CG2 VAL A 57 6.023 -4.677 -7.113 1.00 0.00 C ATOM 0 H VAL A 57 4.063 -7.903 -8.554 1.00 0.00 H new ATOM 0 HA VAL A 57 3.463 -5.497 -7.187 1.00 0.00 H new ATOM 0 HB VAL A 57 5.552 -6.747 -6.858 1.00 0.00 H new ATOM 0 HG11 VAL A 57 7.396 -6.568 -8.471 1.00 0.00 H new ATOM 0 HG12 VAL A 57 6.006 -7.462 -9.132 1.00 0.00 H new ATOM 0 HG13 VAL A 57 6.298 -5.778 -9.627 1.00 0.00 H new ATOM 0 HG21 VAL A 57 7.069 -4.790 -6.829 1.00 0.00 H new ATOM 0 HG22 VAL A 57 5.937 -3.912 -7.885 1.00 0.00 H new ATOM 0 HG23 VAL A 57 5.441 -4.380 -6.241 1.00 0.00 H new ATOM 911 N ASP A 58 3.975 -5.333 -10.441 1.00 0.00 N ATOM 912 CA ASP A 58 3.833 -4.454 -11.591 1.00 0.00 C ATOM 913 C ASP A 58 2.380 -4.038 -11.754 1.00 0.00 C ATOM 914 O ASP A 58 2.090 -2.867 -11.974 1.00 0.00 O ATOM 915 CB ASP A 58 4.332 -5.116 -12.874 1.00 0.00 C ATOM 916 CG ASP A 58 4.387 -4.136 -14.031 1.00 0.00 C ATOM 917 OD1 ASP A 58 5.352 -3.342 -14.095 1.00 0.00 O ATOM 918 OD2 ASP A 58 3.464 -4.140 -14.868 1.00 0.00 O ATOM 0 H ASP A 58 4.154 -6.311 -10.669 1.00 0.00 H new ATOM 0 HA ASP A 58 4.447 -3.572 -11.410 1.00 0.00 H new ATOM 0 HB2 ASP A 58 5.324 -5.534 -12.705 1.00 0.00 H new ATOM 0 HB3 ASP A 58 3.676 -5.947 -13.133 1.00 0.00 H new ATOM 923 N ASN A 59 1.469 -5.001 -11.619 1.00 0.00 N ATOM 924 CA ASN A 59 0.036 -4.716 -11.679 1.00 0.00 C ATOM 925 C ASN A 59 -0.356 -3.719 -10.598 1.00 0.00 C ATOM 926 O ASN A 59 -1.182 -2.837 -10.825 1.00 0.00 O ATOM 927 CB ASN A 59 -0.791 -5.995 -11.519 1.00 0.00 C ATOM 928 CG ASN A 59 -0.831 -6.837 -12.781 1.00 0.00 C ATOM 929 OD1 ASN A 59 -0.770 -6.318 -13.894 1.00 0.00 O ATOM 930 ND2 ASN A 59 -0.944 -8.146 -12.613 1.00 0.00 N ATOM 0 H ASN A 59 1.697 -5.984 -11.468 1.00 0.00 H new ATOM 0 HA ASN A 59 -0.173 -4.287 -12.659 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.376 -6.590 -10.705 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.809 -5.730 -11.233 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.983 -8.763 -13.424 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.992 -8.537 -11.672 1.00 0.00 H new ATOM 937 N PHE A 60 0.247 -3.867 -9.424 1.00 0.00 N ATOM 938 CA PHE A 60 0.007 -2.959 -8.311 1.00 0.00 C ATOM 939 C PHE A 60 0.381 -1.534 -8.701 1.00 0.00 C ATOM 940 O PHE A 60 -0.422 -0.612 -8.582 1.00 0.00 O ATOM 941 CB PHE A 60 0.825 -3.393 -7.092 1.00 0.00 C ATOM 942 CG PHE A 60 0.553 -2.593 -5.850 1.00 0.00 C ATOM 943 CD1 PHE A 60 -0.565 -2.852 -5.073 1.00 0.00 C ATOM 944 CD2 PHE A 60 1.417 -1.583 -5.461 1.00 0.00 C ATOM 945 CE1 PHE A 60 -0.813 -2.120 -3.930 1.00 0.00 C ATOM 946 CE2 PHE A 60 1.174 -0.849 -4.320 1.00 0.00 C ATOM 947 CZ PHE A 60 0.059 -1.115 -3.555 1.00 0.00 C ATOM 0 H PHE A 60 0.911 -4.614 -9.219 1.00 0.00 H new ATOM 0 HA PHE A 60 -1.053 -2.990 -8.060 1.00 0.00 H new ATOM 0 HB2 PHE A 60 0.619 -4.443 -6.886 1.00 0.00 H new ATOM 0 HB3 PHE A 60 1.885 -3.317 -7.334 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -1.249 -3.635 -5.365 1.00 0.00 H new ATOM 0 HD2 PHE A 60 2.291 -1.368 -6.058 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -1.686 -2.332 -3.330 1.00 0.00 H new ATOM 0 HE2 PHE A 60 1.857 -0.066 -4.026 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.134 -0.538 -2.662 1.00 0.00 H new ATOM 957 N THR A 61 1.604 -1.374 -9.183 1.00 0.00 N ATOM 958 CA THR A 61 2.116 -0.069 -9.563 1.00 0.00 C ATOM 959 C THR A 61 1.386 0.484 -10.790 1.00 0.00 C ATOM 960 O THR A 61 1.156 1.693 -10.901 1.00 0.00 O ATOM 961 CB THR A 61 3.634 -0.140 -9.824 1.00 0.00 C ATOM 962 OG1 THR A 61 3.940 -1.203 -10.736 1.00 0.00 O ATOM 963 CG2 THR A 61 4.387 -0.367 -8.520 1.00 0.00 C ATOM 0 H THR A 61 2.264 -2.139 -9.321 1.00 0.00 H new ATOM 0 HA THR A 61 1.934 0.614 -8.733 1.00 0.00 H new ATOM 0 HB THR A 61 3.945 0.809 -10.262 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.108 -1.613 -11.051 1.00 0.00 H new ATOM 0 HG21 THR A 61 5.457 -0.415 -8.721 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.183 0.455 -7.834 1.00 0.00 H new ATOM 0 HG23 THR A 61 4.060 -1.304 -8.070 1.00 0.00 H new ATOM 971 N LYS A 62 1.008 -0.415 -11.691 1.00 0.00 N ATOM 972 CA LYS A 62 0.260 -0.053 -12.886 1.00 0.00 C ATOM 973 C LYS A 62 -1.134 0.452 -12.513 1.00 0.00 C ATOM 974 O LYS A 62 -1.603 1.463 -13.043 1.00 0.00 O ATOM 975 CB LYS A 62 0.174 -1.274 -13.808 1.00 0.00 C ATOM 976 CG LYS A 62 -0.720 -1.102 -15.021 1.00 0.00 C ATOM 977 CD LYS A 62 -0.602 -2.303 -15.947 1.00 0.00 C ATOM 978 CE LYS A 62 -1.666 -2.291 -17.032 1.00 0.00 C ATOM 979 NZ LYS A 62 -3.023 -2.527 -16.477 1.00 0.00 N ATOM 0 H LYS A 62 1.211 -1.412 -11.613 1.00 0.00 H new ATOM 0 HA LYS A 62 0.773 0.754 -13.409 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.179 -1.524 -14.149 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -0.186 -2.123 -13.228 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -1.755 -0.982 -14.702 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -0.444 -0.194 -15.557 1.00 0.00 H new ATOM 0 HD2 LYS A 62 0.386 -2.310 -16.408 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -0.688 -3.220 -15.364 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -1.647 -1.332 -17.549 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -1.438 -3.057 -17.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -3.681 -2.747 -17.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -2.992 -3.326 -15.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.348 -1.674 -15.979 1.00 0.00 H new ATOM 993 N ALA A 63 -1.779 -0.251 -11.588 1.00 0.00 N ATOM 994 CA ALA A 63 -3.099 0.137 -11.111 1.00 0.00 C ATOM 995 C ALA A 63 -3.047 1.488 -10.410 1.00 0.00 C ATOM 996 O ALA A 63 -3.944 2.310 -10.579 1.00 0.00 O ATOM 997 CB ALA A 63 -3.661 -0.924 -10.177 1.00 0.00 C ATOM 0 H ALA A 63 -1.406 -1.095 -11.153 1.00 0.00 H new ATOM 0 HA ALA A 63 -3.759 0.226 -11.974 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -4.648 -0.618 -9.830 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -3.742 -1.872 -10.709 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -2.997 -1.044 -9.321 1.00 0.00 H new ATOM 1003 N LEU A 64 -1.988 1.712 -9.636 1.00 0.00 N ATOM 1004 CA LEU A 64 -1.797 2.978 -8.932 1.00 0.00 C ATOM 1005 C LEU A 64 -1.791 4.157 -9.894 1.00 0.00 C ATOM 1006 O LEU A 64 -2.496 5.138 -9.678 1.00 0.00 O ATOM 1007 CB LEU A 64 -0.496 2.961 -8.127 1.00 0.00 C ATOM 1008 CG LEU A 64 -0.546 2.162 -6.827 1.00 0.00 C ATOM 1009 CD1 LEU A 64 0.821 2.137 -6.168 1.00 0.00 C ATOM 1010 CD2 LEU A 64 -1.578 2.758 -5.883 1.00 0.00 C ATOM 0 H LEU A 64 -1.246 1.030 -9.480 1.00 0.00 H new ATOM 0 HA LEU A 64 -2.638 3.097 -8.249 1.00 0.00 H new ATOM 0 HB2 LEU A 64 0.296 2.553 -8.755 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -0.219 3.989 -7.893 1.00 0.00 H new ATOM 0 HG LEU A 64 -0.836 1.137 -7.059 1.00 0.00 H new ATOM 0 HD11 LEU A 64 0.768 1.564 -5.243 1.00 0.00 H new ATOM 0 HD12 LEU A 64 1.541 1.673 -6.842 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.136 3.156 -5.946 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.604 2.179 -4.960 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.311 3.790 -5.657 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.560 2.733 -6.355 1.00 0.00 H new ATOM 1022 N LYS A 65 -1.003 4.061 -10.960 1.00 0.00 N ATOM 1023 CA LYS A 65 -0.946 5.133 -11.950 1.00 0.00 C ATOM 1024 C LYS A 65 -2.315 5.366 -12.585 1.00 0.00 C ATOM 1025 O LYS A 65 -2.688 6.504 -12.877 1.00 0.00 O ATOM 1026 CB LYS A 65 0.109 4.836 -13.020 1.00 0.00 C ATOM 1027 CG LYS A 65 1.504 5.296 -12.623 1.00 0.00 C ATOM 1028 CD LYS A 65 2.561 4.819 -13.606 1.00 0.00 C ATOM 1029 CE LYS A 65 3.885 5.538 -13.392 1.00 0.00 C ATOM 1030 NZ LYS A 65 3.840 6.944 -13.871 1.00 0.00 N ATOM 0 H LYS A 65 -0.401 3.262 -11.160 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.655 6.048 -11.435 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.128 3.764 -13.216 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.178 5.325 -13.951 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.525 6.384 -12.568 1.00 0.00 H new ATOM 0 HG3 LYS A 65 1.740 4.922 -11.627 1.00 0.00 H new ATOM 0 HD2 LYS A 65 2.707 3.745 -13.493 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.214 4.988 -14.625 1.00 0.00 H new ATOM 0 HE2 LYS A 65 4.137 5.524 -12.332 1.00 0.00 H new ATOM 0 HE3 LYS A 65 4.677 5.002 -13.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 4.391 7.029 -14.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.853 7.217 -14.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 4.245 7.571 -13.146 1.00 0.00 H new ATOM 1044 N GLN A 66 -3.071 4.292 -12.767 1.00 0.00 N ATOM 1045 CA GLN A 66 -4.418 4.401 -13.306 1.00 0.00 C ATOM 1046 C GLN A 66 -5.328 5.129 -12.319 1.00 0.00 C ATOM 1047 O GLN A 66 -5.976 6.113 -12.674 1.00 0.00 O ATOM 1048 CB GLN A 66 -4.997 3.017 -13.622 1.00 0.00 C ATOM 1049 CG GLN A 66 -6.395 3.067 -14.230 1.00 0.00 C ATOM 1050 CD GLN A 66 -6.987 1.692 -14.474 1.00 0.00 C ATOM 1051 OE1 GLN A 66 -6.268 0.727 -14.734 1.00 0.00 O ATOM 1052 NE2 GLN A 66 -8.307 1.590 -14.396 1.00 0.00 N ATOM 0 H GLN A 66 -2.776 3.340 -12.550 1.00 0.00 H new ATOM 0 HA GLN A 66 -4.364 4.973 -14.232 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -4.328 2.501 -14.311 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -5.029 2.427 -12.706 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -7.054 3.627 -13.566 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -6.355 3.612 -15.173 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -8.870 2.412 -14.178 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -8.759 0.689 -14.554 1.00 0.00 H new ATOM 1061 N SER A 67 -5.341 4.666 -11.070 1.00 0.00 N ATOM 1062 CA SER A 67 -6.244 5.204 -10.056 1.00 0.00 C ATOM 1063 C SER A 67 -5.859 6.625 -9.641 1.00 0.00 C ATOM 1064 O SER A 67 -6.594 7.288 -8.912 1.00 0.00 O ATOM 1065 CB SER A 67 -6.286 4.276 -8.839 1.00 0.00 C ATOM 1066 OG SER A 67 -4.985 3.976 -8.370 1.00 0.00 O ATOM 0 H SER A 67 -4.734 3.917 -10.736 1.00 0.00 H new ATOM 0 HA SER A 67 -7.240 5.258 -10.496 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.862 4.746 -8.042 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.801 3.352 -9.102 1.00 0.00 H new ATOM 0 HG SER A 67 -4.971 4.022 -7.391 1.00 0.00 H new ATOM 1072 N VAL A 68 -4.710 7.094 -10.095 1.00 0.00 N ATOM 1073 CA VAL A 68 -4.333 8.481 -9.881 1.00 0.00 C ATOM 1074 C VAL A 68 -4.854 9.353 -11.022 1.00 0.00 C ATOM 1075 O VAL A 68 -5.366 10.451 -10.795 1.00 0.00 O ATOM 1076 CB VAL A 68 -2.801 8.649 -9.755 1.00 0.00 C ATOM 1077 CG1 VAL A 68 -2.413 10.119 -9.689 1.00 0.00 C ATOM 1078 CG2 VAL A 68 -2.284 7.919 -8.527 1.00 0.00 C ATOM 0 H VAL A 68 -4.026 6.540 -10.610 1.00 0.00 H new ATOM 0 HA VAL A 68 -4.784 8.799 -8.941 1.00 0.00 H new ATOM 0 HB VAL A 68 -2.344 8.214 -10.644 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.330 10.206 -9.601 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.745 10.624 -10.596 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.886 10.582 -8.823 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -1.204 8.048 -8.455 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -2.759 8.327 -7.635 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.518 6.858 -8.610 1.00 0.00 H new ATOM 1088 N LEU A 69 -4.755 8.840 -12.245 1.00 0.00 N ATOM 1089 CA LEU A 69 -5.095 9.621 -13.429 1.00 0.00 C ATOM 1090 C LEU A 69 -6.594 9.592 -13.751 1.00 0.00 C ATOM 1091 O LEU A 69 -7.195 10.634 -14.014 1.00 0.00 O ATOM 1092 CB LEU A 69 -4.297 9.120 -14.635 1.00 0.00 C ATOM 1093 CG LEU A 69 -2.775 9.251 -14.510 1.00 0.00 C ATOM 1094 CD1 LEU A 69 -2.086 8.688 -15.744 1.00 0.00 C ATOM 1095 CD2 LEU A 69 -2.378 10.704 -14.292 1.00 0.00 C ATOM 0 H LEU A 69 -4.443 7.889 -12.441 1.00 0.00 H new ATOM 0 HA LEU A 69 -4.833 10.656 -13.210 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -4.543 8.071 -14.803 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -4.622 9.669 -15.519 1.00 0.00 H new ATOM 0 HG LEU A 69 -2.452 8.674 -13.644 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.006 8.790 -15.636 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -2.342 7.634 -15.854 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -2.416 9.236 -16.627 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -1.294 10.776 -14.206 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -2.715 11.304 -15.137 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -2.840 11.074 -13.377 1.00 0.00 H new ATOM 1107 N GLU A 70 -7.202 8.406 -13.738 1.00 0.00 N ATOM 1108 CA GLU A 70 -8.584 8.259 -14.207 1.00 0.00 C ATOM 1109 C GLU A 70 -9.597 8.511 -13.095 1.00 0.00 C ATOM 1110 O GLU A 70 -10.784 8.710 -13.366 1.00 0.00 O ATOM 1111 CB GLU A 70 -8.803 6.869 -14.830 1.00 0.00 C ATOM 1112 CG GLU A 70 -8.689 5.705 -13.853 1.00 0.00 C ATOM 1113 CD GLU A 70 -10.025 5.252 -13.296 1.00 0.00 C ATOM 1114 OE1 GLU A 70 -10.771 4.563 -14.027 1.00 0.00 O ATOM 1115 OE2 GLU A 70 -10.334 5.563 -12.128 1.00 0.00 O ATOM 0 H GLU A 70 -6.768 7.542 -13.413 1.00 0.00 H new ATOM 0 HA GLU A 70 -8.745 9.018 -14.973 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -9.791 6.844 -15.289 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -8.076 6.726 -15.630 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -8.210 4.865 -14.355 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -8.039 5.996 -13.027 1.00 0.00 H new ATOM 1122 N HIS A 71 -9.127 8.516 -11.856 1.00 0.00 N ATOM 1123 CA HIS A 71 -10.000 8.716 -10.704 1.00 0.00 C ATOM 1124 C HIS A 71 -10.499 10.158 -10.641 1.00 0.00 C ATOM 1125 O HIS A 71 -9.790 11.061 -10.192 1.00 0.00 O ATOM 1126 CB HIS A 71 -9.257 8.334 -9.421 1.00 0.00 C ATOM 1127 CG HIS A 71 -9.978 8.660 -8.146 1.00 0.00 C ATOM 1128 ND1 HIS A 71 -9.575 9.674 -7.304 1.00 0.00 N ATOM 1129 CD2 HIS A 71 -11.055 8.090 -7.554 1.00 0.00 C ATOM 1130 CE1 HIS A 71 -10.369 9.713 -6.252 1.00 0.00 C ATOM 1131 NE2 HIS A 71 -11.276 8.763 -6.377 1.00 0.00 N ATOM 0 H HIS A 71 -8.143 8.384 -11.620 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.874 8.072 -10.808 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -9.055 7.263 -9.442 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -8.292 8.841 -9.414 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -11.632 7.261 -7.936 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -10.290 10.406 -5.427 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -12.020 8.561 -5.709 1.00 0.00 H new ATOM 1140 N HIS A 72 -11.717 10.361 -11.116 1.00 0.00 N ATOM 1141 CA HIS A 72 -12.352 11.671 -11.100 1.00 0.00 C ATOM 1142 C HIS A 72 -13.868 11.506 -11.085 1.00 0.00 C ATOM 1143 O HIS A 72 -14.408 10.610 -11.728 1.00 0.00 O ATOM 1144 CB HIS A 72 -11.909 12.491 -12.320 1.00 0.00 C ATOM 1145 CG HIS A 72 -12.419 13.900 -12.321 1.00 0.00 C ATOM 1146 ND1 HIS A 72 -13.429 14.332 -13.148 1.00 0.00 N ATOM 1147 CD2 HIS A 72 -12.051 14.976 -11.587 1.00 0.00 C ATOM 1148 CE1 HIS A 72 -13.663 15.611 -12.926 1.00 0.00 C ATOM 1149 NE2 HIS A 72 -12.840 16.028 -11.979 1.00 0.00 N ATOM 0 H HIS A 72 -12.293 9.625 -11.523 1.00 0.00 H new ATOM 0 HA HIS A 72 -12.048 12.206 -10.201 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -10.820 12.509 -12.358 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -12.251 11.990 -13.226 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -11.279 15.002 -10.832 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -14.402 16.215 -13.432 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -12.798 16.975 -11.602 1.00 0.00 H new ATOM 1158 N HIS A 73 -14.547 12.355 -10.332 1.00 0.00 N ATOM 1159 CA HIS A 73 -15.996 12.291 -10.232 1.00 0.00 C ATOM 1160 C HIS A 73 -16.653 13.016 -11.399 1.00 0.00 C ATOM 1161 O HIS A 73 -16.494 14.226 -11.552 1.00 0.00 O ATOM 1162 CB HIS A 73 -16.479 12.900 -8.909 1.00 0.00 C ATOM 1163 CG HIS A 73 -15.995 12.174 -7.690 1.00 0.00 C ATOM 1164 ND1 HIS A 73 -15.532 12.820 -6.563 1.00 0.00 N ATOM 1165 CD2 HIS A 73 -15.909 10.850 -7.421 1.00 0.00 C ATOM 1166 CE1 HIS A 73 -15.180 11.925 -5.658 1.00 0.00 C ATOM 1167 NE2 HIS A 73 -15.401 10.720 -6.152 1.00 0.00 N ATOM 0 H HIS A 73 -14.118 13.098 -9.780 1.00 0.00 H new ATOM 0 HA HIS A 73 -16.283 11.240 -10.263 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -16.148 13.937 -8.856 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -17.569 12.912 -8.903 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -16.189 10.044 -8.083 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -14.779 12.142 -4.679 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -15.224 9.839 -5.670 1.00 0.00 H new ATOM 1176 N HIS A 74 -17.364 12.268 -12.232 1.00 0.00 N ATOM 1177 CA HIS A 74 -18.139 12.858 -13.315 1.00 0.00 C ATOM 1178 C HIS A 74 -19.487 12.157 -13.429 1.00 0.00 C ATOM 1179 O HIS A 74 -20.470 12.604 -12.838 1.00 0.00 O ATOM 1180 CB HIS A 74 -17.378 12.783 -14.646 1.00 0.00 C ATOM 1181 CG HIS A 74 -18.105 13.409 -15.803 1.00 0.00 C ATOM 1182 ND1 HIS A 74 -18.647 12.676 -16.838 1.00 0.00 N ATOM 1183 CD2 HIS A 74 -18.368 14.705 -16.087 1.00 0.00 C ATOM 1184 CE1 HIS A 74 -19.212 13.493 -17.705 1.00 0.00 C ATOM 1185 NE2 HIS A 74 -19.058 14.732 -17.276 1.00 0.00 N ATOM 0 H HIS A 74 -17.420 11.251 -12.178 1.00 0.00 H new ATOM 0 HA HIS A 74 -18.304 13.911 -13.086 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -16.412 13.274 -14.529 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -17.177 11.737 -14.879 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -18.088 15.560 -15.490 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -19.716 13.198 -18.613 1.00 0.00 H new ATOM 0 HE2 HIS A 74 -19.395 15.571 -17.749 1.00 0.00 H new ATOM 1194 N HIS A 75 -19.507 11.038 -14.158 1.00 0.00 N ATOM 1195 CA HIS A 75 -20.739 10.294 -14.424 1.00 0.00 C ATOM 1196 C HIS A 75 -21.822 11.206 -15.007 1.00 0.00 C ATOM 1197 O HIS A 75 -21.531 12.289 -15.521 1.00 0.00 O ATOM 1198 CB HIS A 75 -21.252 9.606 -13.151 1.00 0.00 C ATOM 1199 CG HIS A 75 -20.421 8.439 -12.714 1.00 0.00 C ATOM 1200 ND1 HIS A 75 -20.141 8.161 -11.394 1.00 0.00 N ATOM 1201 CD2 HIS A 75 -19.828 7.458 -13.433 1.00 0.00 C ATOM 1202 CE1 HIS A 75 -19.415 7.064 -11.322 1.00 0.00 C ATOM 1203 NE2 HIS A 75 -19.211 6.615 -12.544 1.00 0.00 N ATOM 0 H HIS A 75 -18.674 10.625 -14.578 1.00 0.00 H new ATOM 0 HA HIS A 75 -20.505 9.526 -15.162 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -21.287 10.337 -12.343 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -22.275 9.268 -13.319 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -19.839 7.357 -14.508 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -19.048 6.609 -10.414 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -18.681 5.778 -12.789 1.00 0.00 H new ATOM 1212 N HIS A 76 -23.064 10.757 -14.938 1.00 0.00 N ATOM 1213 CA HIS A 76 -24.195 11.533 -15.430 1.00 0.00 C ATOM 1214 C HIS A 76 -25.467 11.122 -14.701 1.00 0.00 C ATOM 1215 O HIS A 76 -25.616 11.500 -13.523 1.00 0.00 O ATOM 1216 CB HIS A 76 -24.359 11.385 -16.956 1.00 0.00 C ATOM 1217 CG HIS A 76 -24.203 9.985 -17.481 1.00 0.00 C ATOM 1218 ND1 HIS A 76 -23.131 9.600 -18.254 1.00 0.00 N ATOM 1219 CD2 HIS A 76 -24.980 8.882 -17.350 1.00 0.00 C ATOM 1220 CE1 HIS A 76 -23.252 8.328 -18.573 1.00 0.00 C ATOM 1221 NE2 HIS A 76 -24.366 7.868 -18.036 1.00 0.00 N ATOM 1222 OXT HIS A 76 -26.296 10.404 -15.287 1.00 0.00 O ATOM 0 H HIS A 76 -23.318 9.852 -14.543 1.00 0.00 H new ATOM 0 HA HIS A 76 -24.001 12.586 -15.227 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -25.345 11.754 -17.237 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -23.627 12.025 -17.448 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -25.910 8.815 -16.806 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -22.557 7.758 -19.172 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -24.713 6.913 -18.118 1.00 0.00 H new TER 1231 HIS A 76 ATOM 1232 N MET B 1 21.766 11.773 17.336 1.00 0.00 N ATOM 1233 CA MET B 1 21.699 13.191 17.758 1.00 0.00 C ATOM 1234 C MET B 1 20.936 14.031 16.725 1.00 0.00 C ATOM 1235 O MET B 1 19.979 14.722 17.078 1.00 0.00 O ATOM 1236 CB MET B 1 23.106 13.757 17.994 1.00 0.00 C ATOM 1237 CG MET B 1 23.104 15.139 18.623 1.00 0.00 C ATOM 1238 SD MET B 1 22.314 15.153 20.245 1.00 0.00 S ATOM 1239 CE MET B 1 22.447 16.885 20.674 1.00 0.00 C ATOM 0 H1 MET B 1 21.307 11.175 18.053 1.00 0.00 H new ATOM 0 H2 MET B 1 21.277 11.658 16.425 1.00 0.00 H new ATOM 0 H3 MET B 1 22.761 11.488 17.233 1.00 0.00 H new ATOM 0 HA MET B 1 21.154 13.239 18.701 1.00 0.00 H new ATOM 0 HB2 MET B 1 23.661 13.074 18.638 1.00 0.00 H new ATOM 0 HB3 MET B 1 23.636 13.800 17.043 1.00 0.00 H new ATOM 0 HG2 MET B 1 24.130 15.494 18.718 1.00 0.00 H new ATOM 0 HG3 MET B 1 22.586 15.835 17.963 1.00 0.00 H new ATOM 0 HE1 MET B 1 22.001 17.052 21.654 1.00 0.00 H new ATOM 0 HE2 MET B 1 23.498 17.174 20.699 1.00 0.00 H new ATOM 0 HE3 MET B 1 21.923 17.485 19.930 1.00 0.00 H new ATOM 1251 N PRO B 2 21.338 14.014 15.432 1.00 0.00 N ATOM 1252 CA PRO B 2 20.581 14.666 14.370 1.00 0.00 C ATOM 1253 C PRO B 2 19.503 13.740 13.809 1.00 0.00 C ATOM 1254 O PRO B 2 19.674 12.518 13.788 1.00 0.00 O ATOM 1255 CB PRO B 2 21.642 14.969 13.296 1.00 0.00 C ATOM 1256 CG PRO B 2 22.920 14.353 13.779 1.00 0.00 C ATOM 1257 CD PRO B 2 22.553 13.405 14.886 1.00 0.00 C ATOM 0 HA PRO B 2 20.058 15.556 14.720 1.00 0.00 H new ATOM 0 HB2 PRO B 2 21.350 14.552 12.332 1.00 0.00 H new ATOM 0 HB3 PRO B 2 21.757 16.044 13.156 1.00 0.00 H new ATOM 0 HG2 PRO B 2 23.425 13.826 12.970 1.00 0.00 H new ATOM 0 HG3 PRO B 2 23.607 15.119 14.138 1.00 0.00 H new ATOM 0 HD2 PRO B 2 22.370 12.397 14.514 1.00 0.00 H new ATOM 0 HD3 PRO B 2 23.342 13.330 15.635 1.00 0.00 H new ATOM 1265 N ILE B 3 18.396 14.311 13.366 1.00 0.00 N ATOM 1266 CA ILE B 3 17.306 13.513 12.825 1.00 0.00 C ATOM 1267 C ILE B 3 17.460 13.323 11.321 1.00 0.00 C ATOM 1268 O ILE B 3 17.571 14.289 10.564 1.00 0.00 O ATOM 1269 CB ILE B 3 15.922 14.130 13.135 1.00 0.00 C ATOM 1270 CG1 ILE B 3 15.865 15.600 12.700 1.00 0.00 C ATOM 1271 CG2 ILE B 3 15.605 13.996 14.618 1.00 0.00 C ATOM 1272 CD1 ILE B 3 14.512 16.249 12.908 1.00 0.00 C ATOM 0 H ILE B 3 18.227 15.317 13.369 1.00 0.00 H new ATOM 0 HA ILE B 3 17.359 12.541 13.315 1.00 0.00 H new ATOM 0 HB ILE B 3 15.169 13.584 12.567 1.00 0.00 H new ATOM 0 HG12 ILE B 3 16.616 16.162 13.255 1.00 0.00 H new ATOM 0 HG13 ILE B 3 16.131 15.667 11.645 1.00 0.00 H new ATOM 0 HG21 ILE B 3 14.628 14.434 14.822 1.00 0.00 H new ATOM 0 HG22 ILE B 3 15.594 12.942 14.894 1.00 0.00 H new ATOM 0 HG23 ILE B 3 16.365 14.516 15.201 1.00 0.00 H new ATOM 0 HD11 ILE B 3 14.551 17.287 12.577 1.00 0.00 H new ATOM 0 HD12 ILE B 3 13.759 15.713 12.331 1.00 0.00 H new ATOM 0 HD13 ILE B 3 14.251 16.215 13.966 1.00 0.00 H new ATOM 1284 N VAL B 4 17.498 12.067 10.899 1.00 0.00 N ATOM 1285 CA VAL B 4 17.575 11.737 9.482 1.00 0.00 C ATOM 1286 C VAL B 4 16.184 11.799 8.855 1.00 0.00 C ATOM 1287 O VAL B 4 16.029 12.040 7.657 1.00 0.00 O ATOM 1288 CB VAL B 4 18.201 10.335 9.263 1.00 0.00 C ATOM 1289 CG1 VAL B 4 17.361 9.246 9.917 1.00 0.00 C ATOM 1290 CG2 VAL B 4 18.400 10.047 7.781 1.00 0.00 C ATOM 0 H VAL B 4 17.477 11.257 11.519 1.00 0.00 H new ATOM 0 HA VAL B 4 18.220 12.470 8.998 1.00 0.00 H new ATOM 0 HB VAL B 4 19.180 10.335 9.741 1.00 0.00 H new ATOM 0 HG11 VAL B 4 17.826 8.275 9.746 1.00 0.00 H new ATOM 0 HG12 VAL B 4 17.294 9.432 10.989 1.00 0.00 H new ATOM 0 HG13 VAL B 4 16.360 9.250 9.485 1.00 0.00 H new ATOM 0 HG21 VAL B 4 18.840 9.057 7.659 1.00 0.00 H new ATOM 0 HG22 VAL B 4 17.437 10.081 7.271 1.00 0.00 H new ATOM 0 HG23 VAL B 4 19.065 10.796 7.351 1.00 0.00 H new ATOM 1300 N SER B 5 15.174 11.611 9.688 1.00 0.00 N ATOM 1301 CA SER B 5 13.797 11.644 9.240 1.00 0.00 C ATOM 1302 C SER B 5 13.095 12.873 9.802 1.00 0.00 C ATOM 1303 O SER B 5 13.667 13.614 10.606 1.00 0.00 O ATOM 1304 CB SER B 5 13.075 10.366 9.682 1.00 0.00 C ATOM 1305 OG SER B 5 11.778 10.276 9.114 1.00 0.00 O ATOM 0 H SER B 5 15.287 11.433 10.686 1.00 0.00 H new ATOM 0 HA SER B 5 13.776 11.700 8.152 1.00 0.00 H new ATOM 0 HB2 SER B 5 13.662 9.496 9.389 1.00 0.00 H new ATOM 0 HB3 SER B 5 12.999 10.348 10.769 1.00 0.00 H new ATOM 0 HG SER B 5 11.346 9.449 9.415 1.00 0.00 H new ATOM 1311 N LYS B 6 11.862 13.086 9.376 1.00 0.00 N ATOM 1312 CA LYS B 6 11.064 14.207 9.851 1.00 0.00 C ATOM 1313 C LYS B 6 10.135 13.744 10.968 1.00 0.00 C ATOM 1314 O LYS B 6 9.386 14.533 11.545 1.00 0.00 O ATOM 1315 CB LYS B 6 10.254 14.804 8.693 1.00 0.00 C ATOM 1316 CG LYS B 6 11.116 15.257 7.522 1.00 0.00 C ATOM 1317 CD LYS B 6 10.290 15.695 6.313 1.00 0.00 C ATOM 1318 CE LYS B 6 9.710 17.099 6.471 1.00 0.00 C ATOM 1319 NZ LYS B 6 8.509 17.131 7.349 1.00 0.00 N ATOM 0 H LYS B 6 11.387 12.492 8.696 1.00 0.00 H new ATOM 0 HA LYS B 6 11.727 14.978 10.244 1.00 0.00 H new ATOM 0 HB2 LYS B 6 9.537 14.063 8.341 1.00 0.00 H new ATOM 0 HB3 LYS B 6 9.679 15.654 9.062 1.00 0.00 H new ATOM 0 HG2 LYS B 6 11.750 16.084 7.842 1.00 0.00 H new ATOM 0 HG3 LYS B 6 11.778 14.443 7.228 1.00 0.00 H new ATOM 0 HD2 LYS B 6 10.915 15.663 5.421 1.00 0.00 H new ATOM 0 HD3 LYS B 6 9.477 14.986 6.158 1.00 0.00 H new ATOM 0 HE2 LYS B 6 10.474 17.758 6.883 1.00 0.00 H new ATOM 0 HE3 LYS B 6 9.447 17.491 5.489 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 7.805 17.784 6.950 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 8.100 16.177 7.412 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 8.782 17.454 8.299 1.00 0.00 H new ATOM 1333 N TYR B 7 10.201 12.452 11.267 1.00 0.00 N ATOM 1334 CA TYR B 7 9.347 11.842 12.277 1.00 0.00 C ATOM 1335 C TYR B 7 10.182 10.933 13.166 1.00 0.00 C ATOM 1336 O TYR B 7 11.391 10.799 12.968 1.00 0.00 O ATOM 1337 CB TYR B 7 8.236 11.010 11.617 1.00 0.00 C ATOM 1338 CG TYR B 7 7.809 11.512 10.257 1.00 0.00 C ATOM 1339 CD1 TYR B 7 8.482 11.105 9.113 1.00 0.00 C ATOM 1340 CD2 TYR B 7 6.749 12.398 10.116 1.00 0.00 C ATOM 1341 CE1 TYR B 7 8.111 11.561 7.867 1.00 0.00 C ATOM 1342 CE2 TYR B 7 6.371 12.860 8.870 1.00 0.00 C ATOM 1343 CZ TYR B 7 7.058 12.438 7.749 1.00 0.00 C ATOM 1344 OH TYR B 7 6.695 12.899 6.508 1.00 0.00 O ATOM 0 H TYR B 7 10.845 11.801 10.818 1.00 0.00 H new ATOM 0 HA TYR B 7 8.893 12.635 12.870 1.00 0.00 H new ATOM 0 HB2 TYR B 7 8.578 9.980 11.520 1.00 0.00 H new ATOM 0 HB3 TYR B 7 7.368 10.997 12.276 1.00 0.00 H new ATOM 0 HD1 TYR B 7 9.311 10.419 9.201 1.00 0.00 H new ATOM 0 HD2 TYR B 7 6.213 12.731 10.992 1.00 0.00 H new ATOM 0 HE1 TYR B 7 8.644 11.232 6.987 1.00 0.00 H new ATOM 0 HE2 TYR B 7 5.543 13.547 8.773 1.00 0.00 H new ATOM 0 HH TYR B 7 7.332 12.572 5.839 1.00 0.00 H new ATOM 1354 N SER B 8 9.541 10.301 14.136 1.00 0.00 N ATOM 1355 CA SER B 8 10.212 9.307 14.952 1.00 0.00 C ATOM 1356 C SER B 8 10.214 7.966 14.225 1.00 0.00 C ATOM 1357 O SER B 8 9.152 7.419 13.928 1.00 0.00 O ATOM 1358 CB SER B 8 9.519 9.177 16.307 1.00 0.00 C ATOM 1359 OG SER B 8 9.415 10.436 16.952 1.00 0.00 O ATOM 0 H SER B 8 8.562 10.459 14.375 1.00 0.00 H new ATOM 0 HA SER B 8 11.242 9.621 15.123 1.00 0.00 H new ATOM 0 HB2 SER B 8 8.525 8.752 16.171 1.00 0.00 H new ATOM 0 HB3 SER B 8 10.077 8.486 16.939 1.00 0.00 H new ATOM 0 HG SER B 8 8.966 10.325 17.816 1.00 0.00 H new ATOM 1365 N ASN B 9 11.407 7.456 13.929 1.00 0.00 N ATOM 1366 CA ASN B 9 11.567 6.193 13.201 1.00 0.00 C ATOM 1367 C ASN B 9 10.791 5.063 13.865 1.00 0.00 C ATOM 1368 O ASN B 9 10.112 4.285 13.193 1.00 0.00 O ATOM 1369 CB ASN B 9 13.046 5.800 13.106 1.00 0.00 C ATOM 1370 CG ASN B 9 13.849 6.698 12.184 1.00 0.00 C ATOM 1371 OD1 ASN B 9 13.570 7.889 12.045 1.00 0.00 O ATOM 1372 ND2 ASN B 9 14.859 6.128 11.549 1.00 0.00 N ATOM 0 H ASN B 9 12.288 7.902 14.184 1.00 0.00 H new ATOM 0 HA ASN B 9 11.169 6.351 12.199 1.00 0.00 H new ATOM 0 HB2 ASN B 9 13.487 5.828 14.103 1.00 0.00 H new ATOM 0 HB3 ASN B 9 13.119 4.771 12.754 1.00 0.00 H new ATOM 0 HD21 ASN B 9 15.440 6.679 10.917 1.00 0.00 H new ATOM 0 HD22 ASN B 9 15.057 5.138 11.692 1.00 0.00 H new ATOM 1379 N GLU B 10 10.884 4.989 15.190 1.00 0.00 N ATOM 1380 CA GLU B 10 10.187 3.960 15.956 1.00 0.00 C ATOM 1381 C GLU B 10 8.680 4.029 15.717 1.00 0.00 C ATOM 1382 O GLU B 10 8.001 3.004 15.667 1.00 0.00 O ATOM 1383 CB GLU B 10 10.497 4.105 17.449 1.00 0.00 C ATOM 1384 CG GLU B 10 10.189 5.484 18.014 1.00 0.00 C ATOM 1385 CD GLU B 10 10.584 5.616 19.467 1.00 0.00 C ATOM 1386 OE1 GLU B 10 11.764 5.910 19.740 1.00 0.00 O ATOM 1387 OE2 GLU B 10 9.716 5.432 20.345 1.00 0.00 O ATOM 0 H GLU B 10 11.437 5.632 15.757 1.00 0.00 H new ATOM 0 HA GLU B 10 10.541 2.986 15.618 1.00 0.00 H new ATOM 0 HB2 GLU B 10 9.924 3.361 18.002 1.00 0.00 H new ATOM 0 HB3 GLU B 10 11.551 3.883 17.614 1.00 0.00 H new ATOM 0 HG2 GLU B 10 10.714 6.239 17.428 1.00 0.00 H new ATOM 0 HG3 GLU B 10 9.123 5.685 17.911 1.00 0.00 H new ATOM 1394 N ARG B 11 8.170 5.242 15.546 1.00 0.00 N ATOM 1395 CA ARG B 11 6.751 5.449 15.307 1.00 0.00 C ATOM 1396 C ARG B 11 6.387 5.050 13.885 1.00 0.00 C ATOM 1397 O ARG B 11 5.342 4.446 13.651 1.00 0.00 O ATOM 1398 CB ARG B 11 6.375 6.911 15.554 1.00 0.00 C ATOM 1399 CG ARG B 11 4.897 7.198 15.358 1.00 0.00 C ATOM 1400 CD ARG B 11 4.577 8.661 15.606 1.00 0.00 C ATOM 1401 NE ARG B 11 3.143 8.920 15.541 1.00 0.00 N ATOM 1402 CZ ARG B 11 2.588 10.115 15.724 1.00 0.00 C ATOM 1403 NH1 ARG B 11 3.339 11.178 15.991 1.00 0.00 N ATOM 1404 NH2 ARG B 11 1.271 10.236 15.650 1.00 0.00 N ATOM 0 H ARG B 11 8.722 6.099 15.569 1.00 0.00 H new ATOM 0 HA ARG B 11 6.192 4.821 16.001 1.00 0.00 H new ATOM 0 HB2 ARG B 11 6.658 7.184 16.571 1.00 0.00 H new ATOM 0 HB3 ARG B 11 6.952 7.545 14.881 1.00 0.00 H new ATOM 0 HG2 ARG B 11 4.604 6.927 14.344 1.00 0.00 H new ATOM 0 HG3 ARG B 11 4.312 6.576 16.035 1.00 0.00 H new ATOM 0 HD2 ARG B 11 4.956 8.955 16.585 1.00 0.00 H new ATOM 0 HD3 ARG B 11 5.091 9.276 14.867 1.00 0.00 H new ATOM 0 HE ARG B 11 2.525 8.133 15.342 1.00 0.00 H new ATOM 0 HH11 ARG B 11 4.352 11.083 16.058 1.00 0.00 H new ATOM 0 HH12 ARG B 11 2.902 12.089 16.129 1.00 0.00 H new ATOM 0 HH21 ARG B 11 0.694 9.418 15.455 1.00 0.00 H new ATOM 0 HH22 ARG B 11 0.834 11.147 15.789 1.00 0.00 H new ATOM 1418 N VAL B 12 7.265 5.383 12.943 1.00 0.00 N ATOM 1419 CA VAL B 12 7.063 5.033 11.539 1.00 0.00 C ATOM 1420 C VAL B 12 6.869 3.530 11.386 1.00 0.00 C ATOM 1421 O VAL B 12 5.896 3.072 10.788 1.00 0.00 O ATOM 1422 CB VAL B 12 8.258 5.475 10.666 1.00 0.00 C ATOM 1423 CG1 VAL B 12 8.040 5.083 9.211 1.00 0.00 C ATOM 1424 CG2 VAL B 12 8.489 6.975 10.784 1.00 0.00 C ATOM 0 H VAL B 12 8.127 5.897 13.127 1.00 0.00 H new ATOM 0 HA VAL B 12 6.169 5.558 11.203 1.00 0.00 H new ATOM 0 HB VAL B 12 9.148 4.961 11.030 1.00 0.00 H new ATOM 0 HG11 VAL B 12 8.894 5.405 8.616 1.00 0.00 H new ATOM 0 HG12 VAL B 12 7.933 4.001 9.138 1.00 0.00 H new ATOM 0 HG13 VAL B 12 7.136 5.563 8.837 1.00 0.00 H new ATOM 0 HG21 VAL B 12 9.335 7.263 10.161 1.00 0.00 H new ATOM 0 HG22 VAL B 12 7.597 7.508 10.454 1.00 0.00 H new ATOM 0 HG23 VAL B 12 8.700 7.230 11.823 1.00 0.00 H new ATOM 1434 N GLU B 13 7.792 2.767 11.958 1.00 0.00 N ATOM 1435 CA GLU B 13 7.732 1.316 11.884 1.00 0.00 C ATOM 1436 C GLU B 13 6.527 0.783 12.652 1.00 0.00 C ATOM 1437 O GLU B 13 5.969 -0.253 12.300 1.00 0.00 O ATOM 1438 CB GLU B 13 9.021 0.700 12.425 1.00 0.00 C ATOM 1439 CG GLU B 13 10.261 1.158 11.679 1.00 0.00 C ATOM 1440 CD GLU B 13 11.514 0.467 12.159 1.00 0.00 C ATOM 1441 OE1 GLU B 13 11.973 0.764 13.283 1.00 0.00 O ATOM 1442 OE2 GLU B 13 12.050 -0.383 11.418 1.00 0.00 O ATOM 0 H GLU B 13 8.591 3.131 12.478 1.00 0.00 H new ATOM 0 HA GLU B 13 7.623 1.034 10.837 1.00 0.00 H new ATOM 0 HB2 GLU B 13 9.124 0.956 13.479 1.00 0.00 H new ATOM 0 HB3 GLU B 13 8.950 -0.386 12.366 1.00 0.00 H new ATOM 0 HG2 GLU B 13 10.131 0.968 10.614 1.00 0.00 H new ATOM 0 HG3 GLU B 13 10.376 2.235 11.799 1.00 0.00 H new ATOM 1449 N LYS B 14 6.123 1.502 13.696 1.00 0.00 N ATOM 1450 CA LYS B 14 4.944 1.123 14.465 1.00 0.00 C ATOM 1451 C LYS B 14 3.702 1.189 13.584 1.00 0.00 C ATOM 1452 O LYS B 14 2.844 0.311 13.638 1.00 0.00 O ATOM 1453 CB LYS B 14 4.763 2.043 15.674 1.00 0.00 C ATOM 1454 CG LYS B 14 3.741 1.530 16.676 1.00 0.00 C ATOM 1455 CD LYS B 14 3.260 2.634 17.603 1.00 0.00 C ATOM 1456 CE LYS B 14 2.306 3.583 16.892 1.00 0.00 C ATOM 1457 NZ LYS B 14 1.005 2.929 16.588 1.00 0.00 N ATOM 0 H LYS B 14 6.592 2.345 14.026 1.00 0.00 H new ATOM 0 HA LYS B 14 5.084 0.102 14.821 1.00 0.00 H new ATOM 0 HB2 LYS B 14 5.723 2.165 16.176 1.00 0.00 H new ATOM 0 HB3 LYS B 14 4.457 3.030 15.327 1.00 0.00 H new ATOM 0 HG2 LYS B 14 2.890 1.106 16.143 1.00 0.00 H new ATOM 0 HG3 LYS B 14 4.181 0.726 17.266 1.00 0.00 H new ATOM 0 HD2 LYS B 14 2.761 2.194 18.466 1.00 0.00 H new ATOM 0 HD3 LYS B 14 4.117 3.193 17.980 1.00 0.00 H new ATOM 0 HE2 LYS B 14 2.135 4.461 17.514 1.00 0.00 H new ATOM 0 HE3 LYS B 14 2.763 3.932 15.966 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 0.292 3.656 16.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 1.116 2.301 15.766 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 0.696 2.372 17.410 1.00 0.00 H new ATOM 1471 N ILE B 15 3.622 2.234 12.769 1.00 0.00 N ATOM 1472 CA ILE B 15 2.508 2.403 11.844 1.00 0.00 C ATOM 1473 C ILE B 15 2.515 1.284 10.806 1.00 0.00 C ATOM 1474 O ILE B 15 1.480 0.681 10.519 1.00 0.00 O ATOM 1475 CB ILE B 15 2.566 3.772 11.132 1.00 0.00 C ATOM 1476 CG1 ILE B 15 2.564 4.908 12.162 1.00 0.00 C ATOM 1477 CG2 ILE B 15 1.393 3.924 10.171 1.00 0.00 C ATOM 1478 CD1 ILE B 15 2.742 6.281 11.552 1.00 0.00 C ATOM 0 H ILE B 15 4.318 2.979 12.730 1.00 0.00 H new ATOM 0 HA ILE B 15 1.586 2.360 12.423 1.00 0.00 H new ATOM 0 HB ILE B 15 3.491 3.825 10.558 1.00 0.00 H new ATOM 0 HG12 ILE B 15 1.625 4.884 12.714 1.00 0.00 H new ATOM 0 HG13 ILE B 15 3.362 4.734 12.883 1.00 0.00 H new ATOM 0 HG21 ILE B 15 1.450 4.895 9.678 1.00 0.00 H new ATOM 0 HG22 ILE B 15 1.432 3.134 9.422 1.00 0.00 H new ATOM 0 HG23 ILE B 15 0.457 3.853 10.725 1.00 0.00 H new ATOM 0 HD11 ILE B 15 2.730 7.034 12.340 1.00 0.00 H new ATOM 0 HD12 ILE B 15 3.694 6.324 11.024 1.00 0.00 H new ATOM 0 HD13 ILE B 15 1.930 6.476 10.852 1.00 0.00 H new ATOM 1490 N ILE B 16 3.697 0.997 10.267 1.00 0.00 N ATOM 1491 CA ILE B 16 3.866 -0.092 9.310 1.00 0.00 C ATOM 1492 C ILE B 16 3.426 -1.415 9.929 1.00 0.00 C ATOM 1493 O ILE B 16 2.702 -2.199 9.310 1.00 0.00 O ATOM 1494 CB ILE B 16 5.334 -0.213 8.850 1.00 0.00 C ATOM 1495 CG1 ILE B 16 5.820 1.114 8.261 1.00 0.00 C ATOM 1496 CG2 ILE B 16 5.482 -1.336 7.831 1.00 0.00 C ATOM 1497 CD1 ILE B 16 7.301 1.139 7.954 1.00 0.00 C ATOM 0 H ILE B 16 4.555 1.506 10.478 1.00 0.00 H new ATOM 0 HA ILE B 16 3.245 0.135 8.443 1.00 0.00 H new ATOM 0 HB ILE B 16 5.950 -0.452 9.717 1.00 0.00 H new ATOM 0 HG12 ILE B 16 5.265 1.320 7.346 1.00 0.00 H new ATOM 0 HG13 ILE B 16 5.590 1.917 8.961 1.00 0.00 H new ATOM 0 HG21 ILE B 16 6.523 -1.408 7.517 1.00 0.00 H new ATOM 0 HG22 ILE B 16 5.173 -2.279 8.282 1.00 0.00 H new ATOM 0 HG23 ILE B 16 4.855 -1.126 6.964 1.00 0.00 H new ATOM 0 HD11 ILE B 16 7.570 2.111 7.540 1.00 0.00 H new ATOM 0 HD12 ILE B 16 7.865 0.966 8.870 1.00 0.00 H new ATOM 0 HD13 ILE B 16 7.536 0.359 7.230 1.00 0.00 H new ATOM 1509 N GLN B 17 3.856 -1.645 11.165 1.00 0.00 N ATOM 1510 CA GLN B 17 3.521 -2.868 11.882 1.00 0.00 C ATOM 1511 C GLN B 17 2.019 -2.930 12.153 1.00 0.00 C ATOM 1512 O GLN B 17 1.415 -3.996 12.074 1.00 0.00 O ATOM 1513 CB GLN B 17 4.314 -2.945 13.197 1.00 0.00 C ATOM 1514 CG GLN B 17 4.464 -4.359 13.756 1.00 0.00 C ATOM 1515 CD GLN B 17 3.190 -4.908 14.372 1.00 0.00 C ATOM 1516 OE1 GLN B 17 2.389 -4.169 14.949 1.00 0.00 O ATOM 1517 NE2 GLN B 17 2.988 -6.208 14.246 1.00 0.00 N ATOM 0 H GLN B 17 4.440 -0.996 11.693 1.00 0.00 H new ATOM 0 HA GLN B 17 3.793 -3.724 11.264 1.00 0.00 H new ATOM 0 HB2 GLN B 17 5.306 -2.523 13.035 1.00 0.00 H new ATOM 0 HB3 GLN B 17 3.820 -2.322 13.943 1.00 0.00 H new ATOM 0 HG2 GLN B 17 4.787 -5.025 12.955 1.00 0.00 H new ATOM 0 HG3 GLN B 17 5.252 -4.361 14.509 1.00 0.00 H new ATOM 0 HE21 GLN B 17 3.675 -6.786 13.762 1.00 0.00 H new ATOM 0 HE22 GLN B 17 2.146 -6.633 14.633 1.00 0.00 H new ATOM 1526 N ASP B 18 1.417 -1.782 12.456 1.00 0.00 N ATOM 1527 CA ASP B 18 -0.016 -1.721 12.738 1.00 0.00 C ATOM 1528 C ASP B 18 -0.812 -2.118 11.502 1.00 0.00 C ATOM 1529 O ASP B 18 -1.798 -2.850 11.594 1.00 0.00 O ATOM 1530 CB ASP B 18 -0.425 -0.319 13.199 1.00 0.00 C ATOM 1531 CG ASP B 18 -1.650 -0.341 14.091 1.00 0.00 C ATOM 1532 OD1 ASP B 18 -2.781 -0.329 13.572 1.00 0.00 O ATOM 1533 OD2 ASP B 18 -1.475 -0.370 15.330 1.00 0.00 O ATOM 0 H ASP B 18 1.897 -0.884 12.513 1.00 0.00 H new ATOM 0 HA ASP B 18 -0.234 -2.423 13.543 1.00 0.00 H new ATOM 0 HB2 ASP B 18 0.405 0.141 13.736 1.00 0.00 H new ATOM 0 HB3 ASP B 18 -0.624 0.304 12.327 1.00 0.00 H new ATOM 1538 N LEU B 19 -0.362 -1.649 10.343 1.00 0.00 N ATOM 1539 CA LEU B 19 -0.969 -2.035 9.075 1.00 0.00 C ATOM 1540 C LEU B 19 -0.860 -3.545 8.886 1.00 0.00 C ATOM 1541 O LEU B 19 -1.806 -4.204 8.452 1.00 0.00 O ATOM 1542 CB LEU B 19 -0.290 -1.308 7.910 1.00 0.00 C ATOM 1543 CG LEU B 19 -0.353 0.221 7.967 1.00 0.00 C ATOM 1544 CD1 LEU B 19 0.443 0.828 6.824 1.00 0.00 C ATOM 1545 CD2 LEU B 19 -1.797 0.705 7.927 1.00 0.00 C ATOM 0 H LEU B 19 0.421 -1.001 10.256 1.00 0.00 H new ATOM 0 HA LEU B 19 -2.021 -1.752 9.091 1.00 0.00 H new ATOM 0 HB2 LEU B 19 0.756 -1.611 7.875 1.00 0.00 H new ATOM 0 HB3 LEU B 19 -0.750 -1.640 6.979 1.00 0.00 H new ATOM 0 HG LEU B 19 0.089 0.546 8.909 1.00 0.00 H new ATOM 0 HD11 LEU B 19 0.388 1.915 6.879 1.00 0.00 H new ATOM 0 HD12 LEU B 19 1.484 0.513 6.898 1.00 0.00 H new ATOM 0 HD13 LEU B 19 0.029 0.492 5.873 1.00 0.00 H new ATOM 0 HD21 LEU B 19 -1.817 1.794 7.969 1.00 0.00 H new ATOM 0 HD22 LEU B 19 -2.268 0.368 7.003 1.00 0.00 H new ATOM 0 HD23 LEU B 19 -2.340 0.299 8.780 1.00 0.00 H new ATOM 1557 N LEU B 20 0.303 -4.085 9.239 1.00 0.00 N ATOM 1558 CA LEU B 20 0.536 -5.523 9.180 1.00 0.00 C ATOM 1559 C LEU B 20 -0.396 -6.262 10.134 1.00 0.00 C ATOM 1560 O LEU B 20 -0.950 -7.304 9.788 1.00 0.00 O ATOM 1561 CB LEU B 20 1.990 -5.844 9.532 1.00 0.00 C ATOM 1562 CG LEU B 20 3.034 -5.355 8.526 1.00 0.00 C ATOM 1563 CD1 LEU B 20 4.435 -5.690 9.011 1.00 0.00 C ATOM 1564 CD2 LEU B 20 2.785 -5.966 7.155 1.00 0.00 C ATOM 0 H LEU B 20 1.102 -3.544 9.570 1.00 0.00 H new ATOM 0 HA LEU B 20 0.332 -5.855 8.162 1.00 0.00 H new ATOM 0 HB2 LEU B 20 2.215 -5.407 10.505 1.00 0.00 H new ATOM 0 HB3 LEU B 20 2.090 -6.924 9.637 1.00 0.00 H new ATOM 0 HG LEU B 20 2.947 -4.272 8.439 1.00 0.00 H new ATOM 0 HD11 LEU B 20 5.166 -5.336 8.284 1.00 0.00 H new ATOM 0 HD12 LEU B 20 4.613 -5.205 9.971 1.00 0.00 H new ATOM 0 HD13 LEU B 20 4.532 -6.770 9.126 1.00 0.00 H new ATOM 0 HD21 LEU B 20 3.538 -5.606 6.454 1.00 0.00 H new ATOM 0 HD22 LEU B 20 2.844 -7.052 7.225 1.00 0.00 H new ATOM 0 HD23 LEU B 20 1.794 -5.678 6.803 1.00 0.00 H new ATOM 1576 N ASP B 21 -0.569 -5.710 11.331 1.00 0.00 N ATOM 1577 CA ASP B 21 -1.428 -6.314 12.345 1.00 0.00 C ATOM 1578 C ASP B 21 -2.862 -6.415 11.850 1.00 0.00 C ATOM 1579 O ASP B 21 -3.522 -7.422 12.065 1.00 0.00 O ATOM 1580 CB ASP B 21 -1.393 -5.515 13.645 1.00 0.00 C ATOM 1581 CG ASP B 21 -2.231 -6.163 14.731 1.00 0.00 C ATOM 1582 OD1 ASP B 21 -1.742 -7.116 15.371 1.00 0.00 O ATOM 1583 OD2 ASP B 21 -3.380 -5.725 14.953 1.00 0.00 O ATOM 0 H ASP B 21 -0.123 -4.841 11.624 1.00 0.00 H new ATOM 0 HA ASP B 21 -1.046 -7.316 12.539 1.00 0.00 H new ATOM 0 HB2 ASP B 21 -0.362 -5.424 13.988 1.00 0.00 H new ATOM 0 HB3 ASP B 21 -1.757 -4.505 13.460 1.00 0.00 H new ATOM 1588 N VAL B 22 -3.336 -5.367 11.184 1.00 0.00 N ATOM 1589 CA VAL B 22 -4.678 -5.374 10.608 1.00 0.00 C ATOM 1590 C VAL B 22 -4.815 -6.510 9.594 1.00 0.00 C ATOM 1591 O VAL B 22 -5.829 -7.210 9.557 1.00 0.00 O ATOM 1592 CB VAL B 22 -5.014 -4.027 9.925 1.00 0.00 C ATOM 1593 CG1 VAL B 22 -6.386 -4.080 9.264 1.00 0.00 C ATOM 1594 CG2 VAL B 22 -4.957 -2.887 10.934 1.00 0.00 C ATOM 0 H VAL B 22 -2.814 -4.505 11.030 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.383 -5.526 11.426 1.00 0.00 H new ATOM 0 HB VAL B 22 -4.268 -3.846 9.151 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -6.599 -3.121 8.791 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -6.396 -4.867 8.510 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.145 -4.289 10.018 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -5.196 -1.948 10.436 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.679 -3.069 11.730 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -3.955 -2.827 11.359 1.00 0.00 H new ATOM 1604 N LEU B 23 -3.774 -6.707 8.795 1.00 0.00 N ATOM 1605 CA LEU B 23 -3.772 -7.756 7.783 1.00 0.00 C ATOM 1606 C LEU B 23 -3.743 -9.143 8.428 1.00 0.00 C ATOM 1607 O LEU B 23 -4.454 -10.052 7.998 1.00 0.00 O ATOM 1608 CB LEU B 23 -2.574 -7.584 6.843 1.00 0.00 C ATOM 1609 CG LEU B 23 -2.506 -6.236 6.119 1.00 0.00 C ATOM 1610 CD1 LEU B 23 -1.262 -6.155 5.251 1.00 0.00 C ATOM 1611 CD2 LEU B 23 -3.757 -6.012 5.284 1.00 0.00 C ATOM 0 H LEU B 23 -2.918 -6.153 8.828 1.00 0.00 H new ATOM 0 HA LEU B 23 -4.692 -7.670 7.205 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -1.658 -7.716 7.419 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -2.600 -8.379 6.097 1.00 0.00 H new ATOM 0 HG LEU B 23 -2.450 -5.448 6.870 1.00 0.00 H new ATOM 0 HD11 LEU B 23 -1.233 -5.190 4.746 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.375 -6.265 5.875 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -1.284 -6.953 4.508 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -3.689 -5.049 4.778 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -3.847 -6.806 4.543 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -4.633 -6.020 5.932 1.00 0.00 H new ATOM 1623 N VAL B 24 -2.925 -9.297 9.465 1.00 0.00 N ATOM 1624 CA VAL B 24 -2.825 -10.564 10.188 1.00 0.00 C ATOM 1625 C VAL B 24 -4.103 -10.837 10.979 1.00 0.00 C ATOM 1626 O VAL B 24 -4.531 -11.984 11.112 1.00 0.00 O ATOM 1627 CB VAL B 24 -1.607 -10.570 11.141 1.00 0.00 C ATOM 1628 CG1 VAL B 24 -1.541 -11.862 11.941 1.00 0.00 C ATOM 1629 CG2 VAL B 24 -0.319 -10.374 10.360 1.00 0.00 C ATOM 0 H VAL B 24 -2.320 -8.559 9.825 1.00 0.00 H new ATOM 0 HA VAL B 24 -2.689 -11.354 9.449 1.00 0.00 H new ATOM 0 HB VAL B 24 -1.727 -9.742 11.840 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -0.675 -11.837 12.602 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -2.448 -11.968 12.536 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -1.453 -12.708 11.259 1.00 0.00 H new ATOM 0 HG21 VAL B 24 0.528 -10.381 11.047 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -0.206 -11.181 9.636 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -0.353 -9.419 9.836 1.00 0.00 H new ATOM 1639 N LYS B 25 -4.706 -9.773 11.489 1.00 0.00 N ATOM 1640 CA LYS B 25 -5.967 -9.860 12.220 1.00 0.00 C ATOM 1641 C LYS B 25 -7.035 -10.543 11.376 1.00 0.00 C ATOM 1642 O LYS B 25 -7.773 -11.401 11.857 1.00 0.00 O ATOM 1643 CB LYS B 25 -6.437 -8.456 12.619 1.00 0.00 C ATOM 1644 CG LYS B 25 -7.785 -8.426 13.326 1.00 0.00 C ATOM 1645 CD LYS B 25 -8.223 -7.003 13.644 1.00 0.00 C ATOM 1646 CE LYS B 25 -8.430 -6.176 12.382 1.00 0.00 C ATOM 1647 NZ LYS B 25 -8.793 -4.770 12.701 1.00 0.00 N ATOM 0 H LYS B 25 -4.338 -8.825 11.409 1.00 0.00 H new ATOM 0 HA LYS B 25 -5.804 -10.455 13.118 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -5.688 -8.006 13.270 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -6.495 -7.837 11.724 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -8.536 -8.906 12.698 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -7.725 -9.003 14.249 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -9.150 -7.028 14.217 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -7.472 -6.524 14.273 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -7.519 -6.190 11.784 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -9.216 -6.627 11.776 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -8.646 -4.174 11.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -9.792 -4.726 12.987 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -8.195 -4.425 13.479 1.00 0.00 H new ATOM 1661 N GLU B 26 -7.095 -10.169 10.109 1.00 0.00 N ATOM 1662 CA GLU B 26 -8.095 -10.712 9.208 1.00 0.00 C ATOM 1663 C GLU B 26 -7.587 -11.961 8.490 1.00 0.00 C ATOM 1664 O GLU B 26 -8.372 -12.690 7.882 1.00 0.00 O ATOM 1665 CB GLU B 26 -8.508 -9.655 8.186 1.00 0.00 C ATOM 1666 CG GLU B 26 -9.208 -8.455 8.804 1.00 0.00 C ATOM 1667 CD GLU B 26 -10.393 -8.862 9.652 1.00 0.00 C ATOM 1668 OE1 GLU B 26 -11.261 -9.611 9.148 1.00 0.00 O ATOM 1669 OE2 GLU B 26 -10.451 -8.454 10.828 1.00 0.00 O ATOM 0 H GLU B 26 -6.463 -9.492 9.682 1.00 0.00 H new ATOM 0 HA GLU B 26 -8.961 -10.998 9.805 1.00 0.00 H new ATOM 0 HB2 GLU B 26 -7.622 -9.313 7.651 1.00 0.00 H new ATOM 0 HB3 GLU B 26 -9.169 -10.112 7.450 1.00 0.00 H new ATOM 0 HG2 GLU B 26 -8.499 -7.898 9.416 1.00 0.00 H new ATOM 0 HG3 GLU B 26 -9.542 -7.784 8.013 1.00 0.00 H new ATOM 1676 N GLU B 27 -6.278 -12.205 8.581 1.00 0.00 N ATOM 1677 CA GLU B 27 -5.634 -13.304 7.859 1.00 0.00 C ATOM 1678 C GLU B 27 -5.877 -13.151 6.361 1.00 0.00 C ATOM 1679 O GLU B 27 -6.248 -14.107 5.677 1.00 0.00 O ATOM 1680 CB GLU B 27 -6.153 -14.662 8.338 1.00 0.00 C ATOM 1681 CG GLU B 27 -5.907 -14.938 9.811 1.00 0.00 C ATOM 1682 CD GLU B 27 -6.412 -16.302 10.226 1.00 0.00 C ATOM 1683 OE1 GLU B 27 -7.640 -16.458 10.397 1.00 0.00 O ATOM 1684 OE2 GLU B 27 -5.588 -17.231 10.352 1.00 0.00 O ATOM 0 H GLU B 27 -5.639 -11.652 9.152 1.00 0.00 H new ATOM 0 HA GLU B 27 -4.563 -13.263 8.060 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -7.224 -14.718 8.143 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -5.680 -15.448 7.749 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -4.839 -14.868 10.019 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -6.399 -14.172 10.410 1.00 0.00 H new ATOM 1691 N VAL B 28 -5.655 -11.942 5.863 1.00 0.00 N ATOM 1692 CA VAL B 28 -5.948 -11.621 4.473 1.00 0.00 C ATOM 1693 C VAL B 28 -4.980 -12.305 3.513 1.00 0.00 C ATOM 1694 O VAL B 28 -3.816 -12.541 3.837 1.00 0.00 O ATOM 1695 CB VAL B 28 -5.914 -10.098 4.214 1.00 0.00 C ATOM 1696 CG1 VAL B 28 -6.942 -9.387 5.075 1.00 0.00 C ATOM 1697 CG2 VAL B 28 -4.524 -9.534 4.463 1.00 0.00 C ATOM 0 H VAL B 28 -5.272 -11.166 6.403 1.00 0.00 H new ATOM 0 HA VAL B 28 -6.956 -11.993 4.288 1.00 0.00 H new ATOM 0 HB VAL B 28 -6.164 -9.928 3.167 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -6.903 -8.316 4.878 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.937 -9.763 4.839 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -6.725 -9.571 6.127 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -4.528 -8.461 4.274 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -4.236 -9.719 5.498 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -3.810 -10.018 3.796 1.00 0.00 H new ATOM 1707 N THR B 29 -5.488 -12.634 2.340 1.00 0.00 N ATOM 1708 CA THR B 29 -4.671 -13.177 1.270 1.00 0.00 C ATOM 1709 C THR B 29 -4.023 -12.031 0.486 1.00 0.00 C ATOM 1710 O THR B 29 -4.596 -10.943 0.402 1.00 0.00 O ATOM 1711 CB THR B 29 -5.534 -14.061 0.337 1.00 0.00 C ATOM 1712 OG1 THR B 29 -4.783 -14.513 -0.798 1.00 0.00 O ATOM 1713 CG2 THR B 29 -6.764 -13.305 -0.135 1.00 0.00 C ATOM 0 H THR B 29 -6.475 -12.533 2.102 1.00 0.00 H new ATOM 0 HA THR B 29 -3.884 -13.799 1.696 1.00 0.00 H new ATOM 0 HB THR B 29 -5.847 -14.931 0.914 1.00 0.00 H new ATOM 0 HG1 THR B 29 -5.354 -15.070 -1.367 1.00 0.00 H new ATOM 0 HG21 THR B 29 -7.356 -13.945 -0.789 1.00 0.00 H new ATOM 0 HG22 THR B 29 -7.364 -13.013 0.727 1.00 0.00 H new ATOM 0 HG23 THR B 29 -6.456 -12.414 -0.682 1.00 0.00 H new ATOM 1721 N PRO B 30 -2.804 -12.245 -0.055 1.00 0.00 N ATOM 1722 CA PRO B 30 -2.069 -11.238 -0.837 1.00 0.00 C ATOM 1723 C PRO B 30 -2.950 -10.444 -1.805 1.00 0.00 C ATOM 1724 O PRO B 30 -2.861 -9.220 -1.861 1.00 0.00 O ATOM 1725 CB PRO B 30 -1.060 -12.086 -1.605 1.00 0.00 C ATOM 1726 CG PRO B 30 -0.751 -13.209 -0.677 1.00 0.00 C ATOM 1727 CD PRO B 30 -2.024 -13.494 0.080 1.00 0.00 C ATOM 0 HA PRO B 30 -1.631 -10.473 -0.196 1.00 0.00 H new ATOM 0 HB2 PRO B 30 -1.477 -12.448 -2.545 1.00 0.00 H new ATOM 0 HB3 PRO B 30 -0.165 -11.515 -1.852 1.00 0.00 H new ATOM 0 HG2 PRO B 30 -0.421 -14.089 -1.228 1.00 0.00 H new ATOM 0 HG3 PRO B 30 0.055 -12.939 0.005 1.00 0.00 H new ATOM 0 HD2 PRO B 30 -2.557 -14.346 -0.342 1.00 0.00 H new ATOM 0 HD3 PRO B 30 -1.823 -13.729 1.125 1.00 0.00 H new ATOM 1735 N ASP B 31 -3.801 -11.144 -2.550 1.00 0.00 N ATOM 1736 CA ASP B 31 -4.702 -10.501 -3.511 1.00 0.00 C ATOM 1737 C ASP B 31 -5.603 -9.478 -2.817 1.00 0.00 C ATOM 1738 O ASP B 31 -5.723 -8.332 -3.257 1.00 0.00 O ATOM 1739 CB ASP B 31 -5.554 -11.558 -4.221 1.00 0.00 C ATOM 1740 CG ASP B 31 -6.618 -10.964 -5.131 1.00 0.00 C ATOM 1741 OD1 ASP B 31 -7.692 -10.585 -4.623 1.00 0.00 O ATOM 1742 OD2 ASP B 31 -6.402 -10.907 -6.359 1.00 0.00 O ATOM 0 H ASP B 31 -3.888 -12.159 -2.509 1.00 0.00 H new ATOM 0 HA ASP B 31 -4.096 -9.976 -4.249 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -4.902 -12.204 -4.809 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -6.036 -12.188 -3.473 1.00 0.00 H new ATOM 1747 N LEU B 32 -6.215 -9.902 -1.714 1.00 0.00 N ATOM 1748 CA LEU B 32 -7.108 -9.048 -0.940 1.00 0.00 C ATOM 1749 C LEU B 32 -6.336 -7.892 -0.316 1.00 0.00 C ATOM 1750 O LEU B 32 -6.816 -6.758 -0.275 1.00 0.00 O ATOM 1751 CB LEU B 32 -7.801 -9.876 0.150 1.00 0.00 C ATOM 1752 CG LEU B 32 -8.746 -9.103 1.070 1.00 0.00 C ATOM 1753 CD1 LEU B 32 -9.873 -8.467 0.275 1.00 0.00 C ATOM 1754 CD2 LEU B 32 -9.306 -10.026 2.142 1.00 0.00 C ATOM 0 H LEU B 32 -6.106 -10.842 -1.334 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.864 -8.633 -1.607 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -8.365 -10.676 -0.330 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -7.034 -10.350 0.763 1.00 0.00 H new ATOM 0 HG LEU B 32 -8.181 -8.306 1.553 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.533 -7.922 0.951 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -9.456 -7.778 -0.459 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -10.440 -9.244 -0.238 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -9.978 -9.464 2.791 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -9.855 -10.841 1.670 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -8.487 -10.435 2.734 1.00 0.00 H new ATOM 1766 N ALA B 33 -5.130 -8.189 0.150 1.00 0.00 N ATOM 1767 CA ALA B 33 -4.275 -7.187 0.763 1.00 0.00 C ATOM 1768 C ALA B 33 -3.932 -6.082 -0.230 1.00 0.00 C ATOM 1769 O ALA B 33 -4.116 -4.902 0.062 1.00 0.00 O ATOM 1770 CB ALA B 33 -3.005 -7.829 1.300 1.00 0.00 C ATOM 0 H ALA B 33 -4.722 -9.123 0.113 1.00 0.00 H new ATOM 0 HA ALA B 33 -4.820 -6.740 1.595 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -2.376 -7.065 1.756 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -3.264 -8.579 2.047 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -2.464 -8.304 0.482 1.00 0.00 H new ATOM 1776 N LEU B 34 -3.458 -6.474 -1.409 1.00 0.00 N ATOM 1777 CA LEU B 34 -3.045 -5.517 -2.433 1.00 0.00 C ATOM 1778 C LEU B 34 -4.194 -4.600 -2.839 1.00 0.00 C ATOM 1779 O LEU B 34 -4.011 -3.392 -2.989 1.00 0.00 O ATOM 1780 CB LEU B 34 -2.507 -6.251 -3.665 1.00 0.00 C ATOM 1781 CG LEU B 34 -1.238 -7.075 -3.433 1.00 0.00 C ATOM 1782 CD1 LEU B 34 -0.817 -7.776 -4.715 1.00 0.00 C ATOM 1783 CD2 LEU B 34 -0.112 -6.190 -2.914 1.00 0.00 C ATOM 0 H LEU B 34 -3.350 -7.451 -1.680 1.00 0.00 H new ATOM 0 HA LEU B 34 -2.254 -4.901 -2.006 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -3.286 -6.913 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -2.306 -5.517 -4.446 1.00 0.00 H new ATOM 0 HG LEU B 34 -1.453 -7.833 -2.680 1.00 0.00 H new ATOM 0 HD11 LEU B 34 0.087 -8.357 -4.532 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -1.615 -8.441 -5.045 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -0.620 -7.033 -5.488 1.00 0.00 H new ATOM 0 HD21 LEU B 34 0.782 -6.794 -2.755 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.103 -5.409 -3.643 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -0.413 -5.733 -1.971 1.00 0.00 H new ATOM 1795 N MET B 35 -5.378 -5.178 -3.004 1.00 0.00 N ATOM 1796 CA MET B 35 -6.555 -4.413 -3.405 1.00 0.00 C ATOM 1797 C MET B 35 -6.915 -3.368 -2.350 1.00 0.00 C ATOM 1798 O MET B 35 -7.219 -2.223 -2.680 1.00 0.00 O ATOM 1799 CB MET B 35 -7.736 -5.354 -3.651 1.00 0.00 C ATOM 1800 CG MET B 35 -8.989 -4.649 -4.141 1.00 0.00 C ATOM 1801 SD MET B 35 -10.312 -5.797 -4.576 1.00 0.00 S ATOM 1802 CE MET B 35 -10.542 -6.655 -3.019 1.00 0.00 C ATOM 0 H MET B 35 -5.550 -6.174 -2.867 1.00 0.00 H new ATOM 0 HA MET B 35 -6.323 -3.889 -4.332 1.00 0.00 H new ATOM 0 HB2 MET B 35 -7.443 -6.106 -4.384 1.00 0.00 H new ATOM 0 HB3 MET B 35 -7.966 -5.883 -2.726 1.00 0.00 H new ATOM 0 HG2 MET B 35 -9.344 -3.969 -3.367 1.00 0.00 H new ATOM 0 HG3 MET B 35 -8.742 -4.040 -5.011 1.00 0.00 H new ATOM 0 HE1 MET B 35 -11.510 -7.156 -3.019 1.00 0.00 H new ATOM 0 HE2 MET B 35 -9.751 -7.394 -2.890 1.00 0.00 H new ATOM 0 HE3 MET B 35 -10.505 -5.937 -2.199 1.00 0.00 H new ATOM 1812 N CYS B 36 -6.861 -3.760 -1.084 1.00 0.00 N ATOM 1813 CA CYS B 36 -7.200 -2.854 0.005 1.00 0.00 C ATOM 1814 C CYS B 36 -6.106 -1.807 0.208 1.00 0.00 C ATOM 1815 O CYS B 36 -6.391 -0.611 0.309 1.00 0.00 O ATOM 1816 CB CYS B 36 -7.422 -3.642 1.294 1.00 0.00 C ATOM 1817 SG CYS B 36 -8.689 -4.923 1.153 1.00 0.00 S ATOM 0 H CYS B 36 -6.587 -4.696 -0.786 1.00 0.00 H new ATOM 0 HA CYS B 36 -8.122 -2.335 -0.258 1.00 0.00 H new ATOM 0 HB2 CYS B 36 -6.482 -4.105 1.593 1.00 0.00 H new ATOM 0 HB3 CYS B 36 -7.704 -2.951 2.088 1.00 0.00 H new ATOM 0 HG CYS B 36 -8.203 -5.946 0.515 1.00 0.00 H new ATOM 1823 N LEU B 37 -4.857 -2.259 0.243 1.00 0.00 N ATOM 1824 CA LEU B 37 -3.720 -1.367 0.454 1.00 0.00 C ATOM 1825 C LEU B 37 -3.591 -0.361 -0.686 1.00 0.00 C ATOM 1826 O LEU B 37 -3.455 0.839 -0.449 1.00 0.00 O ATOM 1827 CB LEU B 37 -2.426 -2.177 0.597 1.00 0.00 C ATOM 1828 CG LEU B 37 -2.347 -3.065 1.843 1.00 0.00 C ATOM 1829 CD1 LEU B 37 -1.125 -3.968 1.781 1.00 0.00 C ATOM 1830 CD2 LEU B 37 -2.307 -2.210 3.101 1.00 0.00 C ATOM 0 H LEU B 37 -4.605 -3.241 0.128 1.00 0.00 H new ATOM 0 HA LEU B 37 -3.893 -0.813 1.376 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -2.310 -2.806 -0.286 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -1.583 -1.486 0.609 1.00 0.00 H new ATOM 0 HG LEU B 37 -3.238 -3.692 1.874 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -1.087 -4.591 2.675 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -1.187 -4.604 0.898 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -0.224 -3.357 1.726 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -2.251 -2.855 3.978 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -1.432 -1.561 3.072 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -3.209 -1.601 3.156 1.00 0.00 H new ATOM 1842 N GLY B 38 -3.661 -0.853 -1.920 1.00 0.00 N ATOM 1843 CA GLY B 38 -3.545 0.015 -3.081 1.00 0.00 C ATOM 1844 C GLY B 38 -4.665 1.034 -3.148 1.00 0.00 C ATOM 1845 O GLY B 38 -4.473 2.155 -3.625 1.00 0.00 O ATOM 0 H GLY B 38 -3.796 -1.840 -2.138 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.586 0.533 -3.051 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -3.552 -0.590 -3.987 1.00 0.00 H new ATOM 1849 N ASN B 39 -5.835 0.645 -2.659 1.00 0.00 N ATOM 1850 CA ASN B 39 -6.984 1.537 -2.632 1.00 0.00 C ATOM 1851 C ASN B 39 -6.735 2.666 -1.639 1.00 0.00 C ATOM 1852 O ASN B 39 -7.032 3.830 -1.911 1.00 0.00 O ATOM 1853 CB ASN B 39 -8.248 0.769 -2.245 1.00 0.00 C ATOM 1854 CG ASN B 39 -9.506 1.407 -2.795 1.00 0.00 C ATOM 1855 OD1 ASN B 39 -10.085 2.307 -2.189 1.00 0.00 O ATOM 1856 ND2 ASN B 39 -9.944 0.926 -3.948 1.00 0.00 N ATOM 0 H ASN B 39 -6.012 -0.283 -2.276 1.00 0.00 H new ATOM 0 HA ASN B 39 -7.126 1.958 -3.627 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -8.174 -0.255 -2.612 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -8.318 0.714 -1.159 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -10.794 1.303 -4.368 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -9.432 0.179 -4.416 1.00 0.00 H new ATOM 1863 N ALA B 40 -6.163 2.306 -0.492 1.00 0.00 N ATOM 1864 CA ALA B 40 -5.822 3.277 0.539 1.00 0.00 C ATOM 1865 C ALA B 40 -4.771 4.258 0.034 1.00 0.00 C ATOM 1866 O ALA B 40 -4.887 5.466 0.251 1.00 0.00 O ATOM 1867 CB ALA B 40 -5.334 2.567 1.796 1.00 0.00 C ATOM 0 H ALA B 40 -5.926 1.343 -0.255 1.00 0.00 H new ATOM 0 HA ALA B 40 -6.720 3.843 0.787 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -5.083 3.306 2.557 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -6.120 1.911 2.172 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -4.450 1.975 1.560 1.00 0.00 H new ATOM 1873 N VAL B 41 -3.755 3.735 -0.653 1.00 0.00 N ATOM 1874 CA VAL B 41 -2.713 4.574 -1.242 1.00 0.00 C ATOM 1875 C VAL B 41 -3.331 5.604 -2.181 1.00 0.00 C ATOM 1876 O VAL B 41 -2.991 6.787 -2.132 1.00 0.00 O ATOM 1877 CB VAL B 41 -1.678 3.738 -2.032 1.00 0.00 C ATOM 1878 CG1 VAL B 41 -0.590 4.632 -2.610 1.00 0.00 C ATOM 1879 CG2 VAL B 41 -1.068 2.655 -1.157 1.00 0.00 C ATOM 0 H VAL B 41 -3.632 2.735 -0.815 1.00 0.00 H new ATOM 0 HA VAL B 41 -2.202 5.073 -0.419 1.00 0.00 H new ATOM 0 HB VAL B 41 -2.200 3.253 -2.857 1.00 0.00 H new ATOM 0 HG11 VAL B 41 0.127 4.023 -3.161 1.00 0.00 H new ATOM 0 HG12 VAL B 41 -1.039 5.363 -3.283 1.00 0.00 H new ATOM 0 HG13 VAL B 41 -0.078 5.151 -1.800 1.00 0.00 H new ATOM 0 HG21 VAL B 41 -0.344 2.083 -1.738 1.00 0.00 H new ATOM 0 HG22 VAL B 41 -0.567 3.115 -0.305 1.00 0.00 H new ATOM 0 HG23 VAL B 41 -1.854 1.990 -0.800 1.00 0.00 H new ATOM 1889 N THR B 42 -4.257 5.146 -3.015 1.00 0.00 N ATOM 1890 CA THR B 42 -4.939 6.013 -3.965 1.00 0.00 C ATOM 1891 C THR B 42 -5.674 7.150 -3.249 1.00 0.00 C ATOM 1892 O THR B 42 -5.637 8.302 -3.688 1.00 0.00 O ATOM 1893 CB THR B 42 -5.938 5.208 -4.823 1.00 0.00 C ATOM 1894 OG1 THR B 42 -5.242 4.178 -5.542 1.00 0.00 O ATOM 1895 CG2 THR B 42 -6.673 6.110 -5.806 1.00 0.00 C ATOM 0 H THR B 42 -4.554 4.171 -3.051 1.00 0.00 H new ATOM 0 HA THR B 42 -4.179 6.445 -4.616 1.00 0.00 H new ATOM 0 HB THR B 42 -6.673 4.759 -4.155 1.00 0.00 H new ATOM 0 HG1 THR B 42 -4.965 3.474 -4.919 1.00 0.00 H new ATOM 0 HG21 THR B 42 -7.369 5.514 -6.396 1.00 0.00 H new ATOM 0 HG22 THR B 42 -7.224 6.874 -5.257 1.00 0.00 H new ATOM 0 HG23 THR B 42 -5.953 6.588 -6.469 1.00 0.00 H new ATOM 1903 N ASN B 43 -6.314 6.824 -2.130 1.00 0.00 N ATOM 1904 CA ASN B 43 -7.073 7.810 -1.368 1.00 0.00 C ATOM 1905 C ASN B 43 -6.138 8.849 -0.748 1.00 0.00 C ATOM 1906 O ASN B 43 -6.514 10.004 -0.552 1.00 0.00 O ATOM 1907 CB ASN B 43 -7.903 7.118 -0.280 1.00 0.00 C ATOM 1908 CG ASN B 43 -8.898 8.055 0.384 1.00 0.00 C ATOM 1909 OD1 ASN B 43 -10.020 8.226 -0.097 1.00 0.00 O ATOM 1910 ND2 ASN B 43 -8.511 8.650 1.502 1.00 0.00 N ATOM 0 H ASN B 43 -6.322 5.885 -1.731 1.00 0.00 H new ATOM 0 HA ASN B 43 -7.751 8.324 -2.049 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -8.439 6.276 -0.718 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -7.234 6.710 0.477 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -9.150 9.274 1.995 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -7.574 8.484 1.870 1.00 0.00 H new ATOM 1917 N ILE B 44 -4.914 8.429 -0.449 1.00 0.00 N ATOM 1918 CA ILE B 44 -3.905 9.328 0.100 1.00 0.00 C ATOM 1919 C ILE B 44 -3.356 10.252 -0.986 1.00 0.00 C ATOM 1920 O ILE B 44 -3.257 11.462 -0.791 1.00 0.00 O ATOM 1921 CB ILE B 44 -2.734 8.547 0.744 1.00 0.00 C ATOM 1922 CG1 ILE B 44 -3.240 7.668 1.894 1.00 0.00 C ATOM 1923 CG2 ILE B 44 -1.649 9.499 1.238 1.00 0.00 C ATOM 1924 CD1 ILE B 44 -3.918 8.441 3.009 1.00 0.00 C ATOM 0 H ILE B 44 -4.595 7.469 -0.578 1.00 0.00 H new ATOM 0 HA ILE B 44 -4.393 9.922 0.873 1.00 0.00 H new ATOM 0 HB ILE B 44 -2.298 7.902 -0.019 1.00 0.00 H new ATOM 0 HG12 ILE B 44 -3.941 6.935 1.496 1.00 0.00 H new ATOM 0 HG13 ILE B 44 -2.400 7.112 2.310 1.00 0.00 H new ATOM 0 HG21 ILE B 44 -0.838 8.925 1.686 1.00 0.00 H new ATOM 0 HG22 ILE B 44 -1.263 10.078 0.399 1.00 0.00 H new ATOM 0 HG23 ILE B 44 -2.070 10.175 1.982 1.00 0.00 H new ATOM 0 HD11 ILE B 44 -4.247 7.749 3.784 1.00 0.00 H new ATOM 0 HD12 ILE B 44 -3.215 9.156 3.436 1.00 0.00 H new ATOM 0 HD13 ILE B 44 -4.780 8.975 2.609 1.00 0.00 H new ATOM 1936 N ILE B 45 -3.020 9.672 -2.137 1.00 0.00 N ATOM 1937 CA ILE B 45 -2.460 10.431 -3.257 1.00 0.00 C ATOM 1938 C ILE B 45 -3.439 11.500 -3.745 1.00 0.00 C ATOM 1939 O ILE B 45 -3.036 12.580 -4.182 1.00 0.00 O ATOM 1940 CB ILE B 45 -2.080 9.498 -4.434 1.00 0.00 C ATOM 1941 CG1 ILE B 45 -1.024 8.481 -3.984 1.00 0.00 C ATOM 1942 CG2 ILE B 45 -1.566 10.306 -5.621 1.00 0.00 C ATOM 1943 CD1 ILE B 45 -0.625 7.494 -5.062 1.00 0.00 C ATOM 0 H ILE B 45 -3.126 8.674 -2.320 1.00 0.00 H new ATOM 0 HA ILE B 45 -1.557 10.921 -2.892 1.00 0.00 H new ATOM 0 HB ILE B 45 -2.974 8.961 -4.749 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -0.136 9.018 -3.649 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -1.407 7.931 -3.124 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -1.305 9.630 -6.436 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -2.342 10.995 -5.955 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -0.683 10.871 -5.322 1.00 0.00 H new ATOM 0 HD11 ILE B 45 0.125 6.808 -4.668 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -1.501 6.930 -5.381 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -0.211 8.033 -5.914 1.00 0.00 H new ATOM 1955 N ALA B 46 -4.728 11.204 -3.643 1.00 0.00 N ATOM 1956 CA ALA B 46 -5.768 12.138 -4.056 1.00 0.00 C ATOM 1957 C ALA B 46 -5.728 13.418 -3.223 1.00 0.00 C ATOM 1958 O ALA B 46 -6.134 14.482 -3.693 1.00 0.00 O ATOM 1959 CB ALA B 46 -7.135 11.484 -3.949 1.00 0.00 C ATOM 0 H ALA B 46 -5.080 10.320 -3.276 1.00 0.00 H new ATOM 0 HA ALA B 46 -5.583 12.408 -5.096 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -7.903 12.192 -4.260 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -7.169 10.605 -4.593 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -7.315 11.184 -2.917 1.00 0.00 H new ATOM 1965 N GLN B 47 -5.214 13.307 -2.001 1.00 0.00 N ATOM 1966 CA GLN B 47 -5.169 14.429 -1.070 1.00 0.00 C ATOM 1967 C GLN B 47 -3.906 15.262 -1.274 1.00 0.00 C ATOM 1968 O GLN B 47 -3.712 16.295 -0.623 1.00 0.00 O ATOM 1969 CB GLN B 47 -5.212 13.910 0.367 1.00 0.00 C ATOM 1970 CG GLN B 47 -6.374 12.973 0.640 1.00 0.00 C ATOM 1971 CD GLN B 47 -6.348 12.407 2.048 1.00 0.00 C ATOM 1972 OE1 GLN B 47 -5.889 13.059 2.989 1.00 0.00 O ATOM 1973 NE2 GLN B 47 -6.825 11.182 2.194 1.00 0.00 N ATOM 0 H GLN B 47 -4.820 12.442 -1.631 1.00 0.00 H new ATOM 0 HA GLN B 47 -6.035 15.064 -1.260 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -4.279 13.391 0.585 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -5.272 14.758 1.049 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -7.311 13.507 0.484 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -6.351 12.153 -0.078 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -7.195 10.679 1.387 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -6.823 10.740 3.113 1.00 0.00 H new ATOM 1982 N VAL B 48 -3.050 14.802 -2.175 1.00 0.00 N ATOM 1983 CA VAL B 48 -1.800 15.482 -2.474 1.00 0.00 C ATOM 1984 C VAL B 48 -2.036 16.533 -3.560 1.00 0.00 C ATOM 1985 O VAL B 48 -2.908 16.354 -4.399 1.00 0.00 O ATOM 1986 CB VAL B 48 -0.737 14.453 -2.945 1.00 0.00 C ATOM 1987 CG1 VAL B 48 0.598 15.110 -3.260 1.00 0.00 C ATOM 1988 CG2 VAL B 48 -0.554 13.367 -1.894 1.00 0.00 C ATOM 0 H VAL B 48 -3.202 13.951 -2.716 1.00 0.00 H new ATOM 0 HA VAL B 48 -1.433 15.976 -1.574 1.00 0.00 H new ATOM 0 HB VAL B 48 -1.105 14.005 -3.868 1.00 0.00 H new ATOM 0 HG11 VAL B 48 1.309 14.351 -3.585 1.00 0.00 H new ATOM 0 HG12 VAL B 48 0.464 15.845 -4.054 1.00 0.00 H new ATOM 0 HG13 VAL B 48 0.979 15.606 -2.367 1.00 0.00 H new ATOM 0 HG21 VAL B 48 0.194 12.652 -2.236 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -0.223 13.818 -0.958 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -1.501 12.852 -1.734 1.00 0.00 H new ATOM 1998 N PRO B 49 -1.323 17.671 -3.526 1.00 0.00 N ATOM 1999 CA PRO B 49 -1.383 18.659 -4.610 1.00 0.00 C ATOM 2000 C PRO B 49 -0.988 18.055 -5.962 1.00 0.00 C ATOM 2001 O PRO B 49 0.010 17.337 -6.065 1.00 0.00 O ATOM 2002 CB PRO B 49 -0.374 19.727 -4.179 1.00 0.00 C ATOM 2003 CG PRO B 49 -0.267 19.576 -2.700 1.00 0.00 C ATOM 2004 CD PRO B 49 -0.456 18.112 -2.422 1.00 0.00 C ATOM 0 HA PRO B 49 -2.391 19.048 -4.755 1.00 0.00 H new ATOM 0 HB2 PRO B 49 0.591 19.577 -4.663 1.00 0.00 H new ATOM 0 HB3 PRO B 49 -0.715 20.726 -4.451 1.00 0.00 H new ATOM 0 HG2 PRO B 49 0.703 19.920 -2.341 1.00 0.00 H new ATOM 0 HG3 PRO B 49 -1.025 20.172 -2.191 1.00 0.00 H new ATOM 0 HD2 PRO B 49 0.494 17.577 -2.417 1.00 0.00 H new ATOM 0 HD3 PRO B 49 -0.922 17.943 -1.451 1.00 0.00 H new ATOM 2012 N GLU B 50 -1.775 18.361 -6.990 1.00 0.00 N ATOM 2013 CA GLU B 50 -1.587 17.788 -8.323 1.00 0.00 C ATOM 2014 C GLU B 50 -0.199 18.081 -8.894 1.00 0.00 C ATOM 2015 O GLU B 50 0.309 17.317 -9.715 1.00 0.00 O ATOM 2016 CB GLU B 50 -2.652 18.306 -9.281 1.00 0.00 C ATOM 2017 CG GLU B 50 -2.840 17.403 -10.484 1.00 0.00 C ATOM 2018 CD GLU B 50 -3.740 18.009 -11.536 1.00 0.00 C ATOM 2019 OE1 GLU B 50 -3.237 18.779 -12.382 1.00 0.00 O ATOM 2020 OE2 GLU B 50 -4.951 17.723 -11.520 1.00 0.00 O ATOM 0 H GLU B 50 -2.559 19.011 -6.925 1.00 0.00 H new ATOM 0 HA GLU B 50 -1.681 16.707 -8.216 1.00 0.00 H new ATOM 0 HB2 GLU B 50 -3.599 18.400 -8.750 1.00 0.00 H new ATOM 0 HB3 GLU B 50 -2.376 19.305 -9.620 1.00 0.00 H new ATOM 0 HG2 GLU B 50 -1.867 17.186 -10.926 1.00 0.00 H new ATOM 0 HG3 GLU B 50 -3.260 16.452 -10.157 1.00 0.00 H new ATOM 2027 N SER B 51 0.412 19.172 -8.447 1.00 0.00 N ATOM 2028 CA SER B 51 1.744 19.559 -8.906 1.00 0.00 C ATOM 2029 C SER B 51 2.753 18.417 -8.722 1.00 0.00 C ATOM 2030 O SER B 51 3.699 18.281 -9.500 1.00 0.00 O ATOM 2031 CB SER B 51 2.203 20.815 -8.154 1.00 0.00 C ATOM 2032 OG SER B 51 3.535 21.184 -8.487 1.00 0.00 O ATOM 0 H SER B 51 0.004 19.809 -7.763 1.00 0.00 H new ATOM 0 HA SER B 51 1.692 19.778 -9.972 1.00 0.00 H new ATOM 0 HB2 SER B 51 1.530 21.641 -8.385 1.00 0.00 H new ATOM 0 HB3 SER B 51 2.134 20.639 -7.080 1.00 0.00 H new ATOM 0 HG SER B 51 3.786 21.989 -7.987 1.00 0.00 H new ATOM 2038 N LYS B 52 2.534 17.579 -7.716 1.00 0.00 N ATOM 2039 CA LYS B 52 3.437 16.467 -7.446 1.00 0.00 C ATOM 2040 C LYS B 52 2.677 15.137 -7.429 1.00 0.00 C ATOM 2041 O LYS B 52 3.168 14.148 -6.893 1.00 0.00 O ATOM 2042 CB LYS B 52 4.166 16.682 -6.110 1.00 0.00 C ATOM 2043 CG LYS B 52 3.235 16.818 -4.913 1.00 0.00 C ATOM 2044 CD LYS B 52 3.988 16.774 -3.588 1.00 0.00 C ATOM 2045 CE LYS B 52 4.385 18.159 -3.083 1.00 0.00 C ATOM 2046 NZ LYS B 52 5.415 18.815 -3.935 1.00 0.00 N ATOM 0 H LYS B 52 1.743 17.648 -7.076 1.00 0.00 H new ATOM 0 HA LYS B 52 4.176 16.427 -8.247 1.00 0.00 H new ATOM 0 HB2 LYS B 52 4.843 15.845 -5.938 1.00 0.00 H new ATOM 0 HB3 LYS B 52 4.781 17.579 -6.183 1.00 0.00 H new ATOM 0 HG2 LYS B 52 2.687 17.757 -4.986 1.00 0.00 H new ATOM 0 HG3 LYS B 52 2.497 16.016 -4.936 1.00 0.00 H new ATOM 0 HD2 LYS B 52 3.366 16.284 -2.839 1.00 0.00 H new ATOM 0 HD3 LYS B 52 4.884 16.165 -3.706 1.00 0.00 H new ATOM 0 HE2 LYS B 52 3.499 18.792 -3.041 1.00 0.00 H new ATOM 0 HE3 LYS B 52 4.764 18.074 -2.065 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 5.876 19.577 -3.398 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 6.127 18.113 -4.221 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 4.962 19.213 -4.782 1.00 0.00 H new ATOM 2060 N ARG B 53 1.498 15.113 -8.049 1.00 0.00 N ATOM 2061 CA ARG B 53 0.623 13.931 -8.018 1.00 0.00 C ATOM 2062 C ARG B 53 1.264 12.733 -8.707 1.00 0.00 C ATOM 2063 O ARG B 53 1.220 11.613 -8.201 1.00 0.00 O ATOM 2064 CB ARG B 53 -0.700 14.236 -8.717 1.00 0.00 C ATOM 2065 CG ARG B 53 -1.931 13.751 -7.970 1.00 0.00 C ATOM 2066 CD ARG B 53 -2.156 14.570 -6.717 1.00 0.00 C ATOM 2067 NE ARG B 53 -3.563 14.635 -6.314 1.00 0.00 N ATOM 2068 CZ ARG B 53 -4.561 15.129 -7.054 1.00 0.00 C ATOM 2069 NH1 ARG B 53 -4.356 15.514 -8.307 1.00 0.00 N ATOM 2070 NH2 ARG B 53 -5.778 15.237 -6.530 1.00 0.00 N ATOM 0 H ARG B 53 1.122 15.898 -8.581 1.00 0.00 H new ATOM 0 HA ARG B 53 0.455 13.687 -6.969 1.00 0.00 H new ATOM 0 HB2 ARG B 53 -0.780 15.313 -8.863 1.00 0.00 H new ATOM 0 HB3 ARG B 53 -0.688 13.780 -9.707 1.00 0.00 H new ATOM 0 HG2 ARG B 53 -2.805 13.820 -8.617 1.00 0.00 H new ATOM 0 HG3 ARG B 53 -1.812 12.700 -7.707 1.00 0.00 H new ATOM 0 HD2 ARG B 53 -1.571 14.144 -5.902 1.00 0.00 H new ATOM 0 HD3 ARG B 53 -1.785 15.582 -6.881 1.00 0.00 H new ATOM 0 HE ARG B 53 -3.801 14.273 -5.391 1.00 0.00 H new ATOM 0 HH11 ARG B 53 -3.426 15.435 -8.719 1.00 0.00 H new ATOM 0 HH12 ARG B 53 -5.128 15.889 -8.858 1.00 0.00 H new ATOM 0 HH21 ARG B 53 -5.947 14.944 -5.568 1.00 0.00 H new ATOM 0 HH22 ARG B 53 -6.543 15.613 -7.090 1.00 0.00 H new ATOM 2084 N VAL B 54 1.843 12.963 -9.870 1.00 0.00 N ATOM 2085 CA VAL B 54 2.461 11.883 -10.615 1.00 0.00 C ATOM 2086 C VAL B 54 3.822 11.562 -10.012 1.00 0.00 C ATOM 2087 O VAL B 54 4.263 10.419 -10.018 1.00 0.00 O ATOM 2088 CB VAL B 54 2.593 12.230 -12.116 1.00 0.00 C ATOM 2089 CG1 VAL B 54 3.226 11.085 -12.889 1.00 0.00 C ATOM 2090 CG2 VAL B 54 1.227 12.574 -12.696 1.00 0.00 C ATOM 0 H VAL B 54 1.898 13.879 -10.316 1.00 0.00 H new ATOM 0 HA VAL B 54 1.820 11.004 -10.544 1.00 0.00 H new ATOM 0 HB VAL B 54 3.246 13.098 -12.210 1.00 0.00 H new ATOM 0 HG11 VAL B 54 3.306 11.357 -13.941 1.00 0.00 H new ATOM 0 HG12 VAL B 54 4.220 10.882 -12.490 1.00 0.00 H new ATOM 0 HG13 VAL B 54 2.607 10.193 -12.791 1.00 0.00 H new ATOM 0 HG21 VAL B 54 1.331 12.817 -13.753 1.00 0.00 H new ATOM 0 HG22 VAL B 54 0.559 11.720 -12.584 1.00 0.00 H new ATOM 0 HG23 VAL B 54 0.812 13.431 -12.166 1.00 0.00 H new ATOM 2100 N ALA B 55 4.457 12.579 -9.447 1.00 0.00 N ATOM 2101 CA ALA B 55 5.741 12.403 -8.785 1.00 0.00 C ATOM 2102 C ALA B 55 5.609 11.502 -7.556 1.00 0.00 C ATOM 2103 O ALA B 55 6.416 10.592 -7.356 1.00 0.00 O ATOM 2104 CB ALA B 55 6.326 13.755 -8.400 1.00 0.00 C ATOM 0 H ALA B 55 4.103 13.536 -9.434 1.00 0.00 H new ATOM 0 HA ALA B 55 6.420 11.915 -9.484 1.00 0.00 H new ATOM 0 HB1 ALA B 55 7.286 13.608 -7.906 1.00 0.00 H new ATOM 0 HB2 ALA B 55 6.468 14.359 -9.296 1.00 0.00 H new ATOM 0 HB3 ALA B 55 5.643 14.267 -7.722 1.00 0.00 H new ATOM 2110 N VAL B 56 4.580 11.743 -6.743 1.00 0.00 N ATOM 2111 CA VAL B 56 4.377 10.967 -5.523 1.00 0.00 C ATOM 2112 C VAL B 56 4.056 9.505 -5.833 1.00 0.00 C ATOM 2113 O VAL B 56 4.537 8.605 -5.147 1.00 0.00 O ATOM 2114 CB VAL B 56 3.279 11.565 -4.602 1.00 0.00 C ATOM 2115 CG1 VAL B 56 3.742 12.886 -4.004 1.00 0.00 C ATOM 2116 CG2 VAL B 56 1.965 11.750 -5.341 1.00 0.00 C ATOM 0 H VAL B 56 3.879 12.465 -6.907 1.00 0.00 H new ATOM 0 HA VAL B 56 5.322 11.015 -4.982 1.00 0.00 H new ATOM 0 HB VAL B 56 3.107 10.854 -3.794 1.00 0.00 H new ATOM 0 HG11 VAL B 56 2.959 13.289 -3.362 1.00 0.00 H new ATOM 0 HG12 VAL B 56 4.645 12.723 -3.416 1.00 0.00 H new ATOM 0 HG13 VAL B 56 3.954 13.594 -4.805 1.00 0.00 H new ATOM 0 HG21 VAL B 56 1.222 12.170 -4.663 1.00 0.00 H new ATOM 0 HG22 VAL B 56 2.113 12.427 -6.182 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.616 10.785 -5.709 1.00 0.00 H new ATOM 2126 N VAL B 57 3.269 9.260 -6.878 1.00 0.00 N ATOM 2127 CA VAL B 57 2.922 7.890 -7.241 1.00 0.00 C ATOM 2128 C VAL B 57 4.088 7.201 -7.956 1.00 0.00 C ATOM 2129 O VAL B 57 4.304 6.000 -7.786 1.00 0.00 O ATOM 2130 CB VAL B 57 1.638 7.812 -8.108 1.00 0.00 C ATOM 2131 CG1 VAL B 57 1.798 8.556 -9.422 1.00 0.00 C ATOM 2132 CG2 VAL B 57 1.245 6.362 -8.362 1.00 0.00 C ATOM 0 H VAL B 57 2.866 9.979 -7.479 1.00 0.00 H new ATOM 0 HA VAL B 57 2.716 7.364 -6.309 1.00 0.00 H new ATOM 0 HB VAL B 57 0.839 8.299 -7.548 1.00 0.00 H new ATOM 0 HG11 VAL B 57 0.877 8.477 -9.999 1.00 0.00 H new ATOM 0 HG12 VAL B 57 2.012 9.606 -9.222 1.00 0.00 H new ATOM 0 HG13 VAL B 57 2.620 8.120 -9.989 1.00 0.00 H new ATOM 0 HG21 VAL B 57 0.342 6.331 -8.972 1.00 0.00 H new ATOM 0 HG22 VAL B 57 2.054 5.852 -8.885 1.00 0.00 H new ATOM 0 HG23 VAL B 57 1.057 5.864 -7.411 1.00 0.00 H new ATOM 2142 N ASP B 58 4.849 7.961 -8.738 1.00 0.00 N ATOM 2143 CA ASP B 58 6.017 7.412 -9.426 1.00 0.00 C ATOM 2144 C ASP B 58 7.090 7.005 -8.428 1.00 0.00 C ATOM 2145 O ASP B 58 7.664 5.926 -8.534 1.00 0.00 O ATOM 2146 CB ASP B 58 6.597 8.410 -10.430 1.00 0.00 C ATOM 2147 CG ASP B 58 6.317 8.009 -11.865 1.00 0.00 C ATOM 2148 OD1 ASP B 58 7.078 7.187 -12.418 1.00 0.00 O ATOM 2149 OD2 ASP B 58 5.329 8.501 -12.444 1.00 0.00 O ATOM 0 H ASP B 58 4.681 8.952 -8.912 1.00 0.00 H new ATOM 0 HA ASP B 58 5.685 6.529 -9.972 1.00 0.00 H new ATOM 0 HB2 ASP B 58 6.176 9.398 -10.242 1.00 0.00 H new ATOM 0 HB3 ASP B 58 7.674 8.489 -10.280 1.00 0.00 H new ATOM 2154 N ASN B 59 7.355 7.869 -7.453 1.00 0.00 N ATOM 2155 CA ASN B 59 8.318 7.554 -6.401 1.00 0.00 C ATOM 2156 C ASN B 59 7.851 6.355 -5.591 1.00 0.00 C ATOM 2157 O ASN B 59 8.643 5.472 -5.259 1.00 0.00 O ATOM 2158 CB ASN B 59 8.528 8.749 -5.467 1.00 0.00 C ATOM 2159 CG ASN B 59 9.343 9.858 -6.100 1.00 0.00 C ATOM 2160 OD1 ASN B 59 10.209 9.612 -6.943 1.00 0.00 O ATOM 2161 ND2 ASN B 59 9.071 11.087 -5.693 1.00 0.00 N ATOM 0 H ASN B 59 6.920 8.788 -7.369 1.00 0.00 H new ATOM 0 HA ASN B 59 9.266 7.317 -6.884 1.00 0.00 H new ATOM 0 HB2 ASN B 59 7.557 9.144 -5.168 1.00 0.00 H new ATOM 0 HB3 ASN B 59 9.028 8.411 -4.560 1.00 0.00 H new ATOM 0 HD21 ASN B 59 9.587 11.878 -6.079 1.00 0.00 H new ATOM 0 HD22 ASN B 59 8.346 11.244 -4.993 1.00 0.00 H new ATOM 2168 N PHE B 60 6.557 6.332 -5.281 1.00 0.00 N ATOM 2169 CA PHE B 60 5.960 5.230 -4.537 1.00 0.00 C ATOM 2170 C PHE B 60 6.166 3.918 -5.279 1.00 0.00 C ATOM 2171 O PHE B 60 6.687 2.949 -4.726 1.00 0.00 O ATOM 2172 CB PHE B 60 4.460 5.478 -4.344 1.00 0.00 C ATOM 2173 CG PHE B 60 3.797 4.524 -3.391 1.00 0.00 C ATOM 2174 CD1 PHE B 60 3.782 4.782 -2.034 1.00 0.00 C ATOM 2175 CD2 PHE B 60 3.183 3.374 -3.857 1.00 0.00 C ATOM 2176 CE1 PHE B 60 3.171 3.910 -1.155 1.00 0.00 C ATOM 2177 CE2 PHE B 60 2.570 2.497 -2.984 1.00 0.00 C ATOM 2178 CZ PHE B 60 2.563 2.766 -1.631 1.00 0.00 C ATOM 0 H PHE B 60 5.900 7.069 -5.536 1.00 0.00 H new ATOM 0 HA PHE B 60 6.445 5.168 -3.563 1.00 0.00 H new ATOM 0 HB2 PHE B 60 4.315 6.496 -3.982 1.00 0.00 H new ATOM 0 HB3 PHE B 60 3.964 5.410 -5.312 1.00 0.00 H new ATOM 0 HD1 PHE B 60 4.254 5.677 -1.656 1.00 0.00 H new ATOM 0 HD2 PHE B 60 3.183 3.160 -4.916 1.00 0.00 H new ATOM 0 HE1 PHE B 60 3.169 4.123 -0.096 1.00 0.00 H new ATOM 0 HE2 PHE B 60 2.097 1.602 -3.360 1.00 0.00 H new ATOM 0 HZ PHE B 60 2.083 2.083 -0.946 1.00 0.00 H new ATOM 2188 N THR B 61 5.770 3.907 -6.541 1.00 0.00 N ATOM 2189 CA THR B 61 5.842 2.711 -7.356 1.00 0.00 C ATOM 2190 C THR B 61 7.291 2.283 -7.596 1.00 0.00 C ATOM 2191 O THR B 61 7.616 1.102 -7.489 1.00 0.00 O ATOM 2192 CB THR B 61 5.110 2.914 -8.698 1.00 0.00 C ATOM 2193 OG1 THR B 61 5.559 4.113 -9.337 1.00 0.00 O ATOM 2194 CG2 THR B 61 3.603 2.984 -8.487 1.00 0.00 C ATOM 0 H THR B 61 5.392 4.722 -7.024 1.00 0.00 H new ATOM 0 HA THR B 61 5.343 1.912 -6.808 1.00 0.00 H new ATOM 0 HB THR B 61 5.338 2.060 -9.336 1.00 0.00 H new ATOM 0 HG1 THR B 61 5.104 4.885 -8.940 1.00 0.00 H new ATOM 0 HG21 THR B 61 3.107 3.127 -9.447 1.00 0.00 H new ATOM 0 HG22 THR B 61 3.255 2.055 -8.034 1.00 0.00 H new ATOM 0 HG23 THR B 61 3.366 3.819 -7.828 1.00 0.00 H new ATOM 2202 N LYS B 62 8.156 3.251 -7.892 1.00 0.00 N ATOM 2203 CA LYS B 62 9.578 2.987 -8.096 1.00 0.00 C ATOM 2204 C LYS B 62 10.190 2.301 -6.878 1.00 0.00 C ATOM 2205 O LYS B 62 10.774 1.220 -6.987 1.00 0.00 O ATOM 2206 CB LYS B 62 10.324 4.296 -8.372 1.00 0.00 C ATOM 2207 CG LYS B 62 11.838 4.147 -8.396 1.00 0.00 C ATOM 2208 CD LYS B 62 12.534 5.498 -8.451 1.00 0.00 C ATOM 2209 CE LYS B 62 14.038 5.357 -8.277 1.00 0.00 C ATOM 2210 NZ LYS B 62 14.674 4.666 -9.430 1.00 0.00 N ATOM 0 H LYS B 62 7.894 4.231 -7.996 1.00 0.00 H new ATOM 0 HA LYS B 62 9.675 2.323 -8.955 1.00 0.00 H new ATOM 0 HB2 LYS B 62 9.993 4.697 -9.330 1.00 0.00 H new ATOM 0 HB3 LYS B 62 10.052 5.026 -7.609 1.00 0.00 H new ATOM 0 HG2 LYS B 62 12.165 3.605 -7.509 1.00 0.00 H new ATOM 0 HG3 LYS B 62 12.132 3.551 -9.260 1.00 0.00 H new ATOM 0 HD2 LYS B 62 12.321 5.980 -9.405 1.00 0.00 H new ATOM 0 HD3 LYS B 62 12.135 6.146 -7.670 1.00 0.00 H new ATOM 0 HE2 LYS B 62 14.483 6.345 -8.157 1.00 0.00 H new ATOM 0 HE3 LYS B 62 14.246 4.801 -7.363 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 14.982 3.717 -9.139 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 13.988 4.584 -10.207 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 15.497 5.214 -9.752 1.00 0.00 H new ATOM 2224 N ALA B 63 10.036 2.930 -5.720 1.00 0.00 N ATOM 2225 CA ALA B 63 10.627 2.424 -4.489 1.00 0.00 C ATOM 2226 C ALA B 63 10.042 1.068 -4.116 1.00 0.00 C ATOM 2227 O ALA B 63 10.742 0.209 -3.574 1.00 0.00 O ATOM 2228 CB ALA B 63 10.431 3.421 -3.354 1.00 0.00 C ATOM 0 H ALA B 63 9.505 3.794 -5.608 1.00 0.00 H new ATOM 0 HA ALA B 63 11.696 2.294 -4.657 1.00 0.00 H new ATOM 0 HB1 ALA B 63 10.879 3.027 -2.442 1.00 0.00 H new ATOM 0 HB2 ALA B 63 10.908 4.366 -3.613 1.00 0.00 H new ATOM 0 HB3 ALA B 63 9.365 3.585 -3.194 1.00 0.00 H new ATOM 2234 N LEU B 64 8.767 0.872 -4.423 1.00 0.00 N ATOM 2235 CA LEU B 64 8.089 -0.374 -4.102 1.00 0.00 C ATOM 2236 C LEU B 64 8.615 -1.507 -4.988 1.00 0.00 C ATOM 2237 O LEU B 64 8.851 -2.618 -4.508 1.00 0.00 O ATOM 2238 CB LEU B 64 6.574 -0.195 -4.262 1.00 0.00 C ATOM 2239 CG LEU B 64 5.701 -1.197 -3.500 1.00 0.00 C ATOM 2240 CD1 LEU B 64 4.402 -0.542 -3.068 1.00 0.00 C ATOM 2241 CD2 LEU B 64 5.400 -2.415 -4.355 1.00 0.00 C ATOM 0 H LEU B 64 8.182 1.562 -4.895 1.00 0.00 H new ATOM 0 HA LEU B 64 8.293 -0.642 -3.065 1.00 0.00 H new ATOM 0 HB2 LEU B 64 6.309 0.811 -3.936 1.00 0.00 H new ATOM 0 HB3 LEU B 64 6.329 -0.261 -5.322 1.00 0.00 H new ATOM 0 HG LEU B 64 6.252 -1.520 -2.617 1.00 0.00 H new ATOM 0 HD11 LEU B 64 3.792 -1.266 -2.528 1.00 0.00 H new ATOM 0 HD12 LEU B 64 4.620 0.305 -2.418 1.00 0.00 H new ATOM 0 HD13 LEU B 64 3.860 -0.195 -3.947 1.00 0.00 H new ATOM 0 HD21 LEU B 64 4.779 -3.111 -3.791 1.00 0.00 H new ATOM 0 HD22 LEU B 64 4.871 -2.105 -5.256 1.00 0.00 H new ATOM 0 HD23 LEU B 64 6.334 -2.905 -4.632 1.00 0.00 H new ATOM 2253 N LYS B 65 8.823 -1.210 -6.271 1.00 0.00 N ATOM 2254 CA LYS B 65 9.401 -2.178 -7.206 1.00 0.00 C ATOM 2255 C LYS B 65 10.771 -2.642 -6.716 1.00 0.00 C ATOM 2256 O LYS B 65 11.057 -3.839 -6.670 1.00 0.00 O ATOM 2257 CB LYS B 65 9.558 -1.570 -8.605 1.00 0.00 C ATOM 2258 CG LYS B 65 8.252 -1.253 -9.318 1.00 0.00 C ATOM 2259 CD LYS B 65 8.516 -0.551 -10.645 1.00 0.00 C ATOM 2260 CE LYS B 65 7.229 -0.179 -11.369 1.00 0.00 C ATOM 2261 NZ LYS B 65 6.476 -1.373 -11.831 1.00 0.00 N ATOM 0 H LYS B 65 8.600 -0.306 -6.688 1.00 0.00 H new ATOM 0 HA LYS B 65 8.720 -3.027 -7.259 1.00 0.00 H new ATOM 0 HB2 LYS B 65 10.142 -0.653 -8.523 1.00 0.00 H new ATOM 0 HB3 LYS B 65 10.133 -2.260 -9.222 1.00 0.00 H new ATOM 0 HG2 LYS B 65 7.695 -2.174 -9.493 1.00 0.00 H new ATOM 0 HG3 LYS B 65 7.631 -0.620 -8.684 1.00 0.00 H new ATOM 0 HD2 LYS B 65 9.103 0.350 -10.466 1.00 0.00 H new ATOM 0 HD3 LYS B 65 9.115 -1.200 -11.284 1.00 0.00 H new ATOM 0 HE2 LYS B 65 6.598 0.411 -10.704 1.00 0.00 H new ATOM 0 HE3 LYS B 65 7.466 0.452 -12.226 1.00 0.00 H new ATOM 0 HZ1 LYS B 65 6.272 -1.283 -12.847 1.00 0.00 H new ATOM 0 HZ2 LYS B 65 7.046 -2.228 -11.667 1.00 0.00 H new ATOM 0 HZ3 LYS B 65 5.583 -1.446 -11.303 1.00 0.00 H new ATOM 2275 N GLN B 66 11.605 -1.676 -6.345 1.00 0.00 N ATOM 2276 CA GLN B 66 12.967 -1.955 -5.896 1.00 0.00 C ATOM 2277 C GLN B 66 12.967 -2.811 -4.635 1.00 0.00 C ATOM 2278 O GLN B 66 13.756 -3.743 -4.508 1.00 0.00 O ATOM 2279 CB GLN B 66 13.712 -0.647 -5.622 1.00 0.00 C ATOM 2280 CG GLN B 66 13.784 0.283 -6.823 1.00 0.00 C ATOM 2281 CD GLN B 66 14.435 1.616 -6.498 1.00 0.00 C ATOM 2282 OE1 GLN B 66 15.046 2.249 -7.359 1.00 0.00 O ATOM 2283 NE2 GLN B 66 14.314 2.048 -5.252 1.00 0.00 N ATOM 0 H GLN B 66 11.360 -0.686 -6.346 1.00 0.00 H new ATOM 0 HA GLN B 66 13.473 -2.505 -6.690 1.00 0.00 H new ATOM 0 HB2 GLN B 66 13.221 -0.126 -4.800 1.00 0.00 H new ATOM 0 HB3 GLN B 66 14.725 -0.879 -5.293 1.00 0.00 H new ATOM 0 HG2 GLN B 66 14.344 -0.205 -7.621 1.00 0.00 H new ATOM 0 HG3 GLN B 66 12.777 0.459 -7.202 1.00 0.00 H new ATOM 0 HE21 GLN B 66 13.799 1.494 -4.568 1.00 0.00 H new ATOM 0 HE22 GLN B 66 14.735 2.935 -4.977 1.00 0.00 H new ATOM 2292 N SER B 67 12.063 -2.497 -3.716 1.00 0.00 N ATOM 2293 CA SER B 67 12.006 -3.185 -2.431 1.00 0.00 C ATOM 2294 C SER B 67 11.551 -4.639 -2.590 1.00 0.00 C ATOM 2295 O SER B 67 11.886 -5.495 -1.772 1.00 0.00 O ATOM 2296 CB SER B 67 11.075 -2.434 -1.478 1.00 0.00 C ATOM 2297 OG SER B 67 11.498 -1.089 -1.306 1.00 0.00 O ATOM 0 H SER B 67 11.358 -1.770 -3.836 1.00 0.00 H new ATOM 0 HA SER B 67 13.012 -3.201 -2.011 1.00 0.00 H new ATOM 0 HB2 SER B 67 10.058 -2.452 -1.869 1.00 0.00 H new ATOM 0 HB3 SER B 67 11.054 -2.938 -0.512 1.00 0.00 H new ATOM 0 HG SER B 67 11.226 -0.558 -2.084 1.00 0.00 H new ATOM 2303 N VAL B 68 10.792 -4.915 -3.646 1.00 0.00 N ATOM 2304 CA VAL B 68 10.363 -6.280 -3.938 1.00 0.00 C ATOM 2305 C VAL B 68 11.519 -7.089 -4.518 1.00 0.00 C ATOM 2306 O VAL B 68 11.780 -8.213 -4.090 1.00 0.00 O ATOM 2307 CB VAL B 68 9.164 -6.312 -4.916 1.00 0.00 C ATOM 2308 CG1 VAL B 68 8.842 -7.739 -5.342 1.00 0.00 C ATOM 2309 CG2 VAL B 68 7.945 -5.666 -4.279 1.00 0.00 C ATOM 0 H VAL B 68 10.462 -4.216 -4.311 1.00 0.00 H new ATOM 0 HA VAL B 68 10.042 -6.725 -2.996 1.00 0.00 H new ATOM 0 HB VAL B 68 9.439 -5.746 -5.806 1.00 0.00 H new ATOM 0 HG11 VAL B 68 7.996 -7.731 -6.029 1.00 0.00 H new ATOM 0 HG12 VAL B 68 9.709 -8.175 -5.839 1.00 0.00 H new ATOM 0 HG13 VAL B 68 8.591 -8.333 -4.463 1.00 0.00 H new ATOM 0 HG21 VAL B 68 7.110 -5.696 -4.979 1.00 0.00 H new ATOM 0 HG22 VAL B 68 7.678 -6.208 -3.372 1.00 0.00 H new ATOM 0 HG23 VAL B 68 8.172 -4.630 -4.029 1.00 0.00 H new ATOM 2319 N LEU B 69 12.219 -6.498 -5.479 1.00 0.00 N ATOM 2320 CA LEU B 69 13.352 -7.157 -6.121 1.00 0.00 C ATOM 2321 C LEU B 69 14.488 -7.373 -5.127 1.00 0.00 C ATOM 2322 O LEU B 69 15.196 -8.380 -5.184 1.00 0.00 O ATOM 2323 CB LEU B 69 13.850 -6.325 -7.306 1.00 0.00 C ATOM 2324 CG LEU B 69 12.826 -6.105 -8.423 1.00 0.00 C ATOM 2325 CD1 LEU B 69 13.398 -5.195 -9.498 1.00 0.00 C ATOM 2326 CD2 LEU B 69 12.394 -7.435 -9.024 1.00 0.00 C ATOM 0 H LEU B 69 12.022 -5.562 -5.832 1.00 0.00 H new ATOM 0 HA LEU B 69 13.017 -8.129 -6.483 1.00 0.00 H new ATOM 0 HB2 LEU B 69 14.175 -5.353 -6.936 1.00 0.00 H new ATOM 0 HB3 LEU B 69 14.727 -6.814 -7.730 1.00 0.00 H new ATOM 0 HG LEU B 69 11.948 -5.622 -7.993 1.00 0.00 H new ATOM 0 HD11 LEU B 69 12.657 -5.050 -10.284 1.00 0.00 H new ATOM 0 HD12 LEU B 69 13.656 -4.231 -9.059 1.00 0.00 H new ATOM 0 HD13 LEU B 69 14.292 -5.651 -9.923 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.666 -7.257 -9.816 1.00 0.00 H new ATOM 0 HD22 LEU B 69 13.263 -7.947 -9.438 1.00 0.00 H new ATOM 0 HD23 LEU B 69 11.943 -8.055 -8.249 1.00 0.00 H new ATOM 2338 N GLU B 70 14.646 -6.429 -4.212 1.00 0.00 N ATOM 2339 CA GLU B 70 15.693 -6.508 -3.205 1.00 0.00 C ATOM 2340 C GLU B 70 15.189 -7.152 -1.919 1.00 0.00 C ATOM 2341 O GLU B 70 15.846 -7.078 -0.882 1.00 0.00 O ATOM 2342 CB GLU B 70 16.256 -5.119 -2.918 1.00 0.00 C ATOM 2343 CG GLU B 70 17.307 -4.678 -3.923 1.00 0.00 C ATOM 2344 CD GLU B 70 18.619 -5.414 -3.739 1.00 0.00 C ATOM 2345 OE1 GLU B 70 18.700 -6.611 -4.093 1.00 0.00 O ATOM 2346 OE2 GLU B 70 19.578 -4.796 -3.226 1.00 0.00 O ATOM 0 H GLU B 70 14.060 -5.597 -4.146 1.00 0.00 H new ATOM 0 HA GLU B 70 16.488 -7.140 -3.601 1.00 0.00 H new ATOM 0 HB2 GLU B 70 15.440 -4.397 -2.916 1.00 0.00 H new ATOM 0 HB3 GLU B 70 16.692 -5.110 -1.919 1.00 0.00 H new ATOM 0 HG2 GLU B 70 16.935 -4.848 -4.933 1.00 0.00 H new ATOM 0 HG3 GLU B 70 17.476 -3.606 -3.822 1.00 0.00 H new ATOM 2353 N HIS B 71 14.038 -7.801 -1.985 1.00 0.00 N ATOM 2354 CA HIS B 71 13.530 -8.537 -0.838 1.00 0.00 C ATOM 2355 C HIS B 71 14.032 -9.974 -0.904 1.00 0.00 C ATOM 2356 O HIS B 71 13.324 -10.876 -1.355 1.00 0.00 O ATOM 2357 CB HIS B 71 12.001 -8.508 -0.797 1.00 0.00 C ATOM 2358 CG HIS B 71 11.440 -8.244 0.568 1.00 0.00 C ATOM 2359 ND1 HIS B 71 11.992 -8.746 1.729 1.00 0.00 N ATOM 2360 CD2 HIS B 71 10.366 -7.518 0.954 1.00 0.00 C ATOM 2361 CE1 HIS B 71 11.280 -8.346 2.764 1.00 0.00 C ATOM 2362 NE2 HIS B 71 10.287 -7.598 2.325 1.00 0.00 N ATOM 0 H HIS B 71 13.442 -7.834 -2.812 1.00 0.00 H new ATOM 0 HA HIS B 71 13.893 -8.063 0.074 1.00 0.00 H new ATOM 0 HB2 HIS B 71 11.642 -7.740 -1.482 1.00 0.00 H new ATOM 0 HB3 HIS B 71 11.618 -9.462 -1.159 1.00 0.00 H new ATOM 0 HD2 HIS B 71 9.694 -6.975 0.305 1.00 0.00 H new ATOM 0 HE1 HIS B 71 11.477 -8.590 3.797 1.00 0.00 H new ATOM 0 HE2 HIS B 71 9.577 -7.152 2.906 1.00 0.00 H new ATOM 2371 N HIS B 72 15.273 -10.172 -0.474 1.00 0.00 N ATOM 2372 CA HIS B 72 15.943 -11.464 -0.607 1.00 0.00 C ATOM 2373 C HIS B 72 15.324 -12.488 0.339 1.00 0.00 C ATOM 2374 O HIS B 72 14.999 -12.175 1.484 1.00 0.00 O ATOM 2375 CB HIS B 72 17.451 -11.323 -0.349 1.00 0.00 C ATOM 2376 CG HIS B 72 18.171 -10.483 -1.374 1.00 0.00 C ATOM 2377 ND1 HIS B 72 19.472 -10.716 -1.774 1.00 0.00 N ATOM 2378 CD2 HIS B 72 17.764 -9.392 -2.068 1.00 0.00 C ATOM 2379 CE1 HIS B 72 19.827 -9.803 -2.663 1.00 0.00 C ATOM 2380 NE2 HIS B 72 18.808 -8.989 -2.860 1.00 0.00 N ATOM 0 H HIS B 72 15.840 -9.451 -0.028 1.00 0.00 H new ATOM 0 HA HIS B 72 15.807 -11.818 -1.629 1.00 0.00 H new ATOM 0 HB2 HIS B 72 17.601 -10.883 0.637 1.00 0.00 H new ATOM 0 HB3 HIS B 72 17.900 -12.316 -0.327 1.00 0.00 H new ATOM 0 HD2 HIS B 72 16.792 -8.924 -2.008 1.00 0.00 H new ATOM 0 HE1 HIS B 72 20.790 -9.735 -3.147 1.00 0.00 H new ATOM 0 HE2 HIS B 72 18.798 -8.192 -3.496 1.00 0.00 H new ATOM 2389 N HIS B 73 15.169 -13.715 -0.142 1.00 0.00 N ATOM 2390 CA HIS B 73 14.393 -14.726 0.570 1.00 0.00 C ATOM 2391 C HIS B 73 15.258 -15.530 1.545 1.00 0.00 C ATOM 2392 O HIS B 73 14.831 -16.575 2.035 1.00 0.00 O ATOM 2393 CB HIS B 73 13.744 -15.669 -0.451 1.00 0.00 C ATOM 2394 CG HIS B 73 12.410 -16.217 -0.035 1.00 0.00 C ATOM 2395 ND1 HIS B 73 11.486 -16.704 -0.939 1.00 0.00 N ATOM 2396 CD2 HIS B 73 11.845 -16.360 1.186 1.00 0.00 C ATOM 2397 CE1 HIS B 73 10.414 -17.118 -0.290 1.00 0.00 C ATOM 2398 NE2 HIS B 73 10.605 -16.920 0.997 1.00 0.00 N ATOM 0 H HIS B 73 15.570 -14.036 -1.023 1.00 0.00 H new ATOM 0 HA HIS B 73 13.628 -14.218 1.157 1.00 0.00 H new ATOM 0 HB2 HIS B 73 13.625 -15.136 -1.394 1.00 0.00 H new ATOM 0 HB3 HIS B 73 14.422 -16.502 -0.639 1.00 0.00 H new ATOM 0 HD2 HIS B 73 12.286 -16.085 2.133 1.00 0.00 H new ATOM 0 HE1 HIS B 73 9.530 -17.547 -0.739 1.00 0.00 H new ATOM 0 HE2 HIS B 73 9.939 -17.146 1.736 1.00 0.00 H new ATOM 2407 N HIS B 74 16.463 -15.035 1.834 1.00 0.00 N ATOM 2408 CA HIS B 74 17.403 -15.737 2.716 1.00 0.00 C ATOM 2409 C HIS B 74 17.696 -17.133 2.183 1.00 0.00 C ATOM 2410 O HIS B 74 17.522 -18.128 2.882 1.00 0.00 O ATOM 2411 CB HIS B 74 16.865 -15.835 4.152 1.00 0.00 C ATOM 2412 CG HIS B 74 16.895 -14.543 4.904 1.00 0.00 C ATOM 2413 ND1 HIS B 74 15.772 -13.960 5.449 1.00 0.00 N ATOM 2414 CD2 HIS B 74 17.928 -13.732 5.225 1.00 0.00 C ATOM 2415 CE1 HIS B 74 16.115 -12.846 6.066 1.00 0.00 C ATOM 2416 NE2 HIS B 74 17.418 -12.684 5.949 1.00 0.00 N ATOM 0 H HIS B 74 16.813 -14.149 1.470 1.00 0.00 H new ATOM 0 HA HIS B 74 18.325 -15.157 2.735 1.00 0.00 H new ATOM 0 HB2 HIS B 74 15.839 -16.201 4.120 1.00 0.00 H new ATOM 0 HB3 HIS B 74 17.450 -16.575 4.698 1.00 0.00 H new ATOM 0 HD2 HIS B 74 18.964 -13.882 4.960 1.00 0.00 H new ATOM 0 HE1 HIS B 74 15.441 -12.178 6.581 1.00 0.00 H new ATOM 0 HE2 HIS B 74 17.958 -11.908 6.333 1.00 0.00 H new ATOM 2425 N HIS B 75 18.140 -17.198 0.942 1.00 0.00 N ATOM 2426 CA HIS B 75 18.414 -18.473 0.302 1.00 0.00 C ATOM 2427 C HIS B 75 19.733 -19.033 0.821 1.00 0.00 C ATOM 2428 O HIS B 75 20.774 -18.384 0.721 1.00 0.00 O ATOM 2429 CB HIS B 75 18.458 -18.304 -1.220 1.00 0.00 C ATOM 2430 CG HIS B 75 18.276 -19.585 -1.977 1.00 0.00 C ATOM 2431 ND1 HIS B 75 17.123 -19.888 -2.671 1.00 0.00 N ATOM 2432 CD2 HIS B 75 19.107 -20.640 -2.156 1.00 0.00 C ATOM 2433 CE1 HIS B 75 17.252 -21.073 -3.240 1.00 0.00 C ATOM 2434 NE2 HIS B 75 18.445 -21.548 -2.944 1.00 0.00 N ATOM 0 H HIS B 75 18.319 -16.383 0.356 1.00 0.00 H new ATOM 0 HA HIS B 75 17.616 -19.175 0.542 1.00 0.00 H new ATOM 0 HB2 HIS B 75 17.681 -17.602 -1.521 1.00 0.00 H new ATOM 0 HB3 HIS B 75 19.414 -17.860 -1.499 1.00 0.00 H new ATOM 0 HD2 HIS B 75 20.104 -20.747 -1.754 1.00 0.00 H new ATOM 0 HE1 HIS B 75 16.507 -21.568 -3.845 1.00 0.00 H new ATOM 0 HE2 HIS B 75 18.817 -22.447 -3.251 1.00 0.00 H new ATOM 2443 N HIS B 76 19.680 -20.230 1.383 1.00 0.00 N ATOM 2444 CA HIS B 76 20.861 -20.861 1.959 1.00 0.00 C ATOM 2445 C HIS B 76 20.706 -22.377 1.927 1.00 0.00 C ATOM 2446 O HIS B 76 21.053 -23.041 2.921 1.00 0.00 O ATOM 2447 CB HIS B 76 21.094 -20.365 3.399 1.00 0.00 C ATOM 2448 CG HIS B 76 19.971 -20.660 4.355 1.00 0.00 C ATOM 2449 ND1 HIS B 76 18.764 -19.997 4.330 1.00 0.00 N ATOM 2450 CD2 HIS B 76 19.879 -21.554 5.369 1.00 0.00 C ATOM 2451 CE1 HIS B 76 17.984 -20.468 5.280 1.00 0.00 C ATOM 2452 NE2 HIS B 76 18.632 -21.416 5.926 1.00 0.00 N ATOM 2453 OXT HIS B 76 20.187 -22.890 0.915 1.00 0.00 O ATOM 0 H HIS B 76 18.829 -20.788 1.454 1.00 0.00 H new ATOM 0 HA HIS B 76 21.733 -20.586 1.365 1.00 0.00 H new ATOM 0 HB2 HIS B 76 22.008 -20.820 3.782 1.00 0.00 H new ATOM 0 HB3 HIS B 76 21.259 -19.288 3.375 1.00 0.00 H new ATOM 0 HD1 HIS B 76 18.513 -19.255 3.676 1.00 0.00 H new ATOM 0 HD2 HIS B 76 20.646 -22.248 5.681 1.00 0.00 H new ATOM 0 HE1 HIS B 76 16.980 -20.133 5.494 1.00 0.00 H new TER 2462 HIS B 76