USER MOD reduce.3.24.130724 H: found=0, std=0, add=1346, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1340 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 11 GLN : amide:sc= 0.943 K(o=2.9,f=-1.8!) USER MOD Set 1.2: B 26 HIS : +bothHN:sc= 1.91 K(o=2.9,f=-15!) USER MOD Set 2.1: A 71 THR OG1 : rot 21:sc= 0.934 USER MOD Set 2.2: A 73 LYS NZ :NH3+ -143:sc=-0.00884 (180deg=-0.229) USER MOD Set 3.1: A 4 THR OG1 : rot -41:sc= 1.15 USER MOD Set 3.2: A 60 LYS NZ :NH3+ -149:sc= -0.0798 (180deg=-2.16!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -140:sc= 1.22 (180deg=-0.389) USER MOD Single : A 5 SER OG : rot 180:sc= 0.0808 USER MOD Single : A 6 LYS NZ :NH3+ 155:sc= 1.28 (180deg=1.14) USER MOD Single : A 7 TYR OH : rot 180:sc=-0.00782 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -152:sc= 2.35 (180deg=1.78) USER MOD Single : A 25 LYS NZ :NH3+ 161:sc= -0.0636 (180deg=-0.394) USER MOD Single : A 26 HIS : no HD1:sc= 1.14 K(o=1.1,f=-3.6!) USER MOD Single : A 29 SER OG : rot 180:sc= -0.95 USER MOD Single : A 33 THR OG1 : rot 64:sc= 0.556 USER MOD Single : A 35 MET CE :methyl -123:sc= -0.461 (180deg=-2.92!) USER MOD Single : A 39 ASN : amide:sc= 0.304 X(o=0.3,f=-0.0037) USER MOD Single : A 42 THR OG1 : rot 73:sc= 1.26 USER MOD Single : A 43 ASN : amide:sc= -0.168 K(o=-0.17,f=-1!) USER MOD Single : A 46 ASN : amide:sc= 1.18 K(o=1.2,f=-0.71) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 GLN :FLIP amide:sc= -0.225 F(o=-1.1,f=-0.22) USER MOD Single : A 55 LYS NZ :NH3+ -163:sc= 0.373 (180deg=0.149) USER MOD Single : A 63 GLN : amide:sc= -1.87! C(o=-1.9!,f=-6.8!) USER MOD Single : A 66 MET CE :methyl 163:sc= -0.155 (180deg=-0.656) USER MOD Single : A 67 SER OG : rot -92:sc= 1.13 USER MOD Single : A 68 SER OG : rot 100:sc= 1.26 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 80 HIS : no HD1:sc=-0.00154 X(o=-0.0015,f=-0.11) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.0398 X(o=-0.04,f=-0.053) USER MOD Single : A 83 HIS : no HE2:sc= 0.0513 K(o=0.051,f=-1.4) USER MOD Single : B 1 MET CE :methyl -124:sc= 0 (180deg=-0.113) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 THR OG1 : rot 71:sc= 1.13 USER MOD Single : B 5 SER OG : rot 180:sc= 0.165 USER MOD Single : B 6 LYS NZ :NH3+ 165:sc= -0.018 (180deg=-0.235) USER MOD Single : B 7 TYR OH : rot 62:sc= 0.846 USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 14 LYS NZ :NH3+ -166:sc= 1.24 (180deg=0.864) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 72:sc= 0.111 USER MOD Single : B 35 MET CE :methyl 150:sc= -0.106 (180deg=-1.55) USER MOD Single : B 39 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : B 42 THR OG1 : rot 83:sc= 1.24 USER MOD Single : B 43 ASN : amide:sc=-0.00237 X(o=-0.0024,f=0) USER MOD Single : B 46 ASN :FLIP amide:sc= -0.543 F(o=-1.4!,f=-0.54) USER MOD Single : B 47 GLN :FLIP amide:sc= 0 F(o=-0.98,f=0) USER MOD Single : B 52 SER OG : rot 180:sc= 0.00698 USER MOD Single : B 53 GLN :FLIP amide:sc= -0.376 F(o=-1.6,f=-0.38) USER MOD Single : B 55 LYS NZ :NH3+ -116:sc= -0.0382 (180deg=-0.323) USER MOD Single : B 60 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0137) USER MOD Single : B 63 GLN : amide:sc= 0.694 K(o=0.69,f=-0.049) USER MOD Single : B 66 MET CE :methyl 172:sc= 0 (180deg=-0.0495) USER MOD Single : B 67 SER OG : rot 180:sc= 0 USER MOD Single : B 68 SER OG : rot 78:sc= 1.04 USER MOD Single : B 71 THR OG1 : rot 180:sc= 0.349 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 THR OG1 : rot 180:sc= 0 USER MOD Single : B 75 HIS : no HD1:sc= 1.09 K(o=1.1,f=-4!) USER MOD Single : B 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 79 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 80 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 81 HIS : no HD1:sc= -0.0296 X(o=-0.03,f=0) USER MOD Single : B 82 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.792 -5.073 20.136 1.00 0.00 N ATOM 2 CA MET A 1 -0.327 -4.077 19.146 1.00 0.00 C ATOM 3 C MET A 1 -0.869 -2.688 19.486 1.00 0.00 C ATOM 4 O MET A 1 -2.063 -2.422 19.356 1.00 0.00 O ATOM 5 CB MET A 1 -0.727 -4.481 17.712 1.00 0.00 C ATOM 6 CG MET A 1 -2.220 -4.707 17.496 1.00 0.00 C ATOM 7 SD MET A 1 -2.826 -6.210 18.291 1.00 0.00 S ATOM 8 CE MET A 1 -4.564 -6.148 17.849 1.00 0.00 C ATOM 0 H1 MET A 1 -0.018 -5.733 20.354 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.087 -4.586 21.006 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.598 -5.601 19.745 1.00 0.00 H new ATOM 0 HA MET A 1 0.762 -4.045 19.191 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.390 -3.705 17.025 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.195 -5.395 17.447 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.772 -3.850 17.883 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.423 -4.761 16.426 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.077 -7.013 18.269 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.008 -5.235 18.246 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.664 -6.158 16.764 1.00 0.00 H new ATOM 17 N PRO A 2 0.004 -1.794 19.972 1.00 0.00 N ATOM 18 CA PRO A 2 -0.374 -0.429 20.324 1.00 0.00 C ATOM 19 C PRO A 2 -0.193 0.559 19.170 1.00 0.00 C ATOM 20 O PRO A 2 -0.828 1.610 19.135 1.00 0.00 O ATOM 21 CB PRO A 2 0.599 -0.116 21.455 1.00 0.00 C ATOM 22 CG PRO A 2 1.845 -0.868 21.106 1.00 0.00 C ATOM 23 CD PRO A 2 1.425 -2.053 20.266 1.00 0.00 C ATOM 0 HA PRO A 2 -1.428 -0.342 20.587 1.00 0.00 H new ATOM 0 HB2 PRO A 2 0.790 0.955 21.527 1.00 0.00 H new ATOM 0 HB3 PRO A 2 0.201 -0.435 22.419 1.00 0.00 H new ATOM 0 HG2 PRO A 2 2.538 -0.232 20.556 1.00 0.00 H new ATOM 0 HG3 PRO A 2 2.362 -1.198 22.007 1.00 0.00 H new ATOM 0 HD2 PRO A 2 2.015 -2.124 19.352 1.00 0.00 H new ATOM 0 HD3 PRO A 2 1.557 -2.991 20.805 1.00 0.00 H new ATOM 31 N ILE A 3 0.669 0.209 18.225 1.00 0.00 N ATOM 32 CA ILE A 3 0.996 1.105 17.122 1.00 0.00 C ATOM 33 C ILE A 3 0.054 0.912 15.939 1.00 0.00 C ATOM 34 O ILE A 3 -0.280 1.864 15.240 1.00 0.00 O ATOM 35 CB ILE A 3 2.456 0.915 16.650 1.00 0.00 C ATOM 36 CG1 ILE A 3 2.740 -0.563 16.342 1.00 0.00 C ATOM 37 CG2 ILE A 3 3.416 1.444 17.704 1.00 0.00 C ATOM 38 CD1 ILE A 3 4.141 -0.824 15.830 1.00 0.00 C ATOM 0 H ILE A 3 1.154 -0.688 18.199 1.00 0.00 H new ATOM 0 HA ILE A 3 0.876 2.119 17.503 1.00 0.00 H new ATOM 0 HB ILE A 3 2.604 1.481 15.730 1.00 0.00 H new ATOM 0 HG12 ILE A 3 2.579 -1.150 17.246 1.00 0.00 H new ATOM 0 HG13 ILE A 3 2.022 -0.914 15.601 1.00 0.00 H new ATOM 0 HG21 ILE A 3 4.442 1.306 17.363 1.00 0.00 H new ATOM 0 HG22 ILE A 3 3.228 2.505 17.868 1.00 0.00 H new ATOM 0 HG23 ILE A 3 3.267 0.901 18.637 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.265 -1.889 15.635 1.00 0.00 H new ATOM 0 HD12 ILE A 3 4.301 -0.266 14.908 1.00 0.00 H new ATOM 0 HD13 ILE A 3 4.867 -0.505 16.578 1.00 0.00 H new ATOM 50 N THR A 4 -0.376 -0.318 15.715 1.00 0.00 N ATOM 51 CA THR A 4 -1.256 -0.608 14.601 1.00 0.00 C ATOM 52 C THR A 4 -2.688 -0.778 15.084 1.00 0.00 C ATOM 53 O THR A 4 -3.012 -1.737 15.783 1.00 0.00 O ATOM 54 CB THR A 4 -0.817 -1.876 13.854 1.00 0.00 C ATOM 55 OG1 THR A 4 0.603 -1.853 13.672 1.00 0.00 O ATOM 56 CG2 THR A 4 -1.499 -1.964 12.496 1.00 0.00 C ATOM 0 H THR A 4 -0.131 -1.126 16.287 1.00 0.00 H new ATOM 0 HA THR A 4 -1.201 0.236 13.914 1.00 0.00 H new ATOM 0 HB THR A 4 -1.103 -2.746 14.445 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.886 -0.949 13.422 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.174 -2.869 11.984 1.00 0.00 H new ATOM 0 HG22 THR A 4 -2.580 -1.993 12.633 1.00 0.00 H new ATOM 0 HG23 THR A 4 -1.232 -1.093 11.898 1.00 0.00 H new ATOM 64 N SER A 5 -3.528 0.172 14.720 1.00 0.00 N ATOM 65 CA SER A 5 -4.928 0.155 15.092 1.00 0.00 C ATOM 66 C SER A 5 -5.688 1.045 14.119 1.00 0.00 C ATOM 67 O SER A 5 -5.125 1.486 13.120 1.00 0.00 O ATOM 68 CB SER A 5 -5.098 0.649 16.537 1.00 0.00 C ATOM 69 OG SER A 5 -6.445 0.537 16.975 1.00 0.00 O ATOM 0 H SER A 5 -3.257 0.978 14.157 1.00 0.00 H new ATOM 0 HA SER A 5 -5.322 -0.860 15.043 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.451 0.072 17.198 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.778 1.689 16.606 1.00 0.00 H new ATOM 0 HG SER A 5 -6.517 0.858 17.898 1.00 0.00 H new ATOM 75 N LYS A 6 -6.948 1.329 14.408 1.00 0.00 N ATOM 76 CA LYS A 6 -7.737 2.191 13.541 1.00 0.00 C ATOM 77 C LYS A 6 -7.314 3.645 13.718 1.00 0.00 C ATOM 78 O LYS A 6 -7.641 4.497 12.888 1.00 0.00 O ATOM 79 CB LYS A 6 -9.232 2.058 13.839 1.00 0.00 C ATOM 80 CG LYS A 6 -9.625 2.566 15.215 1.00 0.00 C ATOM 81 CD LYS A 6 -11.075 3.008 15.246 1.00 0.00 C ATOM 82 CE LYS A 6 -11.432 3.649 16.576 1.00 0.00 C ATOM 83 NZ LYS A 6 -12.791 4.250 16.556 1.00 0.00 N ATOM 0 H LYS A 6 -7.443 0.979 15.228 1.00 0.00 H new ATOM 0 HA LYS A 6 -7.558 1.880 12.512 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -9.795 2.607 13.084 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -9.520 1.010 13.752 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -9.466 1.781 15.954 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.982 3.401 15.494 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -11.258 3.717 14.438 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -11.722 2.149 15.069 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -11.378 2.900 17.366 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -10.698 4.419 16.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -13.167 4.291 17.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -12.739 5.212 16.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -13.419 3.669 15.965 1.00 0.00 H new ATOM 97 N TYR A 7 -6.582 3.910 14.809 1.00 0.00 N ATOM 98 CA TYR A 7 -6.175 5.265 15.176 1.00 0.00 C ATOM 99 C TYR A 7 -7.395 6.128 15.464 1.00 0.00 C ATOM 100 O TYR A 7 -8.503 5.619 15.645 1.00 0.00 O ATOM 101 CB TYR A 7 -5.342 5.907 14.060 1.00 0.00 C ATOM 102 CG TYR A 7 -3.861 5.621 14.135 1.00 0.00 C ATOM 103 CD1 TYR A 7 -3.359 4.333 13.994 1.00 0.00 C ATOM 104 CD2 TYR A 7 -2.960 6.655 14.335 1.00 0.00 C ATOM 105 CE1 TYR A 7 -2.000 4.088 14.057 1.00 0.00 C ATOM 106 CE2 TYR A 7 -1.602 6.421 14.399 1.00 0.00 C ATOM 107 CZ TYR A 7 -1.124 5.136 14.261 1.00 0.00 C ATOM 108 OH TYR A 7 0.231 4.901 14.320 1.00 0.00 O ATOM 0 H TYR A 7 -6.259 3.191 15.457 1.00 0.00 H new ATOM 0 HA TYR A 7 -5.563 5.198 16.076 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -5.718 5.558 13.098 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.492 6.986 14.088 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -4.041 3.511 13.833 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -3.329 7.664 14.443 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.625 3.081 13.947 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -0.917 7.241 14.556 1.00 0.00 H new ATOM 0 HH TYR A 7 0.704 5.747 14.468 1.00 0.00 H new ATOM 118 N THR A 8 -7.188 7.428 15.542 1.00 0.00 N ATOM 119 CA THR A 8 -8.296 8.353 15.578 1.00 0.00 C ATOM 120 C THR A 8 -8.935 8.391 14.196 1.00 0.00 C ATOM 121 O THR A 8 -8.428 9.054 13.289 1.00 0.00 O ATOM 122 CB THR A 8 -7.831 9.760 15.990 1.00 0.00 C ATOM 123 OG1 THR A 8 -7.075 9.674 17.207 1.00 0.00 O ATOM 124 CG2 THR A 8 -9.018 10.694 16.184 1.00 0.00 C ATOM 0 H THR A 8 -6.266 7.863 15.581 1.00 0.00 H new ATOM 0 HA THR A 8 -9.022 8.019 16.320 1.00 0.00 H new ATOM 0 HB THR A 8 -7.207 10.166 15.194 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.776 10.569 17.470 1.00 0.00 H new ATOM 0 HG21 THR A 8 -8.660 11.682 16.475 1.00 0.00 H new ATOM 0 HG22 THR A 8 -9.577 10.771 15.251 1.00 0.00 H new ATOM 0 HG23 THR A 8 -9.668 10.299 16.965 1.00 0.00 H new ATOM 132 N ASP A 9 -10.021 7.643 14.034 1.00 0.00 N ATOM 133 CA ASP A 9 -10.653 7.458 12.727 1.00 0.00 C ATOM 134 C ASP A 9 -11.086 8.782 12.108 1.00 0.00 C ATOM 135 O ASP A 9 -11.219 8.885 10.889 1.00 0.00 O ATOM 136 CB ASP A 9 -11.842 6.496 12.827 1.00 0.00 C ATOM 137 CG ASP A 9 -12.887 6.934 13.836 1.00 0.00 C ATOM 138 OD1 ASP A 9 -13.727 7.792 13.498 1.00 0.00 O ATOM 139 OD2 ASP A 9 -12.886 6.396 14.965 1.00 0.00 O ATOM 0 H ASP A 9 -10.487 7.150 14.796 1.00 0.00 H new ATOM 0 HA ASP A 9 -9.904 7.020 12.068 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.310 6.405 11.847 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -11.477 5.506 13.099 1.00 0.00 H new ATOM 144 N GLU A 10 -11.294 9.790 12.943 1.00 0.00 N ATOM 145 CA GLU A 10 -11.594 11.130 12.459 1.00 0.00 C ATOM 146 C GLU A 10 -10.421 11.655 11.628 1.00 0.00 C ATOM 147 O GLU A 10 -10.580 12.033 10.467 1.00 0.00 O ATOM 148 CB GLU A 10 -11.852 12.070 13.639 1.00 0.00 C ATOM 149 CG GLU A 10 -12.467 13.396 13.237 1.00 0.00 C ATOM 150 CD GLU A 10 -13.872 13.231 12.703 1.00 0.00 C ATOM 151 OE1 GLU A 10 -14.026 12.854 11.527 1.00 0.00 O ATOM 152 OE2 GLU A 10 -14.831 13.470 13.463 1.00 0.00 O ATOM 0 H GLU A 10 -11.261 9.705 13.959 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.488 11.089 11.836 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.512 11.574 14.350 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.911 12.258 14.156 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.483 14.064 14.098 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.844 13.869 12.478 1.00 0.00 H new ATOM 159 N GLN A 11 -9.241 11.646 12.241 1.00 0.00 N ATOM 160 CA GLN A 11 -8.013 12.098 11.594 1.00 0.00 C ATOM 161 C GLN A 11 -7.731 11.271 10.342 1.00 0.00 C ATOM 162 O GLN A 11 -7.437 11.815 9.277 1.00 0.00 O ATOM 163 CB GLN A 11 -6.839 11.978 12.577 1.00 0.00 C ATOM 164 CG GLN A 11 -5.500 12.434 12.018 1.00 0.00 C ATOM 165 CD GLN A 11 -5.457 13.919 11.730 1.00 0.00 C ATOM 166 OE1 GLN A 11 -5.785 14.362 10.632 1.00 0.00 O ATOM 167 NE2 GLN A 11 -5.053 14.701 12.718 1.00 0.00 N ATOM 0 H GLN A 11 -9.109 11.325 13.200 1.00 0.00 H new ATOM 0 HA GLN A 11 -8.134 13.140 11.299 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -7.066 12.565 13.467 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -6.751 10.939 12.894 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -4.711 12.184 12.728 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -5.289 11.885 11.100 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -4.789 14.294 13.615 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -5.005 15.711 12.582 1.00 0.00 H new ATOM 176 N VAL A 12 -7.848 9.954 10.479 1.00 0.00 N ATOM 177 CA VAL A 12 -7.573 9.035 9.382 1.00 0.00 C ATOM 178 C VAL A 12 -8.490 9.309 8.189 1.00 0.00 C ATOM 179 O VAL A 12 -8.028 9.377 7.047 1.00 0.00 O ATOM 180 CB VAL A 12 -7.738 7.568 9.829 1.00 0.00 C ATOM 181 CG1 VAL A 12 -7.506 6.619 8.665 1.00 0.00 C ATOM 182 CG2 VAL A 12 -6.789 7.248 10.977 1.00 0.00 C ATOM 0 H VAL A 12 -8.133 9.498 11.345 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.539 9.198 9.079 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.761 7.433 10.179 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -7.628 5.590 9.004 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.228 6.828 7.875 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.496 6.757 8.279 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.920 6.209 11.279 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.760 7.405 10.653 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -7.007 7.901 11.822 1.00 0.00 H new ATOM 192 N GLU A 13 -9.781 9.480 8.463 1.00 0.00 N ATOM 193 CA GLU A 13 -10.759 9.761 7.413 1.00 0.00 C ATOM 194 C GLU A 13 -10.386 11.024 6.649 1.00 0.00 C ATOM 195 O GLU A 13 -10.398 11.043 5.421 1.00 0.00 O ATOM 196 CB GLU A 13 -12.157 9.924 8.007 1.00 0.00 C ATOM 197 CG GLU A 13 -13.223 10.250 6.972 1.00 0.00 C ATOM 198 CD GLU A 13 -14.575 10.518 7.596 1.00 0.00 C ATOM 199 OE1 GLU A 13 -14.839 11.677 7.974 1.00 0.00 O ATOM 200 OE2 GLU A 13 -15.375 9.566 7.719 1.00 0.00 O ATOM 0 H GLU A 13 -10.175 9.429 9.402 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.758 8.915 6.725 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.433 9.005 8.524 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -12.135 10.716 8.756 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.912 11.123 6.398 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -13.309 9.421 6.270 1.00 0.00 H new ATOM 207 N LYS A 14 -10.044 12.070 7.389 1.00 0.00 N ATOM 208 CA LYS A 14 -9.710 13.359 6.794 1.00 0.00 C ATOM 209 C LYS A 14 -8.469 13.251 5.919 1.00 0.00 C ATOM 210 O LYS A 14 -8.412 13.833 4.837 1.00 0.00 O ATOM 211 CB LYS A 14 -9.516 14.421 7.879 1.00 0.00 C ATOM 212 CG LYS A 14 -10.803 15.135 8.276 1.00 0.00 C ATOM 213 CD LYS A 14 -11.919 14.159 8.623 1.00 0.00 C ATOM 214 CE LYS A 14 -13.207 14.887 8.967 1.00 0.00 C ATOM 215 NZ LYS A 14 -14.343 13.952 9.189 1.00 0.00 N ATOM 0 H LYS A 14 -9.990 12.052 8.407 1.00 0.00 H new ATOM 0 HA LYS A 14 -10.543 13.664 6.161 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.085 13.950 8.763 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -8.795 15.159 7.527 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -10.609 15.781 9.132 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.127 15.778 7.458 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.092 13.488 7.781 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -11.613 13.540 9.466 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -13.054 15.488 9.863 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -13.459 15.576 8.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -15.236 14.429 8.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.227 13.114 8.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -14.361 13.658 10.186 1.00 0.00 H new ATOM 229 N ILE A 15 -7.484 12.492 6.384 1.00 0.00 N ATOM 230 CA ILE A 15 -6.272 12.262 5.612 1.00 0.00 C ATOM 231 C ILE A 15 -6.590 11.502 4.327 1.00 0.00 C ATOM 232 O ILE A 15 -6.220 11.933 3.231 1.00 0.00 O ATOM 233 CB ILE A 15 -5.216 11.483 6.428 1.00 0.00 C ATOM 234 CG1 ILE A 15 -4.794 12.294 7.655 1.00 0.00 C ATOM 235 CG2 ILE A 15 -4.005 11.163 5.563 1.00 0.00 C ATOM 236 CD1 ILE A 15 -3.791 11.591 8.546 1.00 0.00 C ATOM 0 H ILE A 15 -7.502 12.026 7.291 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.858 13.239 5.361 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.658 10.545 6.763 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.368 13.240 7.323 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -5.681 12.533 8.242 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.271 10.614 6.153 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.315 10.555 4.713 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.560 12.090 5.202 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.544 12.232 9.392 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.220 10.658 8.911 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.886 11.377 7.977 1.00 0.00 H new ATOM 248 N LEU A 16 -7.293 10.381 4.467 1.00 0.00 N ATOM 249 CA LEU A 16 -7.661 9.555 3.323 1.00 0.00 C ATOM 250 C LEU A 16 -8.520 10.338 2.328 1.00 0.00 C ATOM 251 O LEU A 16 -8.328 10.235 1.115 1.00 0.00 O ATOM 252 CB LEU A 16 -8.424 8.309 3.785 1.00 0.00 C ATOM 253 CG LEU A 16 -7.591 7.268 4.533 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.478 6.144 5.043 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.508 6.714 3.624 1.00 0.00 C ATOM 0 H LEU A 16 -7.620 10.024 5.365 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.740 9.252 2.826 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.244 8.625 4.430 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.870 7.833 2.912 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.118 7.750 5.389 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.869 5.412 5.573 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.228 6.551 5.721 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.974 5.662 4.201 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.921 5.973 4.167 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.968 6.245 2.754 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.857 7.525 3.298 1.00 0.00 H new ATOM 267 N ALA A 17 -9.458 11.123 2.854 1.00 0.00 N ATOM 268 CA ALA A 17 -10.373 11.899 2.023 1.00 0.00 C ATOM 269 C ALA A 17 -9.618 12.870 1.125 1.00 0.00 C ATOM 270 O ALA A 17 -9.936 13.009 -0.059 1.00 0.00 O ATOM 271 CB ALA A 17 -11.371 12.651 2.894 1.00 0.00 C ATOM 0 H ALA A 17 -9.604 11.238 3.857 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.916 11.203 1.383 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -12.047 13.225 2.260 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.946 11.939 3.486 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.835 13.328 3.560 1.00 0.00 H new ATOM 277 N GLU A 18 -8.615 13.538 1.683 1.00 0.00 N ATOM 278 CA GLU A 18 -7.828 14.490 0.913 1.00 0.00 C ATOM 279 C GLU A 18 -6.960 13.775 -0.117 1.00 0.00 C ATOM 280 O GLU A 18 -6.822 14.241 -1.244 1.00 0.00 O ATOM 281 CB GLU A 18 -6.966 15.363 1.821 1.00 0.00 C ATOM 282 CG GLU A 18 -7.772 16.355 2.643 1.00 0.00 C ATOM 283 CD GLU A 18 -6.902 17.355 3.369 1.00 0.00 C ATOM 284 OE1 GLU A 18 -6.372 18.275 2.710 1.00 0.00 O ATOM 285 OE2 GLU A 18 -6.756 17.238 4.600 1.00 0.00 O ATOM 0 H GLU A 18 -8.330 13.439 2.657 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.527 15.139 0.385 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.396 14.723 2.494 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.245 15.908 1.212 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.461 16.888 1.988 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.377 15.812 3.369 1.00 0.00 H new ATOM 292 N VAL A 19 -6.394 12.636 0.262 1.00 0.00 N ATOM 293 CA VAL A 19 -5.593 11.847 -0.665 1.00 0.00 C ATOM 294 C VAL A 19 -6.446 11.384 -1.843 1.00 0.00 C ATOM 295 O VAL A 19 -6.050 11.522 -3.001 1.00 0.00 O ATOM 296 CB VAL A 19 -4.957 10.622 0.025 1.00 0.00 C ATOM 297 CG1 VAL A 19 -4.173 9.782 -0.972 1.00 0.00 C ATOM 298 CG2 VAL A 19 -4.054 11.063 1.168 1.00 0.00 C ATOM 0 H VAL A 19 -6.474 12.240 1.199 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.789 12.489 -1.025 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.761 10.008 0.431 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.735 8.925 -0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.842 9.432 -1.758 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.380 10.386 -1.412 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.614 10.186 1.643 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.261 11.702 0.779 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.640 11.618 1.901 1.00 0.00 H new ATOM 308 N ALA A 20 -7.632 10.861 -1.538 1.00 0.00 N ATOM 309 CA ALA A 20 -8.561 10.403 -2.566 1.00 0.00 C ATOM 310 C ALA A 20 -9.009 11.562 -3.449 1.00 0.00 C ATOM 311 O ALA A 20 -9.194 11.403 -4.658 1.00 0.00 O ATOM 312 CB ALA A 20 -9.763 9.724 -1.929 1.00 0.00 C ATOM 0 H ALA A 20 -7.972 10.744 -0.583 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.044 9.678 -3.195 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.447 9.388 -2.709 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.429 8.866 -1.345 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.276 10.430 -1.276 1.00 0.00 H new ATOM 318 N LEU A 21 -9.180 12.727 -2.836 1.00 0.00 N ATOM 319 CA LEU A 21 -9.538 13.932 -3.565 1.00 0.00 C ATOM 320 C LEU A 21 -8.434 14.298 -4.549 1.00 0.00 C ATOM 321 O LEU A 21 -8.712 14.642 -5.694 1.00 0.00 O ATOM 322 CB LEU A 21 -9.807 15.089 -2.591 1.00 0.00 C ATOM 323 CG LEU A 21 -10.242 16.410 -3.234 1.00 0.00 C ATOM 324 CD1 LEU A 21 -11.231 17.133 -2.337 1.00 0.00 C ATOM 325 CD2 LEU A 21 -9.037 17.301 -3.501 1.00 0.00 C ATOM 0 H LEU A 21 -9.075 12.860 -1.830 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.452 13.743 -4.128 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.579 14.776 -1.888 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.902 15.269 -2.011 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.725 16.183 -4.185 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.531 18.070 -2.807 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -12.109 16.506 -2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -10.764 17.343 -1.375 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.368 18.234 -3.958 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.529 17.517 -2.561 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.350 16.791 -4.176 1.00 0.00 H new ATOM 337 N VAL A 22 -7.183 14.200 -4.104 1.00 0.00 N ATOM 338 CA VAL A 22 -6.038 14.481 -4.962 1.00 0.00 C ATOM 339 C VAL A 22 -6.015 13.522 -6.144 1.00 0.00 C ATOM 340 O VAL A 22 -5.737 13.921 -7.280 1.00 0.00 O ATOM 341 CB VAL A 22 -4.706 14.375 -4.186 1.00 0.00 C ATOM 342 CG1 VAL A 22 -3.517 14.484 -5.129 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.630 15.446 -3.112 1.00 0.00 C ATOM 0 H VAL A 22 -6.938 13.927 -3.152 1.00 0.00 H new ATOM 0 HA VAL A 22 -6.143 15.504 -5.323 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.671 13.397 -3.706 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.592 14.406 -4.558 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.559 13.679 -5.863 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.547 15.445 -5.643 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.686 15.357 -2.575 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.692 16.431 -3.575 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.457 15.320 -2.414 1.00 0.00 H new ATOM 353 N LEU A 23 -6.322 12.261 -5.869 1.00 0.00 N ATOM 354 CA LEU A 23 -6.375 11.240 -6.902 1.00 0.00 C ATOM 355 C LEU A 23 -7.392 11.624 -7.972 1.00 0.00 C ATOM 356 O LEU A 23 -7.082 11.634 -9.160 1.00 0.00 O ATOM 357 CB LEU A 23 -6.735 9.881 -6.294 1.00 0.00 C ATOM 358 CG LEU A 23 -5.799 9.395 -5.185 1.00 0.00 C ATOM 359 CD1 LEU A 23 -6.259 8.048 -4.651 1.00 0.00 C ATOM 360 CD2 LEU A 23 -4.367 9.313 -5.692 1.00 0.00 C ATOM 0 H LEU A 23 -6.539 11.921 -4.932 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.391 11.164 -7.364 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.748 9.936 -5.894 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.747 9.136 -7.090 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.830 10.115 -4.367 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.582 7.718 -3.863 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.267 8.142 -4.247 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -6.259 7.317 -5.459 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.716 8.966 -4.890 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -4.316 8.615 -6.528 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -4.041 10.299 -6.022 1.00 0.00 H new ATOM 372 N GLU A 24 -8.594 11.975 -7.538 1.00 0.00 N ATOM 373 CA GLU A 24 -9.648 12.381 -8.459 1.00 0.00 C ATOM 374 C GLU A 24 -9.288 13.695 -9.152 1.00 0.00 C ATOM 375 O GLU A 24 -9.472 13.843 -10.361 1.00 0.00 O ATOM 376 CB GLU A 24 -10.979 12.533 -7.718 1.00 0.00 C ATOM 377 CG GLU A 24 -12.110 12.995 -8.624 1.00 0.00 C ATOM 378 CD GLU A 24 -13.432 13.108 -7.907 1.00 0.00 C ATOM 379 OE1 GLU A 24 -13.638 14.104 -7.184 1.00 0.00 O ATOM 380 OE2 GLU A 24 -14.284 12.212 -8.085 1.00 0.00 O ATOM 0 H GLU A 24 -8.864 11.987 -6.555 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.750 11.604 -9.216 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.249 11.579 -7.266 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.857 13.248 -6.904 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.852 13.963 -9.053 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.212 12.296 -9.454 1.00 0.00 H new ATOM 387 N LYS A 25 -8.754 14.628 -8.377 1.00 0.00 N ATOM 388 CA LYS A 25 -8.432 15.964 -8.861 1.00 0.00 C ATOM 389 C LYS A 25 -7.383 15.921 -9.972 1.00 0.00 C ATOM 390 O LYS A 25 -7.399 16.743 -10.885 1.00 0.00 O ATOM 391 CB LYS A 25 -7.932 16.822 -7.696 1.00 0.00 C ATOM 392 CG LYS A 25 -7.855 18.304 -8.002 1.00 0.00 C ATOM 393 CD LYS A 25 -7.389 19.090 -6.790 1.00 0.00 C ATOM 394 CE LYS A 25 -7.526 20.582 -7.013 1.00 0.00 C ATOM 395 NZ LYS A 25 -8.947 20.994 -7.172 1.00 0.00 N ATOM 0 H LYS A 25 -8.531 14.480 -7.393 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.337 16.404 -9.280 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.592 16.673 -6.841 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.943 16.472 -7.400 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.170 18.472 -8.833 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.834 18.664 -8.318 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.972 18.796 -5.917 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.349 18.847 -6.575 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.086 21.116 -6.171 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.964 20.869 -7.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.033 22.016 -7.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.266 20.776 -8.138 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.537 20.478 -6.488 1.00 0.00 H new ATOM 409 N HIS A 26 -6.472 14.961 -9.890 1.00 0.00 N ATOM 410 CA HIS A 26 -5.418 14.828 -10.889 1.00 0.00 C ATOM 411 C HIS A 26 -5.710 13.683 -11.857 1.00 0.00 C ATOM 412 O HIS A 26 -4.841 13.292 -12.634 1.00 0.00 O ATOM 413 CB HIS A 26 -4.056 14.613 -10.219 1.00 0.00 C ATOM 414 CG HIS A 26 -3.486 15.844 -9.577 1.00 0.00 C ATOM 415 ND1 HIS A 26 -2.536 16.631 -10.187 1.00 0.00 N ATOM 416 CD2 HIS A 26 -3.714 16.410 -8.365 1.00 0.00 C ATOM 417 CE1 HIS A 26 -2.202 17.621 -9.382 1.00 0.00 C ATOM 418 NE2 HIS A 26 -2.900 17.511 -8.269 1.00 0.00 N ATOM 0 H HIS A 26 -6.440 14.265 -9.145 1.00 0.00 H new ATOM 0 HA HIS A 26 -5.388 15.758 -11.457 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -4.154 13.835 -9.462 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -3.351 14.246 -10.964 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -4.407 16.059 -7.615 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.478 18.393 -9.598 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.844 18.140 -7.468 1.00 0.00 H new ATOM 427 N ALA A 27 -6.938 13.155 -11.798 1.00 0.00 N ATOM 428 CA ALA A 27 -7.383 12.085 -12.699 1.00 0.00 C ATOM 429 C ALA A 27 -6.483 10.850 -12.604 1.00 0.00 C ATOM 430 O ALA A 27 -6.234 10.170 -13.602 1.00 0.00 O ATOM 431 CB ALA A 27 -7.440 12.595 -14.133 1.00 0.00 C ATOM 0 H ALA A 27 -7.647 13.455 -11.129 1.00 0.00 H new ATOM 0 HA ALA A 27 -8.383 11.784 -12.388 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.771 11.792 -14.792 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -8.140 13.428 -14.195 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.449 12.930 -14.440 1.00 0.00 H new ATOM 437 N ALA A 28 -6.029 10.551 -11.395 1.00 0.00 N ATOM 438 CA ALA A 28 -5.130 9.430 -11.167 1.00 0.00 C ATOM 439 C ALA A 28 -5.832 8.096 -11.403 1.00 0.00 C ATOM 440 O ALA A 28 -6.818 7.768 -10.735 1.00 0.00 O ATOM 441 CB ALA A 28 -4.560 9.488 -9.759 1.00 0.00 C ATOM 0 H ALA A 28 -6.271 11.073 -10.553 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.312 9.506 -11.883 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.889 8.643 -9.603 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -4.008 10.419 -9.628 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.374 9.444 -9.035 1.00 0.00 H new ATOM 447 N SER A 29 -5.314 7.337 -12.361 1.00 0.00 N ATOM 448 CA SER A 29 -5.840 6.017 -12.686 1.00 0.00 C ATOM 449 C SER A 29 -5.701 5.079 -11.482 1.00 0.00 C ATOM 450 O SER A 29 -4.788 5.247 -10.672 1.00 0.00 O ATOM 451 CB SER A 29 -5.076 5.456 -13.895 1.00 0.00 C ATOM 452 OG SER A 29 -5.640 4.243 -14.360 1.00 0.00 O ATOM 0 H SER A 29 -4.518 7.619 -12.934 1.00 0.00 H new ATOM 0 HA SER A 29 -6.899 6.097 -12.933 1.00 0.00 H new ATOM 0 HB2 SER A 29 -5.081 6.191 -14.700 1.00 0.00 H new ATOM 0 HB3 SER A 29 -4.034 5.290 -13.621 1.00 0.00 H new ATOM 0 HG SER A 29 -5.128 3.918 -15.130 1.00 0.00 H new ATOM 458 N PRO A 30 -6.616 4.098 -11.330 1.00 0.00 N ATOM 459 CA PRO A 30 -6.564 3.113 -10.240 1.00 0.00 C ATOM 460 C PRO A 30 -5.196 2.441 -10.115 1.00 0.00 C ATOM 461 O PRO A 30 -4.687 2.261 -9.008 1.00 0.00 O ATOM 462 CB PRO A 30 -7.638 2.081 -10.620 1.00 0.00 C ATOM 463 CG PRO A 30 -8.045 2.412 -12.019 1.00 0.00 C ATOM 464 CD PRO A 30 -7.782 3.877 -12.194 1.00 0.00 C ATOM 0 HA PRO A 30 -6.735 3.584 -9.272 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -7.245 1.066 -10.557 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -8.490 2.135 -9.942 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -7.475 1.825 -12.740 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -9.098 2.183 -12.183 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.570 4.130 -13.233 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -8.635 4.482 -11.886 1.00 0.00 H new ATOM 472 N GLU A 31 -4.608 2.086 -11.254 1.00 0.00 N ATOM 473 CA GLU A 31 -3.274 1.496 -11.280 1.00 0.00 C ATOM 474 C GLU A 31 -2.251 2.475 -10.712 1.00 0.00 C ATOM 475 O GLU A 31 -1.422 2.117 -9.875 1.00 0.00 O ATOM 476 CB GLU A 31 -2.894 1.118 -12.709 1.00 0.00 C ATOM 477 CG GLU A 31 -3.793 0.058 -13.321 1.00 0.00 C ATOM 478 CD GLU A 31 -3.756 -1.248 -12.556 1.00 0.00 C ATOM 479 OE1 GLU A 31 -2.772 -2.005 -12.713 1.00 0.00 O ATOM 480 OE2 GLU A 31 -4.707 -1.518 -11.796 1.00 0.00 O ATOM 0 H GLU A 31 -5.036 2.197 -12.173 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.280 0.596 -10.665 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.925 2.012 -13.332 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.865 0.758 -12.719 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -4.818 0.429 -13.351 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.488 -0.120 -14.352 1.00 0.00 H new ATOM 487 N LEU A 32 -2.334 3.721 -11.164 1.00 0.00 N ATOM 488 CA LEU A 32 -1.458 4.780 -10.676 1.00 0.00 C ATOM 489 C LEU A 32 -1.642 4.968 -9.170 1.00 0.00 C ATOM 490 O LEU A 32 -0.677 5.176 -8.438 1.00 0.00 O ATOM 491 CB LEU A 32 -1.756 6.090 -11.418 1.00 0.00 C ATOM 492 CG LEU A 32 -0.929 7.301 -10.981 1.00 0.00 C ATOM 493 CD1 LEU A 32 0.551 7.062 -11.235 1.00 0.00 C ATOM 494 CD2 LEU A 32 -1.396 8.551 -11.710 1.00 0.00 C ATOM 0 H LEU A 32 -3.003 4.024 -11.872 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.423 4.497 -10.865 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.594 5.928 -12.484 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.812 6.328 -11.288 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.073 7.446 -9.910 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.120 7.935 -10.917 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.881 6.189 -10.671 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.714 6.890 -12.299 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.798 9.404 -11.389 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.280 8.410 -12.785 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.445 8.736 -11.480 1.00 0.00 H new ATOM 506 N THR A 33 -2.888 4.869 -8.724 1.00 0.00 N ATOM 507 CA THR A 33 -3.228 4.984 -7.311 1.00 0.00 C ATOM 508 C THR A 33 -2.458 3.969 -6.469 1.00 0.00 C ATOM 509 O THR A 33 -1.834 4.318 -5.464 1.00 0.00 O ATOM 510 CB THR A 33 -4.740 4.765 -7.103 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.483 5.744 -7.841 1.00 0.00 O ATOM 512 CG2 THR A 33 -5.109 4.839 -5.629 1.00 0.00 C ATOM 0 H THR A 33 -3.691 4.707 -9.331 1.00 0.00 H new ATOM 0 HA THR A 33 -2.952 5.988 -6.990 1.00 0.00 H new ATOM 0 HB THR A 33 -4.991 3.769 -7.467 1.00 0.00 H new ATOM 0 HG1 THR A 33 -5.324 5.620 -8.800 1.00 0.00 H new ATOM 0 HG21 THR A 33 -6.181 4.681 -5.514 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.568 4.069 -5.079 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.843 5.820 -5.236 1.00 0.00 H new ATOM 520 N LEU A 34 -2.492 2.716 -6.894 1.00 0.00 N ATOM 521 CA LEU A 34 -1.867 1.646 -6.140 1.00 0.00 C ATOM 522 C LEU A 34 -0.345 1.721 -6.264 1.00 0.00 C ATOM 523 O LEU A 34 0.381 1.405 -5.319 1.00 0.00 O ATOM 524 CB LEU A 34 -2.407 0.292 -6.615 1.00 0.00 C ATOM 525 CG LEU A 34 -2.088 -0.896 -5.707 1.00 0.00 C ATOM 526 CD1 LEU A 34 -3.227 -1.901 -5.722 1.00 0.00 C ATOM 527 CD2 LEU A 34 -0.796 -1.570 -6.139 1.00 0.00 C ATOM 0 H LEU A 34 -2.946 2.417 -7.757 1.00 0.00 H new ATOM 0 HA LEU A 34 -2.113 1.758 -5.084 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.489 0.368 -6.719 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -2.005 0.087 -7.607 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.964 -0.521 -4.691 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -2.981 -2.739 -5.070 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.140 -1.422 -5.368 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.378 -2.264 -6.738 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.587 -2.413 -5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.897 -1.927 -7.164 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.024 -0.854 -6.083 1.00 0.00 H new ATOM 539 N MET A 35 0.132 2.170 -7.420 1.00 0.00 N ATOM 540 CA MET A 35 1.563 2.341 -7.640 1.00 0.00 C ATOM 541 C MET A 35 2.101 3.452 -6.734 1.00 0.00 C ATOM 542 O MET A 35 3.233 3.385 -6.247 1.00 0.00 O ATOM 543 CB MET A 35 1.840 2.648 -9.119 1.00 0.00 C ATOM 544 CG MET A 35 3.307 2.525 -9.517 1.00 0.00 C ATOM 545 SD MET A 35 4.238 4.052 -9.291 1.00 0.00 S ATOM 546 CE MET A 35 3.441 5.098 -10.505 1.00 0.00 C ATOM 0 H MET A 35 -0.451 2.422 -8.218 1.00 0.00 H new ATOM 0 HA MET A 35 2.079 1.415 -7.387 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.249 1.971 -9.736 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.499 3.660 -9.339 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.771 1.734 -8.928 1.00 0.00 H new ATOM 0 HG3 MET A 35 3.368 2.222 -10.562 1.00 0.00 H new ATOM 0 HE1 MET A 35 4.186 5.475 -11.206 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.692 4.521 -11.047 1.00 0.00 H new ATOM 0 HE3 MET A 35 2.959 5.937 -10.002 1.00 0.00 H new ATOM 556 N ILE A 36 1.273 4.462 -6.491 1.00 0.00 N ATOM 557 CA ILE A 36 1.607 5.524 -5.550 1.00 0.00 C ATOM 558 C ILE A 36 1.745 4.963 -4.136 1.00 0.00 C ATOM 559 O ILE A 36 2.684 5.306 -3.413 1.00 0.00 O ATOM 560 CB ILE A 36 0.547 6.649 -5.581 1.00 0.00 C ATOM 561 CG1 ILE A 36 0.738 7.504 -6.836 1.00 0.00 C ATOM 562 CG2 ILE A 36 0.600 7.506 -4.323 1.00 0.00 C ATOM 563 CD1 ILE A 36 -0.251 8.642 -6.958 1.00 0.00 C ATOM 0 H ILE A 36 0.361 4.567 -6.935 1.00 0.00 H new ATOM 0 HA ILE A 36 2.563 5.951 -5.852 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.441 6.189 -5.611 1.00 0.00 H new ATOM 0 HG12 ILE A 36 1.749 7.912 -6.835 1.00 0.00 H new ATOM 0 HG13 ILE A 36 0.653 6.866 -7.715 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -0.159 8.286 -4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.413 6.882 -3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 36 1.585 7.965 -4.237 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -0.051 9.201 -7.872 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -1.264 8.241 -6.992 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.151 9.304 -6.098 1.00 0.00 H new ATOM 575 N ALA A 37 0.825 4.077 -3.760 1.00 0.00 N ATOM 576 CA ALA A 37 0.877 3.422 -2.455 1.00 0.00 C ATOM 577 C ALA A 37 2.184 2.652 -2.294 1.00 0.00 C ATOM 578 O ALA A 37 2.744 2.575 -1.199 1.00 0.00 O ATOM 579 CB ALA A 37 -0.316 2.494 -2.276 1.00 0.00 C ATOM 0 H ALA A 37 0.035 3.796 -4.341 1.00 0.00 H new ATOM 0 HA ALA A 37 0.834 4.190 -1.683 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.261 2.015 -1.299 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.239 3.070 -2.346 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.304 1.732 -3.055 1.00 0.00 H new ATOM 585 N GLY A 38 2.664 2.095 -3.399 1.00 0.00 N ATOM 586 CA GLY A 38 3.935 1.402 -3.397 1.00 0.00 C ATOM 587 C GLY A 38 5.086 2.323 -3.062 1.00 0.00 C ATOM 588 O GLY A 38 5.945 1.983 -2.246 1.00 0.00 O ATOM 0 H GLY A 38 2.190 2.112 -4.302 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.902 0.587 -2.674 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.104 0.953 -4.376 1.00 0.00 H new ATOM 592 N ASN A 39 5.097 3.496 -3.687 1.00 0.00 N ATOM 593 CA ASN A 39 6.122 4.499 -3.416 1.00 0.00 C ATOM 594 C ASN A 39 6.094 4.905 -1.952 1.00 0.00 C ATOM 595 O ASN A 39 7.142 5.054 -1.320 1.00 0.00 O ATOM 596 CB ASN A 39 5.931 5.735 -4.301 1.00 0.00 C ATOM 597 CG ASN A 39 6.468 5.540 -5.705 1.00 0.00 C ATOM 598 OD1 ASN A 39 7.636 5.808 -5.975 1.00 0.00 O ATOM 599 ND2 ASN A 39 5.626 5.071 -6.611 1.00 0.00 N ATOM 0 H ASN A 39 4.408 3.776 -4.385 1.00 0.00 H new ATOM 0 HA ASN A 39 7.091 4.056 -3.645 1.00 0.00 H new ATOM 0 HB2 ASN A 39 4.870 5.978 -4.353 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.431 6.587 -3.840 1.00 0.00 H new ATOM 0 HD21 ASN A 39 5.940 4.921 -7.570 1.00 0.00 H new ATOM 0 HD22 ASN A 39 4.663 4.859 -6.351 1.00 0.00 H new ATOM 606 N ILE A 40 4.889 5.072 -1.418 1.00 0.00 N ATOM 607 CA ILE A 40 4.712 5.422 -0.017 1.00 0.00 C ATOM 608 C ILE A 40 5.364 4.371 0.881 1.00 0.00 C ATOM 609 O ILE A 40 6.267 4.684 1.655 1.00 0.00 O ATOM 610 CB ILE A 40 3.216 5.558 0.353 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.551 6.655 -0.487 1.00 0.00 C ATOM 612 CG2 ILE A 40 3.054 5.858 1.838 1.00 0.00 C ATOM 613 CD1 ILE A 40 1.058 6.780 -0.256 1.00 0.00 C ATOM 0 H ILE A 40 4.018 4.970 -1.939 1.00 0.00 H new ATOM 0 HA ILE A 40 5.193 6.387 0.140 1.00 0.00 H new ATOM 0 HB ILE A 40 2.725 4.609 0.137 1.00 0.00 H new ATOM 0 HG12 ILE A 40 3.026 7.610 -0.262 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.730 6.451 -1.543 1.00 0.00 H new ATOM 0 HG21 ILE A 40 1.995 5.950 2.077 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.489 5.047 2.423 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.562 6.792 2.078 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.658 7.576 -0.884 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.571 5.838 -0.509 1.00 0.00 H new ATOM 0 HD13 ILE A 40 0.870 7.016 0.792 1.00 0.00 H new ATOM 625 N ALA A 41 4.921 3.123 0.748 1.00 0.00 N ATOM 626 CA ALA A 41 5.444 2.031 1.557 1.00 0.00 C ATOM 627 C ALA A 41 6.959 1.908 1.411 1.00 0.00 C ATOM 628 O ALA A 41 7.675 1.803 2.403 1.00 0.00 O ATOM 629 CB ALA A 41 4.766 0.723 1.176 1.00 0.00 C ATOM 0 H ALA A 41 4.198 2.845 0.084 1.00 0.00 H new ATOM 0 HA ALA A 41 5.227 2.251 2.602 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.166 -0.086 1.788 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.692 0.808 1.343 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.954 0.509 0.124 1.00 0.00 H new ATOM 635 N THR A 42 7.438 1.948 0.172 1.00 0.00 N ATOM 636 CA THR A 42 8.859 1.804 -0.109 1.00 0.00 C ATOM 637 C THR A 42 9.683 2.879 0.600 1.00 0.00 C ATOM 638 O THR A 42 10.681 2.572 1.247 1.00 0.00 O ATOM 639 CB THR A 42 9.140 1.863 -1.626 1.00 0.00 C ATOM 640 OG1 THR A 42 8.368 0.865 -2.304 1.00 0.00 O ATOM 641 CG2 THR A 42 10.619 1.647 -1.924 1.00 0.00 C ATOM 0 H THR A 42 6.858 2.080 -0.657 1.00 0.00 H new ATOM 0 HA THR A 42 9.156 0.826 0.270 1.00 0.00 H new ATOM 0 HB THR A 42 8.858 2.854 -1.981 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.427 1.138 -2.326 1.00 0.00 H new ATOM 0 HG21 THR A 42 10.784 1.694 -3.000 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.206 2.423 -1.432 1.00 0.00 H new ATOM 0 HG23 THR A 42 10.926 0.669 -1.553 1.00 0.00 H new ATOM 649 N ASN A 43 9.252 4.133 0.500 1.00 0.00 N ATOM 650 CA ASN A 43 10.004 5.241 1.086 1.00 0.00 C ATOM 651 C ASN A 43 9.927 5.189 2.613 1.00 0.00 C ATOM 652 O ASN A 43 10.913 5.460 3.298 1.00 0.00 O ATOM 653 CB ASN A 43 9.484 6.584 0.551 1.00 0.00 C ATOM 654 CG ASN A 43 10.434 7.744 0.819 1.00 0.00 C ATOM 655 OD1 ASN A 43 11.108 7.799 1.844 1.00 0.00 O ATOM 656 ND2 ASN A 43 10.506 8.677 -0.120 1.00 0.00 N ATOM 0 H ASN A 43 8.393 4.407 0.023 1.00 0.00 H new ATOM 0 HA ASN A 43 11.051 5.146 0.797 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.317 6.500 -0.523 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.518 6.801 1.008 1.00 0.00 H new ATOM 0 HD21 ASN A 43 11.135 9.471 -0.003 1.00 0.00 H new ATOM 0 HD22 ASN A 43 9.932 8.601 -0.960 1.00 0.00 H new ATOM 663 N VAL A 44 8.766 4.811 3.147 1.00 0.00 N ATOM 664 CA VAL A 44 8.620 4.643 4.589 1.00 0.00 C ATOM 665 C VAL A 44 9.571 3.560 5.090 1.00 0.00 C ATOM 666 O VAL A 44 10.313 3.768 6.049 1.00 0.00 O ATOM 667 CB VAL A 44 7.170 4.290 4.997 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.078 4.005 6.490 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.223 5.417 4.621 1.00 0.00 C ATOM 0 H VAL A 44 7.922 4.617 2.608 1.00 0.00 H new ATOM 0 HA VAL A 44 8.869 5.599 5.049 1.00 0.00 H new ATOM 0 HB VAL A 44 6.878 3.389 4.457 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.049 3.760 6.751 1.00 0.00 H new ATOM 0 HG12 VAL A 44 7.726 3.165 6.741 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.394 4.886 7.049 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.207 5.152 4.915 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.523 6.331 5.134 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.258 5.578 3.544 1.00 0.00 H new ATOM 679 N LEU A 45 9.574 2.421 4.406 1.00 0.00 N ATOM 680 CA LEU A 45 10.463 1.312 4.745 1.00 0.00 C ATOM 681 C LEU A 45 11.925 1.701 4.556 1.00 0.00 C ATOM 682 O LEU A 45 12.824 1.111 5.154 1.00 0.00 O ATOM 683 CB LEU A 45 10.146 0.101 3.865 1.00 0.00 C ATOM 684 CG LEU A 45 8.770 -0.533 4.087 1.00 0.00 C ATOM 685 CD1 LEU A 45 8.498 -1.605 3.042 1.00 0.00 C ATOM 686 CD2 LEU A 45 8.681 -1.122 5.484 1.00 0.00 C ATOM 0 H LEU A 45 8.966 2.240 3.607 1.00 0.00 H new ATOM 0 HA LEU A 45 10.302 1.061 5.793 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.223 0.403 2.820 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.909 -0.659 4.035 1.00 0.00 H new ATOM 0 HG LEU A 45 8.012 0.244 3.986 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.515 -2.043 3.217 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.524 -1.159 2.048 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.259 -2.382 3.111 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.698 -1.569 5.628 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.449 -1.886 5.606 1.00 0.00 H new ATOM 0 HD23 LEU A 45 8.833 -0.334 6.222 1.00 0.00 H new ATOM 698 N ASN A 46 12.146 2.702 3.728 1.00 0.00 N ATOM 699 CA ASN A 46 13.486 3.091 3.334 1.00 0.00 C ATOM 700 C ASN A 46 14.078 4.127 4.286 1.00 0.00 C ATOM 701 O ASN A 46 15.135 3.908 4.874 1.00 0.00 O ATOM 702 CB ASN A 46 13.427 3.657 1.919 1.00 0.00 C ATOM 703 CG ASN A 46 14.717 3.507 1.148 1.00 0.00 C ATOM 704 OD1 ASN A 46 15.816 3.604 1.697 1.00 0.00 O ATOM 705 ND2 ASN A 46 14.582 3.239 -0.139 1.00 0.00 N ATOM 0 H ASN A 46 11.406 3.267 3.311 1.00 0.00 H new ATOM 0 HA ASN A 46 14.132 2.214 3.370 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.627 3.158 1.371 1.00 0.00 H new ATOM 0 HB3 ASN A 46 13.167 4.714 1.971 1.00 0.00 H new ATOM 0 HD21 ASN A 46 15.409 3.103 -0.721 1.00 0.00 H new ATOM 0 HD22 ASN A 46 13.651 3.168 -0.550 1.00 0.00 H new ATOM 712 N GLN A 47 13.386 5.250 4.448 1.00 0.00 N ATOM 713 CA GLN A 47 13.954 6.390 5.158 1.00 0.00 C ATOM 714 C GLN A 47 13.095 6.829 6.346 1.00 0.00 C ATOM 715 O GLN A 47 13.427 7.799 7.026 1.00 0.00 O ATOM 716 CB GLN A 47 14.110 7.565 4.187 1.00 0.00 C ATOM 717 CG GLN A 47 14.928 7.234 2.947 1.00 0.00 C ATOM 718 CD GLN A 47 14.969 8.377 1.954 1.00 0.00 C ATOM 719 OE1 GLN A 47 14.909 9.547 2.329 1.00 0.00 O ATOM 720 NE2 GLN A 47 15.054 8.050 0.674 1.00 0.00 N ATOM 0 H GLN A 47 12.438 5.395 4.100 1.00 0.00 H new ATOM 0 HA GLN A 47 14.922 6.080 5.551 1.00 0.00 H new ATOM 0 HB2 GLN A 47 13.121 7.903 3.878 1.00 0.00 H new ATOM 0 HB3 GLN A 47 14.582 8.396 4.711 1.00 0.00 H new ATOM 0 HG2 GLN A 47 15.945 6.979 3.245 1.00 0.00 H new ATOM 0 HG3 GLN A 47 14.507 6.352 2.463 1.00 0.00 H new ATOM 0 HE21 GLN A 47 15.102 7.069 0.400 1.00 0.00 H new ATOM 0 HE22 GLN A 47 15.072 8.780 -0.039 1.00 0.00 H new ATOM 729 N ARG A 48 11.998 6.128 6.607 1.00 0.00 N ATOM 730 CA ARG A 48 11.067 6.561 7.649 1.00 0.00 C ATOM 731 C ARG A 48 10.723 5.428 8.612 1.00 0.00 C ATOM 732 O ARG A 48 9.700 5.478 9.292 1.00 0.00 O ATOM 733 CB ARG A 48 9.783 7.117 7.018 1.00 0.00 C ATOM 734 CG ARG A 48 9.988 8.386 6.193 1.00 0.00 C ATOM 735 CD ARG A 48 10.178 9.628 7.065 1.00 0.00 C ATOM 736 NE ARG A 48 11.400 9.576 7.870 1.00 0.00 N ATOM 737 CZ ARG A 48 11.954 10.638 8.462 1.00 0.00 C ATOM 738 NH1 ARG A 48 11.437 11.854 8.297 1.00 0.00 N ATOM 739 NH2 ARG A 48 13.043 10.486 9.205 1.00 0.00 N ATOM 0 H ARG A 48 11.732 5.271 6.122 1.00 0.00 H new ATOM 0 HA ARG A 48 11.561 7.346 8.221 1.00 0.00 H new ATOM 0 HB2 ARG A 48 9.344 6.350 6.380 1.00 0.00 H new ATOM 0 HB3 ARG A 48 9.063 7.324 7.810 1.00 0.00 H new ATOM 0 HG2 ARG A 48 10.859 8.261 5.550 1.00 0.00 H new ATOM 0 HG3 ARG A 48 9.128 8.533 5.539 1.00 0.00 H new ATOM 0 HD2 ARG A 48 10.205 10.512 6.428 1.00 0.00 H new ATOM 0 HD3 ARG A 48 9.318 9.737 7.726 1.00 0.00 H new ATOM 0 HE ARG A 48 11.857 8.672 7.986 1.00 0.00 H new ATOM 0 HH11 ARG A 48 10.610 11.982 7.714 1.00 0.00 H new ATOM 0 HH12 ARG A 48 11.868 12.658 8.754 1.00 0.00 H new ATOM 0 HH21 ARG A 48 13.455 9.560 9.323 1.00 0.00 H new ATOM 0 HH22 ARG A 48 13.468 11.295 9.658 1.00 0.00 H new ATOM 753 N VAL A 49 11.584 4.424 8.693 1.00 0.00 N ATOM 754 CA VAL A 49 11.342 3.295 9.582 1.00 0.00 C ATOM 755 C VAL A 49 12.662 2.799 10.173 1.00 0.00 C ATOM 756 O VAL A 49 13.730 3.300 9.819 1.00 0.00 O ATOM 757 CB VAL A 49 10.624 2.139 8.838 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.603 1.307 8.024 1.00 0.00 C ATOM 759 CG2 VAL A 49 9.838 1.264 9.805 1.00 0.00 C ATOM 0 H VAL A 49 12.451 4.367 8.158 1.00 0.00 H new ATOM 0 HA VAL A 49 10.692 3.633 10.389 1.00 0.00 H new ATOM 0 HB VAL A 49 9.916 2.590 8.143 1.00 0.00 H new ATOM 0 HG11 VAL A 49 11.065 0.506 7.516 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.093 1.941 7.285 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.354 0.877 8.687 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.346 0.463 9.253 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.517 0.834 10.541 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.087 1.868 10.314 1.00 0.00 H new ATOM 769 N ALA A 50 12.585 1.824 11.067 1.00 0.00 N ATOM 770 CA ALA A 50 13.778 1.260 11.682 1.00 0.00 C ATOM 771 C ALA A 50 14.192 -0.010 10.954 1.00 0.00 C ATOM 772 O ALA A 50 13.338 -0.778 10.537 1.00 0.00 O ATOM 773 CB ALA A 50 13.530 0.979 13.156 1.00 0.00 C ATOM 0 H ALA A 50 11.709 1.407 11.383 1.00 0.00 H new ATOM 0 HA ALA A 50 14.590 1.983 11.604 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.431 0.558 13.603 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.273 1.908 13.665 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.709 0.270 13.258 1.00 0.00 H new ATOM 779 N ALA A 51 15.494 -0.215 10.792 1.00 0.00 N ATOM 780 CA ALA A 51 16.022 -1.404 10.120 1.00 0.00 C ATOM 781 C ALA A 51 15.531 -2.692 10.780 1.00 0.00 C ATOM 782 O ALA A 51 15.038 -3.595 10.103 1.00 0.00 O ATOM 783 CB ALA A 51 17.545 -1.366 10.102 1.00 0.00 C ATOM 0 H ALA A 51 16.212 0.431 11.119 1.00 0.00 H new ATOM 0 HA ALA A 51 15.651 -1.397 9.095 1.00 0.00 H new ATOM 0 HB1 ALA A 51 17.925 -2.255 9.600 1.00 0.00 H new ATOM 0 HB2 ALA A 51 17.880 -0.477 9.569 1.00 0.00 H new ATOM 0 HB3 ALA A 51 17.920 -1.339 11.125 1.00 0.00 H new ATOM 789 N SER A 52 15.643 -2.762 12.100 1.00 0.00 N ATOM 790 CA SER A 52 15.232 -3.951 12.840 1.00 0.00 C ATOM 791 C SER A 52 13.712 -4.090 12.859 1.00 0.00 C ATOM 792 O SER A 52 13.171 -5.141 13.205 1.00 0.00 O ATOM 793 CB SER A 52 15.771 -3.888 14.268 1.00 0.00 C ATOM 794 OG SER A 52 17.189 -3.791 14.269 1.00 0.00 O ATOM 0 H SER A 52 16.015 -2.011 12.681 1.00 0.00 H new ATOM 0 HA SER A 52 15.645 -4.825 12.337 1.00 0.00 H new ATOM 0 HB2 SER A 52 15.343 -3.029 14.785 1.00 0.00 H new ATOM 0 HB3 SER A 52 15.463 -4.777 14.817 1.00 0.00 H new ATOM 0 HG SER A 52 17.513 -3.750 15.193 1.00 0.00 H new ATOM 800 N GLN A 53 13.031 -3.025 12.478 1.00 0.00 N ATOM 801 CA GLN A 53 11.581 -3.011 12.457 1.00 0.00 C ATOM 802 C GLN A 53 11.085 -3.087 11.019 1.00 0.00 C ATOM 803 O GLN A 53 9.893 -3.221 10.766 1.00 0.00 O ATOM 804 CB GLN A 53 11.073 -1.723 13.107 1.00 0.00 C ATOM 805 CG GLN A 53 9.666 -1.830 13.672 1.00 0.00 C ATOM 806 CD GLN A 53 9.587 -2.765 14.861 1.00 0.00 C ATOM 807 OE1 GLN A 53 9.350 -4.039 14.597 1.00 0.00 O flip ATOM 808 NE2 GLN A 53 9.743 -2.345 16.007 1.00 0.00 N flip ATOM 0 H GLN A 53 13.464 -2.152 12.177 1.00 0.00 H new ATOM 0 HA GLN A 53 11.205 -3.871 13.012 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.755 -1.439 13.909 1.00 0.00 H new ATOM 0 HB3 GLN A 53 11.097 -0.921 12.369 1.00 0.00 H new ATOM 0 HG2 GLN A 53 9.321 -0.840 13.969 1.00 0.00 H new ATOM 0 HG3 GLN A 53 8.991 -2.182 12.892 1.00 0.00 H new ATOM 0 HE21 GLN A 53 9.924 -1.354 16.167 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.691 -2.988 16.797 1.00 0.00 H new ATOM 817 N ARG A 54 12.027 -3.035 10.089 1.00 0.00 N ATOM 818 CA ARG A 54 11.733 -2.825 8.679 1.00 0.00 C ATOM 819 C ARG A 54 11.005 -4.009 8.062 1.00 0.00 C ATOM 820 O ARG A 54 9.879 -3.865 7.591 1.00 0.00 O ATOM 821 CB ARG A 54 13.037 -2.542 7.935 1.00 0.00 C ATOM 822 CG ARG A 54 12.869 -2.219 6.462 1.00 0.00 C ATOM 823 CD ARG A 54 14.191 -1.788 5.849 1.00 0.00 C ATOM 824 NE ARG A 54 14.682 -0.542 6.438 1.00 0.00 N ATOM 825 CZ ARG A 54 15.957 -0.299 6.726 1.00 0.00 C ATOM 826 NH1 ARG A 54 16.866 -1.254 6.605 1.00 0.00 N ATOM 827 NH2 ARG A 54 16.329 0.900 7.153 1.00 0.00 N ATOM 0 H ARG A 54 13.021 -3.138 10.292 1.00 0.00 H new ATOM 0 HA ARG A 54 11.064 -1.969 8.591 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.543 -1.707 8.421 1.00 0.00 H new ATOM 0 HB3 ARG A 54 13.690 -3.410 8.031 1.00 0.00 H new ATOM 0 HG2 ARG A 54 12.487 -3.093 5.935 1.00 0.00 H new ATOM 0 HG3 ARG A 54 12.131 -1.426 6.341 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.932 -2.575 5.992 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.068 -1.658 4.774 1.00 0.00 H new ATOM 0 HE ARG A 54 14.001 0.189 6.641 1.00 0.00 H new ATOM 0 HH11 ARG A 54 16.590 -2.184 6.289 1.00 0.00 H new ATOM 0 HH12 ARG A 54 17.842 -1.060 6.828 1.00 0.00 H new ATOM 0 HH21 ARG A 54 15.636 1.640 7.262 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.308 1.082 7.373 1.00 0.00 H new ATOM 841 N LYS A 55 11.629 -5.180 8.069 1.00 0.00 N ATOM 842 CA LYS A 55 11.012 -6.346 7.452 1.00 0.00 C ATOM 843 C LYS A 55 9.785 -6.772 8.245 1.00 0.00 C ATOM 844 O LYS A 55 8.819 -7.269 7.681 1.00 0.00 O ATOM 845 CB LYS A 55 11.994 -7.513 7.335 1.00 0.00 C ATOM 846 CG LYS A 55 11.469 -8.638 6.451 1.00 0.00 C ATOM 847 CD LYS A 55 12.417 -9.825 6.405 1.00 0.00 C ATOM 848 CE LYS A 55 11.940 -10.877 5.412 1.00 0.00 C ATOM 849 NZ LYS A 55 10.573 -11.378 5.733 1.00 0.00 N ATOM 0 H LYS A 55 12.545 -5.346 8.487 1.00 0.00 H new ATOM 0 HA LYS A 55 10.711 -6.065 6.443 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.938 -7.149 6.930 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.205 -7.906 8.330 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.498 -8.966 6.822 1.00 0.00 H new ATOM 0 HG3 LYS A 55 11.313 -8.261 5.440 1.00 0.00 H new ATOM 0 HD2 LYS A 55 13.415 -9.486 6.127 1.00 0.00 H new ATOM 0 HD3 LYS A 55 12.496 -10.268 7.398 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.943 -10.453 4.408 1.00 0.00 H new ATOM 0 HE3 LYS A 55 12.639 -11.713 5.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.403 -12.271 5.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 10.494 -11.539 6.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 9.867 -10.674 5.437 1.00 0.00 H new ATOM 863 N LEU A 56 9.823 -6.550 9.551 1.00 0.00 N ATOM 864 CA LEU A 56 8.701 -6.883 10.418 1.00 0.00 C ATOM 865 C LEU A 56 7.505 -5.994 10.077 1.00 0.00 C ATOM 866 O LEU A 56 6.371 -6.461 9.989 1.00 0.00 O ATOM 867 CB LEU A 56 9.114 -6.720 11.889 1.00 0.00 C ATOM 868 CG LEU A 56 8.138 -7.287 12.931 1.00 0.00 C ATOM 869 CD1 LEU A 56 8.873 -7.600 14.224 1.00 0.00 C ATOM 870 CD2 LEU A 56 6.998 -6.312 13.212 1.00 0.00 C ATOM 0 H LEU A 56 10.621 -6.139 10.035 1.00 0.00 H new ATOM 0 HA LEU A 56 8.410 -7.922 10.260 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.082 -7.200 12.029 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.253 -5.658 12.091 1.00 0.00 H new ATOM 0 HG LEU A 56 7.713 -8.204 12.523 1.00 0.00 H new ATOM 0 HD11 LEU A 56 8.170 -8.001 14.954 1.00 0.00 H new ATOM 0 HD12 LEU A 56 9.654 -8.335 14.030 1.00 0.00 H new ATOM 0 HD13 LEU A 56 9.323 -6.688 14.617 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.325 -6.743 13.953 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.406 -5.376 13.593 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.448 -6.120 12.291 1.00 0.00 H new ATOM 882 N ILE A 57 7.778 -4.716 9.864 1.00 0.00 N ATOM 883 CA ILE A 57 6.751 -3.758 9.484 1.00 0.00 C ATOM 884 C ILE A 57 6.284 -4.010 8.046 1.00 0.00 C ATOM 885 O ILE A 57 5.128 -3.753 7.704 1.00 0.00 O ATOM 886 CB ILE A 57 7.263 -2.306 9.704 1.00 0.00 C ATOM 887 CG1 ILE A 57 6.691 -1.760 11.016 1.00 0.00 C ATOM 888 CG2 ILE A 57 6.944 -1.380 8.540 1.00 0.00 C ATOM 889 CD1 ILE A 57 7.122 -0.344 11.340 1.00 0.00 C ATOM 0 H ILE A 57 8.712 -4.315 9.949 1.00 0.00 H new ATOM 0 HA ILE A 57 5.878 -3.890 10.124 1.00 0.00 H new ATOM 0 HB ILE A 57 8.351 -2.344 9.764 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.603 -1.794 10.967 1.00 0.00 H new ATOM 0 HG13 ILE A 57 6.994 -2.416 11.832 1.00 0.00 H new ATOM 0 HG21 ILE A 57 7.327 -0.382 8.754 1.00 0.00 H new ATOM 0 HG22 ILE A 57 7.412 -1.762 7.633 1.00 0.00 H new ATOM 0 HG23 ILE A 57 5.864 -1.332 8.399 1.00 0.00 H new ATOM 0 HD11 ILE A 57 6.673 -0.034 12.284 1.00 0.00 H new ATOM 0 HD12 ILE A 57 8.208 -0.304 11.424 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.795 0.327 10.545 1.00 0.00 H new ATOM 901 N ALA A 58 7.176 -4.552 7.224 1.00 0.00 N ATOM 902 CA ALA A 58 6.816 -4.976 5.875 1.00 0.00 C ATOM 903 C ALA A 58 5.880 -6.180 5.932 1.00 0.00 C ATOM 904 O ALA A 58 4.875 -6.231 5.218 1.00 0.00 O ATOM 905 CB ALA A 58 8.064 -5.304 5.068 1.00 0.00 C ATOM 0 H ALA A 58 8.154 -4.708 7.468 1.00 0.00 H new ATOM 0 HA ALA A 58 6.296 -4.156 5.380 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.776 -5.618 4.065 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.698 -4.420 5.003 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.612 -6.109 5.557 1.00 0.00 H new ATOM 911 N GLU A 59 6.215 -7.145 6.793 1.00 0.00 N ATOM 912 CA GLU A 59 5.355 -8.299 7.037 1.00 0.00 C ATOM 913 C GLU A 59 3.979 -7.832 7.492 1.00 0.00 C ATOM 914 O GLU A 59 2.957 -8.353 7.049 1.00 0.00 O ATOM 915 CB GLU A 59 5.957 -9.216 8.109 1.00 0.00 C ATOM 916 CG GLU A 59 7.271 -9.873 7.715 1.00 0.00 C ATOM 917 CD GLU A 59 7.128 -10.834 6.556 1.00 0.00 C ATOM 918 OE1 GLU A 59 6.332 -11.790 6.663 1.00 0.00 O ATOM 919 OE2 GLU A 59 7.816 -10.645 5.530 1.00 0.00 O ATOM 0 H GLU A 59 7.080 -7.147 7.333 1.00 0.00 H new ATOM 0 HA GLU A 59 5.268 -8.859 6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.114 -8.636 9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.234 -9.995 8.349 1.00 0.00 H new ATOM 0 HG2 GLU A 59 7.993 -9.100 7.452 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.676 -10.407 8.575 1.00 0.00 H new ATOM 926 N LYS A 60 3.974 -6.841 8.382 1.00 0.00 N ATOM 927 CA LYS A 60 2.738 -6.241 8.877 1.00 0.00 C ATOM 928 C LYS A 60 1.863 -5.785 7.721 1.00 0.00 C ATOM 929 O LYS A 60 0.712 -6.199 7.601 1.00 0.00 O ATOM 930 CB LYS A 60 3.045 -5.038 9.771 1.00 0.00 C ATOM 931 CG LYS A 60 3.571 -5.389 11.150 1.00 0.00 C ATOM 932 CD LYS A 60 4.047 -4.147 11.892 1.00 0.00 C ATOM 933 CE LYS A 60 2.988 -3.054 11.898 1.00 0.00 C ATOM 934 NZ LYS A 60 3.460 -1.821 12.580 1.00 0.00 N ATOM 0 H LYS A 60 4.821 -6.434 8.778 1.00 0.00 H new ATOM 0 HA LYS A 60 2.209 -6.999 9.455 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.777 -4.407 9.268 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.137 -4.446 9.884 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.788 -5.882 11.726 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.393 -6.098 11.058 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.302 -4.412 12.918 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.956 -3.770 11.424 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.708 -2.816 10.872 1.00 0.00 H new ATOM 0 HE3 LYS A 60 2.091 -3.422 12.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.653 -1.340 13.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.158 -2.073 13.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.900 -1.186 11.884 1.00 0.00 H new ATOM 948 N PHE A 61 2.433 -4.940 6.873 1.00 0.00 N ATOM 949 CA PHE A 61 1.721 -4.378 5.734 1.00 0.00 C ATOM 950 C PHE A 61 1.173 -5.478 4.834 1.00 0.00 C ATOM 951 O PHE A 61 -0.011 -5.495 4.509 1.00 0.00 O ATOM 952 CB PHE A 61 2.658 -3.464 4.939 1.00 0.00 C ATOM 953 CG PHE A 61 2.035 -2.862 3.710 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.240 -1.730 3.798 1.00 0.00 C ATOM 955 CD2 PHE A 61 2.252 -3.426 2.465 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.674 -1.175 2.667 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.687 -2.877 1.332 1.00 0.00 C ATOM 958 CZ PHE A 61 0.897 -1.749 1.432 1.00 0.00 C ATOM 0 H PHE A 61 3.400 -4.625 6.955 1.00 0.00 H new ATOM 0 HA PHE A 61 0.878 -3.796 6.107 1.00 0.00 H new ATOM 0 HB2 PHE A 61 3.001 -2.660 5.590 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.539 -4.034 4.644 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.061 -1.277 4.762 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.871 -4.307 2.379 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.057 -0.292 2.749 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.863 -3.330 0.367 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.455 -1.317 0.546 1.00 0.00 H new ATOM 968 N ALA A 62 2.040 -6.402 4.451 1.00 0.00 N ATOM 969 CA ALA A 62 1.675 -7.451 3.514 1.00 0.00 C ATOM 970 C ALA A 62 0.631 -8.394 4.097 1.00 0.00 C ATOM 971 O ALA A 62 -0.357 -8.704 3.439 1.00 0.00 O ATOM 972 CB ALA A 62 2.906 -8.234 3.094 1.00 0.00 C ATOM 0 H ALA A 62 3.006 -6.446 4.777 1.00 0.00 H new ATOM 0 HA ALA A 62 1.237 -6.970 2.640 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.618 -9.016 2.392 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.619 -7.562 2.616 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.367 -8.686 3.972 1.00 0.00 H new ATOM 978 N GLN A 63 0.845 -8.849 5.324 1.00 0.00 N ATOM 979 CA GLN A 63 -0.072 -9.798 5.939 1.00 0.00 C ATOM 980 C GLN A 63 -1.413 -9.147 6.239 1.00 0.00 C ATOM 981 O GLN A 63 -2.455 -9.783 6.101 1.00 0.00 O ATOM 982 CB GLN A 63 0.528 -10.402 7.209 1.00 0.00 C ATOM 983 CG GLN A 63 1.682 -11.360 6.942 1.00 0.00 C ATOM 984 CD GLN A 63 1.254 -12.619 6.199 1.00 0.00 C ATOM 985 OE1 GLN A 63 0.293 -12.616 5.427 1.00 0.00 O ATOM 986 NE2 GLN A 63 1.974 -13.704 6.418 1.00 0.00 N ATOM 0 H GLN A 63 1.637 -8.580 5.908 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.237 -10.605 5.225 1.00 0.00 H new ATOM 0 HB2 GLN A 63 0.878 -9.596 7.855 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.254 -10.931 7.754 1.00 0.00 H new ATOM 0 HG2 GLN A 63 2.447 -10.845 6.361 1.00 0.00 H new ATOM 0 HG3 GLN A 63 2.139 -11.643 7.891 1.00 0.00 H new ATOM 0 HE21 GLN A 63 2.763 -13.671 7.064 1.00 0.00 H new ATOM 0 HE22 GLN A 63 1.741 -14.575 5.942 1.00 0.00 H new ATOM 995 N ALA A 64 -1.393 -7.880 6.638 1.00 0.00 N ATOM 996 CA ALA A 64 -2.627 -7.140 6.868 1.00 0.00 C ATOM 997 C ALA A 64 -3.364 -6.930 5.551 1.00 0.00 C ATOM 998 O ALA A 64 -4.585 -7.066 5.477 1.00 0.00 O ATOM 999 CB ALA A 64 -2.345 -5.805 7.544 1.00 0.00 C ATOM 0 H ALA A 64 -0.540 -7.347 6.808 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.260 -7.725 7.535 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.283 -5.273 7.704 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.858 -5.979 8.504 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -1.692 -5.206 6.909 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.602 -6.621 4.510 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.146 -6.434 3.171 1.00 0.00 C ATOM 1007 C LEU A 65 -3.739 -7.739 2.646 1.00 0.00 C ATOM 1008 O LEU A 65 -4.851 -7.767 2.125 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.043 -5.942 2.228 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.514 -5.506 0.845 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.556 -4.415 0.973 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.342 -5.008 0.013 1.00 0.00 C ATOM 0 H LEU A 65 -1.592 -6.493 4.569 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.940 -5.688 3.217 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.531 -5.103 2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.308 -6.738 2.109 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.956 -6.367 0.343 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -3.887 -4.110 -0.020 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.408 -4.790 1.540 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.124 -3.559 1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.698 -4.701 -0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.877 -4.158 0.512 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.610 -5.808 -0.099 1.00 0.00 H new ATOM 1024 N MET A 66 -2.989 -8.818 2.815 1.00 0.00 N ATOM 1025 CA MET A 66 -3.376 -10.128 2.306 1.00 0.00 C ATOM 1026 C MET A 66 -4.571 -10.692 3.076 1.00 0.00 C ATOM 1027 O MET A 66 -5.413 -11.385 2.506 1.00 0.00 O ATOM 1028 CB MET A 66 -2.178 -11.077 2.401 1.00 0.00 C ATOM 1029 CG MET A 66 -2.297 -12.323 1.542 1.00 0.00 C ATOM 1030 SD MET A 66 -2.534 -11.942 -0.209 1.00 0.00 S ATOM 1031 CE MET A 66 -1.103 -10.915 -0.535 1.00 0.00 C ATOM 0 H MET A 66 -2.096 -8.812 3.308 1.00 0.00 H new ATOM 0 HA MET A 66 -3.680 -10.026 1.264 1.00 0.00 H new ATOM 0 HB2 MET A 66 -1.277 -10.536 2.112 1.00 0.00 H new ATOM 0 HB3 MET A 66 -2.050 -11.378 3.441 1.00 0.00 H new ATOM 0 HG2 MET A 66 -1.398 -12.928 1.660 1.00 0.00 H new ATOM 0 HG3 MET A 66 -3.134 -12.925 1.895 1.00 0.00 H new ATOM 0 HE1 MET A 66 -0.939 -10.850 -1.611 1.00 0.00 H new ATOM 0 HE2 MET A 66 -1.273 -9.916 -0.133 1.00 0.00 H new ATOM 0 HE3 MET A 66 -0.225 -11.353 -0.060 1.00 0.00 H new ATOM 1041 N SER A 67 -4.656 -10.387 4.368 1.00 0.00 N ATOM 1042 CA SER A 67 -5.780 -10.845 5.179 1.00 0.00 C ATOM 1043 C SER A 67 -7.018 -9.991 4.917 1.00 0.00 C ATOM 1044 O SER A 67 -8.144 -10.406 5.193 1.00 0.00 O ATOM 1045 CB SER A 67 -5.415 -10.827 6.667 1.00 0.00 C ATOM 1046 OG SER A 67 -4.903 -9.566 7.057 1.00 0.00 O ATOM 0 H SER A 67 -3.967 -9.830 4.872 1.00 0.00 H new ATOM 0 HA SER A 67 -6.009 -11.872 4.896 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.297 -11.064 7.263 1.00 0.00 H new ATOM 0 HB3 SER A 67 -4.675 -11.601 6.871 1.00 0.00 H new ATOM 0 HG SER A 67 -3.927 -9.569 6.972 1.00 0.00 H new ATOM 1052 N SER A 68 -6.804 -8.798 4.378 1.00 0.00 N ATOM 1053 CA SER A 68 -7.905 -7.925 4.011 1.00 0.00 C ATOM 1054 C SER A 68 -8.306 -8.165 2.561 1.00 0.00 C ATOM 1055 O SER A 68 -9.313 -7.640 2.081 1.00 0.00 O ATOM 1056 CB SER A 68 -7.518 -6.463 4.228 1.00 0.00 C ATOM 1057 OG SER A 68 -7.109 -6.247 5.571 1.00 0.00 O ATOM 0 H SER A 68 -5.878 -8.415 4.186 1.00 0.00 H new ATOM 0 HA SER A 68 -8.760 -8.152 4.648 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.711 -6.190 3.548 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.365 -5.818 3.992 1.00 0.00 H new ATOM 0 HG SER A 68 -6.130 -6.237 5.617 1.00 0.00 H new ATOM 1063 N LEU A 69 -7.510 -8.963 1.865 1.00 0.00 N ATOM 1064 CA LEU A 69 -7.822 -9.352 0.505 1.00 0.00 C ATOM 1065 C LEU A 69 -8.959 -10.365 0.528 1.00 0.00 C ATOM 1066 O LEU A 69 -8.792 -11.482 1.021 1.00 0.00 O ATOM 1067 CB LEU A 69 -6.582 -9.930 -0.182 1.00 0.00 C ATOM 1068 CG LEU A 69 -6.757 -10.284 -1.660 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -7.202 -9.065 -2.455 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -5.464 -10.848 -2.227 1.00 0.00 C ATOM 0 H LEU A 69 -6.639 -9.354 2.225 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.137 -8.478 -0.065 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -5.769 -9.210 -0.092 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.275 -10.827 0.355 1.00 0.00 H new ATOM 0 HG LEU A 69 -7.532 -11.046 -1.742 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.321 -9.338 -3.504 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -8.153 -8.703 -2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -6.451 -8.280 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.605 -11.095 -3.279 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -4.671 -10.106 -2.132 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -5.188 -11.748 -1.677 1.00 0.00 H new ATOM 1082 N GLU A 70 -10.112 -9.939 0.015 1.00 0.00 N ATOM 1083 CA GLU A 70 -11.355 -10.717 0.070 1.00 0.00 C ATOM 1084 C GLU A 70 -11.131 -12.203 -0.212 1.00 0.00 C ATOM 1085 O GLU A 70 -11.343 -13.037 0.667 1.00 0.00 O ATOM 1086 CB GLU A 70 -12.368 -10.153 -0.925 1.00 0.00 C ATOM 1087 CG GLU A 70 -12.609 -8.661 -0.774 1.00 0.00 C ATOM 1088 CD GLU A 70 -13.765 -8.175 -1.623 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -13.793 -8.485 -2.832 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -14.656 -7.488 -1.085 1.00 0.00 O ATOM 0 H GLU A 70 -10.214 -9.039 -0.454 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.740 -10.633 1.086 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.020 -10.355 -1.938 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.315 -10.679 -0.803 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.809 -8.432 0.273 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.705 -8.120 -1.052 1.00 0.00 H new ATOM 1097 N THR A 71 -10.689 -12.509 -1.429 1.00 0.00 N ATOM 1098 CA THR A 71 -10.451 -13.889 -1.882 1.00 0.00 C ATOM 1099 C THR A 71 -11.624 -14.824 -1.564 1.00 0.00 C ATOM 1100 O THR A 71 -11.666 -15.441 -0.499 1.00 0.00 O ATOM 1101 CB THR A 71 -9.145 -14.487 -1.301 1.00 0.00 C ATOM 1102 OG1 THR A 71 -9.119 -14.376 0.130 1.00 0.00 O ATOM 1103 CG2 THR A 71 -7.925 -13.798 -1.888 1.00 0.00 C ATOM 0 H THR A 71 -10.483 -11.806 -2.138 1.00 0.00 H new ATOM 0 HA THR A 71 -10.349 -13.818 -2.965 1.00 0.00 H new ATOM 0 HB THR A 71 -9.120 -15.542 -1.572 1.00 0.00 H new ATOM 0 HG1 THR A 71 -10.033 -14.267 0.466 1.00 0.00 H new ATOM 0 HG21 THR A 71 -7.021 -14.236 -1.464 1.00 0.00 H new ATOM 0 HG22 THR A 71 -7.919 -13.929 -2.970 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.959 -12.735 -1.651 1.00 0.00 H new ATOM 1111 N PRO A 72 -12.598 -14.930 -2.486 1.00 0.00 N ATOM 1112 CA PRO A 72 -13.757 -15.816 -2.313 1.00 0.00 C ATOM 1113 C PRO A 72 -13.332 -17.264 -2.096 1.00 0.00 C ATOM 1114 O PRO A 72 -12.474 -17.786 -2.815 1.00 0.00 O ATOM 1115 CB PRO A 72 -14.527 -15.676 -3.629 1.00 0.00 C ATOM 1116 CG PRO A 72 -14.076 -14.377 -4.202 1.00 0.00 C ATOM 1117 CD PRO A 72 -12.650 -14.202 -3.766 1.00 0.00 C ATOM 0 HA PRO A 72 -14.349 -15.548 -1.438 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.308 -16.503 -4.305 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -15.604 -15.680 -3.459 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -14.153 -14.383 -5.289 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -14.697 -13.556 -3.843 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -11.953 -14.617 -4.494 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -12.393 -13.150 -3.642 1.00 0.00 H new ATOM 1125 N LYS A 73 -13.928 -17.910 -1.105 1.00 0.00 N ATOM 1126 CA LYS A 73 -13.534 -19.262 -0.733 1.00 0.00 C ATOM 1127 C LYS A 73 -14.648 -20.244 -1.047 1.00 0.00 C ATOM 1128 O LYS A 73 -15.831 -19.912 -0.954 1.00 0.00 O ATOM 1129 CB LYS A 73 -13.154 -19.302 0.748 1.00 0.00 C ATOM 1130 CG LYS A 73 -12.187 -18.192 1.132 1.00 0.00 C ATOM 1131 CD LYS A 73 -11.723 -18.298 2.572 1.00 0.00 C ATOM 1132 CE LYS A 73 -10.913 -17.076 2.976 1.00 0.00 C ATOM 1133 NZ LYS A 73 -9.806 -16.794 2.024 1.00 0.00 N ATOM 0 H LYS A 73 -14.686 -17.521 -0.544 1.00 0.00 H new ATOM 0 HA LYS A 73 -12.662 -19.556 -1.317 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -14.056 -19.219 1.354 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -12.704 -20.268 0.978 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -11.321 -18.225 0.471 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -12.668 -17.226 0.979 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -12.587 -18.400 3.229 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -11.119 -19.197 2.698 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -11.571 -16.209 3.032 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -10.501 -17.229 3.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -8.975 -16.453 2.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -9.558 -17.665 1.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -10.109 -16.067 1.345 1.00 0.00 H new ATOM 1147 N THR A 74 -14.268 -21.453 -1.407 1.00 0.00 N ATOM 1148 CA THR A 74 -15.196 -22.385 -2.007 1.00 0.00 C ATOM 1149 C THR A 74 -15.491 -23.574 -1.096 1.00 0.00 C ATOM 1150 O THR A 74 -14.622 -24.406 -0.834 1.00 0.00 O ATOM 1151 CB THR A 74 -14.633 -22.891 -3.343 1.00 0.00 C ATOM 1152 OG1 THR A 74 -13.847 -21.859 -3.954 1.00 0.00 O ATOM 1153 CG2 THR A 74 -15.757 -23.279 -4.282 1.00 0.00 C ATOM 0 H THR A 74 -13.320 -21.812 -1.293 1.00 0.00 H new ATOM 0 HA THR A 74 -16.133 -21.852 -2.170 1.00 0.00 H new ATOM 0 HB THR A 74 -14.014 -23.767 -3.149 1.00 0.00 H new ATOM 0 HG1 THR A 74 -13.487 -22.183 -4.806 1.00 0.00 H new ATOM 0 HG21 THR A 74 -15.338 -23.635 -5.223 1.00 0.00 H new ATOM 0 HG22 THR A 74 -16.354 -24.070 -3.828 1.00 0.00 H new ATOM 0 HG23 THR A 74 -16.389 -22.411 -4.471 1.00 0.00 H new ATOM 1161 N HIS A 75 -16.719 -23.628 -0.598 1.00 0.00 N ATOM 1162 CA HIS A 75 -17.194 -24.782 0.154 1.00 0.00 C ATOM 1163 C HIS A 75 -18.614 -25.138 -0.278 1.00 0.00 C ATOM 1164 O HIS A 75 -18.796 -25.862 -1.258 1.00 0.00 O ATOM 1165 CB HIS A 75 -17.129 -24.532 1.665 1.00 0.00 C ATOM 1166 CG HIS A 75 -15.737 -24.565 2.224 1.00 0.00 C ATOM 1167 ND1 HIS A 75 -15.022 -23.432 2.561 1.00 0.00 N ATOM 1168 CD2 HIS A 75 -14.925 -25.611 2.500 1.00 0.00 C ATOM 1169 CE1 HIS A 75 -13.833 -23.782 3.015 1.00 0.00 C ATOM 1170 NE2 HIS A 75 -13.751 -25.098 2.988 1.00 0.00 N ATOM 0 H HIS A 75 -17.407 -22.882 -0.702 1.00 0.00 H new ATOM 0 HA HIS A 75 -16.538 -25.625 -0.064 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -17.575 -23.562 1.883 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -17.733 -25.283 2.175 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -15.158 -26.656 2.362 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -13.060 -23.107 3.351 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -12.943 -25.646 3.283 1.00 0.00 H new ATOM 1179 N LEU A 76 -19.611 -24.608 0.436 1.00 0.00 N ATOM 1180 CA LEU A 76 -21.027 -24.811 0.095 1.00 0.00 C ATOM 1181 C LEU A 76 -21.376 -26.293 -0.066 1.00 0.00 C ATOM 1182 O LEU A 76 -22.298 -26.642 -0.807 1.00 0.00 O ATOM 1183 CB LEU A 76 -21.397 -24.064 -1.199 1.00 0.00 C ATOM 1184 CG LEU A 76 -21.430 -22.532 -1.115 1.00 0.00 C ATOM 1185 CD1 LEU A 76 -20.027 -21.947 -1.107 1.00 0.00 C ATOM 1186 CD2 LEU A 76 -22.239 -21.959 -2.268 1.00 0.00 C ATOM 0 H LEU A 76 -19.464 -24.029 1.263 1.00 0.00 H new ATOM 0 HA LEU A 76 -21.604 -24.409 0.928 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -20.685 -24.349 -1.974 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -22.378 -24.410 -1.525 1.00 0.00 H new ATOM 0 HG LEU A 76 -21.910 -22.257 -0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -20.086 -20.860 -1.047 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -19.479 -22.329 -0.246 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -19.509 -22.232 -2.023 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -22.254 -20.871 -2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -21.784 -22.254 -3.214 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -23.259 -22.340 -2.222 1.00 0.00 H new ATOM 1198 N GLU A 77 -20.674 -27.162 0.646 1.00 0.00 N ATOM 1199 CA GLU A 77 -20.843 -28.593 0.456 1.00 0.00 C ATOM 1200 C GLU A 77 -21.403 -29.294 1.686 1.00 0.00 C ATOM 1201 O GLU A 77 -22.508 -29.834 1.633 1.00 0.00 O ATOM 1202 CB GLU A 77 -19.520 -29.245 0.057 1.00 0.00 C ATOM 1203 CG GLU A 77 -19.179 -29.088 -1.414 1.00 0.00 C ATOM 1204 CD GLU A 77 -20.254 -29.650 -2.323 1.00 0.00 C ATOM 1205 OE1 GLU A 77 -20.943 -30.612 -1.924 1.00 0.00 O ATOM 1206 OE2 GLU A 77 -20.410 -29.139 -3.450 1.00 0.00 O ATOM 0 H GLU A 77 -19.988 -26.903 1.355 1.00 0.00 H new ATOM 0 HA GLU A 77 -21.571 -28.708 -0.347 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -18.718 -28.812 0.655 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -19.561 -30.307 0.300 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -19.034 -28.031 -1.639 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -18.234 -29.591 -1.620 1.00 0.00 H new ATOM 1213 N HIS A 78 -20.626 -29.301 2.776 1.00 0.00 N ATOM 1214 CA HIS A 78 -20.900 -30.140 3.957 1.00 0.00 C ATOM 1215 C HIS A 78 -20.593 -31.607 3.648 1.00 0.00 C ATOM 1216 O HIS A 78 -20.055 -32.327 4.488 1.00 0.00 O ATOM 1217 CB HIS A 78 -22.351 -30.017 4.455 1.00 0.00 C ATOM 1218 CG HIS A 78 -22.705 -28.686 5.046 1.00 0.00 C ATOM 1219 ND1 HIS A 78 -23.806 -27.965 4.648 1.00 0.00 N ATOM 1220 CD2 HIS A 78 -22.134 -27.972 6.044 1.00 0.00 C ATOM 1221 CE1 HIS A 78 -23.898 -26.867 5.372 1.00 0.00 C ATOM 1222 NE2 HIS A 78 -22.898 -26.845 6.229 1.00 0.00 N ATOM 0 H HIS A 78 -19.788 -28.726 2.868 1.00 0.00 H new ATOM 0 HA HIS A 78 -20.249 -29.777 4.752 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -23.024 -30.219 3.622 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -22.530 -30.789 5.203 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -21.243 -28.239 6.593 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -24.665 -26.112 5.278 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -22.720 -26.113 6.916 1.00 0.00 H new ATOM 1231 N HIS A 79 -20.947 -32.026 2.430 1.00 0.00 N ATOM 1232 CA HIS A 79 -20.725 -33.388 1.945 1.00 0.00 C ATOM 1233 C HIS A 79 -21.687 -34.363 2.614 1.00 0.00 C ATOM 1234 O HIS A 79 -22.439 -33.993 3.519 1.00 0.00 O ATOM 1235 CB HIS A 79 -19.264 -33.829 2.131 1.00 0.00 C ATOM 1236 CG HIS A 79 -18.302 -33.119 1.224 1.00 0.00 C ATOM 1237 ND1 HIS A 79 -17.485 -32.092 1.644 1.00 0.00 N ATOM 1238 CD2 HIS A 79 -18.024 -33.298 -0.090 1.00 0.00 C ATOM 1239 CE1 HIS A 79 -16.752 -31.674 0.630 1.00 0.00 C ATOM 1240 NE2 HIS A 79 -17.057 -32.387 -0.434 1.00 0.00 N ATOM 0 H HIS A 79 -21.401 -31.421 1.746 1.00 0.00 H new ATOM 0 HA HIS A 79 -20.926 -33.394 0.874 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -18.970 -33.656 3.166 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -19.192 -34.902 1.955 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -18.480 -34.024 -0.746 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -16.022 -30.879 0.667 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -16.643 -32.280 -1.360 1.00 0.00 H new ATOM 1249 N HIS A 80 -21.673 -35.604 2.155 1.00 0.00 N ATOM 1250 CA HIS A 80 -22.620 -36.599 2.642 1.00 0.00 C ATOM 1251 C HIS A 80 -22.106 -37.266 3.911 1.00 0.00 C ATOM 1252 O HIS A 80 -20.933 -37.614 4.015 1.00 0.00 O ATOM 1253 CB HIS A 80 -22.920 -37.649 1.554 1.00 0.00 C ATOM 1254 CG HIS A 80 -21.761 -38.537 1.195 1.00 0.00 C ATOM 1255 ND1 HIS A 80 -20.842 -38.217 0.222 1.00 0.00 N ATOM 1256 CD2 HIS A 80 -21.382 -39.746 1.679 1.00 0.00 C ATOM 1257 CE1 HIS A 80 -19.946 -39.184 0.126 1.00 0.00 C ATOM 1258 NE2 HIS A 80 -20.253 -40.122 1.000 1.00 0.00 N ATOM 0 H HIS A 80 -21.021 -35.947 1.450 1.00 0.00 H new ATOM 0 HA HIS A 80 -23.551 -36.087 2.885 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -23.747 -38.274 1.891 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -23.256 -37.133 0.655 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -21.878 -40.308 2.456 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -19.106 -39.203 -0.553 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -19.734 -40.988 1.147 1.00 0.00 H new ATOM 1267 N HIS A 81 -22.996 -37.430 4.875 1.00 0.00 N ATOM 1268 CA HIS A 81 -22.672 -38.082 6.137 1.00 0.00 C ATOM 1269 C HIS A 81 -23.821 -38.992 6.545 1.00 0.00 C ATOM 1270 O HIS A 81 -24.669 -39.342 5.722 1.00 0.00 O ATOM 1271 CB HIS A 81 -22.437 -37.055 7.256 1.00 0.00 C ATOM 1272 CG HIS A 81 -21.214 -36.203 7.096 1.00 0.00 C ATOM 1273 ND1 HIS A 81 -21.240 -34.834 7.226 1.00 0.00 N ATOM 1274 CD2 HIS A 81 -19.923 -36.529 6.853 1.00 0.00 C ATOM 1275 CE1 HIS A 81 -20.022 -34.353 7.065 1.00 0.00 C ATOM 1276 NE2 HIS A 81 -19.198 -35.361 6.841 1.00 0.00 N ATOM 0 H HIS A 81 -23.964 -37.116 4.807 1.00 0.00 H new ATOM 0 HA HIS A 81 -21.757 -38.656 5.993 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -23.308 -36.403 7.317 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -22.368 -37.586 8.206 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -19.534 -37.524 6.697 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -19.745 -33.310 7.109 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -18.193 -35.285 6.685 1.00 0.00 H new ATOM 1285 N HIS A 82 -23.842 -39.372 7.813 1.00 0.00 N ATOM 1286 CA HIS A 82 -24.977 -40.090 8.384 1.00 0.00 C ATOM 1287 C HIS A 82 -25.237 -39.580 9.798 1.00 0.00 C ATOM 1288 O HIS A 82 -26.384 -39.450 10.225 1.00 0.00 O ATOM 1289 CB HIS A 82 -24.754 -41.616 8.381 1.00 0.00 C ATOM 1290 CG HIS A 82 -23.608 -42.091 9.227 1.00 0.00 C ATOM 1291 ND1 HIS A 82 -23.753 -42.497 10.540 1.00 0.00 N ATOM 1292 CD2 HIS A 82 -22.291 -42.226 8.940 1.00 0.00 C ATOM 1293 CE1 HIS A 82 -22.578 -42.859 11.019 1.00 0.00 C ATOM 1294 NE2 HIS A 82 -21.678 -42.702 10.071 1.00 0.00 N ATOM 0 H HIS A 82 -23.083 -39.195 8.471 1.00 0.00 H new ATOM 0 HA HIS A 82 -25.852 -39.900 7.763 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -25.667 -42.102 8.726 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -24.588 -41.942 7.354 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -21.813 -42.001 7.998 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -22.387 -43.222 12.018 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -20.682 -42.903 10.163 1.00 0.00 H new ATOM 1303 N HIS A 83 -24.156 -39.259 10.500 1.00 0.00 N ATOM 1304 CA HIS A 83 -24.226 -38.715 11.847 1.00 0.00 C ATOM 1305 C HIS A 83 -22.839 -38.237 12.253 1.00 0.00 C ATOM 1306 O HIS A 83 -22.165 -38.949 13.028 1.00 0.00 O ATOM 1307 CB HIS A 83 -24.730 -39.771 12.838 1.00 0.00 C ATOM 1308 CG HIS A 83 -25.004 -39.235 14.213 1.00 0.00 C ATOM 1309 ND1 HIS A 83 -24.012 -38.990 15.133 1.00 0.00 N ATOM 1310 CD2 HIS A 83 -26.167 -38.906 14.821 1.00 0.00 C ATOM 1311 CE1 HIS A 83 -24.550 -38.537 16.249 1.00 0.00 C ATOM 1312 NE2 HIS A 83 -25.858 -38.475 16.085 1.00 0.00 N ATOM 1313 OXT HIS A 83 -22.409 -37.189 11.740 1.00 0.00 O ATOM 0 H HIS A 83 -23.205 -39.370 10.148 1.00 0.00 H new ATOM 0 HA HIS A 83 -24.928 -37.881 11.862 1.00 0.00 H new ATOM 0 HB2 HIS A 83 -25.643 -40.217 12.444 1.00 0.00 H new ATOM 0 HB3 HIS A 83 -23.991 -40.569 12.911 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -23.015 -39.136 14.977 1.00 0.00 H new ATOM 0 HD2 HIS A 83 -27.155 -38.971 14.390 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -24.012 -38.263 17.144 1.00 0.00 H new TER 1322 HIS A 83 ATOM 1323 N MET B 1 -5.871 -1.577 -22.305 1.00 0.00 N ATOM 1324 CA MET B 1 -5.476 -0.589 -21.279 1.00 0.00 C ATOM 1325 C MET B 1 -4.296 -1.117 -20.471 1.00 0.00 C ATOM 1326 O MET B 1 -4.375 -2.194 -19.881 1.00 0.00 O ATOM 1327 CB MET B 1 -6.676 -0.277 -20.373 1.00 0.00 C ATOM 1328 CG MET B 1 -6.359 0.619 -19.183 1.00 0.00 C ATOM 1329 SD MET B 1 -5.904 -0.315 -17.707 1.00 0.00 S ATOM 1330 CE MET B 1 -5.606 1.013 -16.541 1.00 0.00 C ATOM 0 H1 MET B 1 -6.676 -1.208 -22.851 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.070 -1.752 -22.945 1.00 0.00 H new ATOM 0 H3 MET B 1 -6.145 -2.467 -21.842 1.00 0.00 H new ATOM 0 HA MET B 1 -5.163 0.336 -21.764 1.00 0.00 H new ATOM 0 HB2 MET B 1 -7.452 0.199 -20.972 1.00 0.00 H new ATOM 0 HB3 MET B 1 -7.089 -1.216 -20.004 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.543 1.292 -19.448 1.00 0.00 H new ATOM 0 HG3 MET B 1 -7.226 1.241 -18.961 1.00 0.00 H new ATOM 0 HE1 MET B 1 -4.599 0.922 -16.135 1.00 0.00 H new ATOM 0 HE2 MET B 1 -5.707 1.972 -17.049 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.331 0.954 -15.729 1.00 0.00 H new ATOM 1339 N PRO B 2 -3.175 -0.377 -20.466 1.00 0.00 N ATOM 1340 CA PRO B 2 -1.968 -0.760 -19.733 1.00 0.00 C ATOM 1341 C PRO B 2 -2.152 -0.634 -18.227 1.00 0.00 C ATOM 1342 O PRO B 2 -2.646 0.381 -17.735 1.00 0.00 O ATOM 1343 CB PRO B 2 -0.903 0.235 -20.222 1.00 0.00 C ATOM 1344 CG PRO B 2 -1.508 0.930 -21.397 1.00 0.00 C ATOM 1345 CD PRO B 2 -2.988 0.890 -21.183 1.00 0.00 C ATOM 0 HA PRO B 2 -1.702 -1.802 -19.912 1.00 0.00 H new ATOM 0 HB2 PRO B 2 -0.642 0.946 -19.438 1.00 0.00 H new ATOM 0 HB3 PRO B 2 0.015 -0.281 -20.502 1.00 0.00 H new ATOM 0 HG2 PRO B 2 -1.152 1.958 -21.468 1.00 0.00 H new ATOM 0 HG3 PRO B 2 -1.235 0.433 -22.328 1.00 0.00 H new ATOM 0 HD2 PRO B 2 -3.336 1.742 -20.598 1.00 0.00 H new ATOM 0 HD3 PRO B 2 -3.534 0.906 -22.126 1.00 0.00 H new ATOM 1353 N ILE B 3 -1.748 -1.667 -17.505 1.00 0.00 N ATOM 1354 CA ILE B 3 -1.885 -1.692 -16.057 1.00 0.00 C ATOM 1355 C ILE B 3 -0.773 -0.890 -15.380 1.00 0.00 C ATOM 1356 O ILE B 3 -0.087 -0.090 -16.030 1.00 0.00 O ATOM 1357 CB ILE B 3 -1.869 -3.138 -15.518 1.00 0.00 C ATOM 1358 CG1 ILE B 3 -0.598 -3.868 -15.971 1.00 0.00 C ATOM 1359 CG2 ILE B 3 -3.112 -3.886 -15.981 1.00 0.00 C ATOM 1360 CD1 ILE B 3 -0.442 -5.251 -15.374 1.00 0.00 C ATOM 0 H ILE B 3 -1.320 -2.504 -17.901 1.00 0.00 H new ATOM 0 HA ILE B 3 -2.846 -1.235 -15.822 1.00 0.00 H new ATOM 0 HB ILE B 3 -1.871 -3.103 -14.429 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -0.605 -3.950 -17.058 1.00 0.00 H new ATOM 0 HG13 ILE B 3 0.270 -3.266 -15.703 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -3.089 -4.905 -15.594 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -4.002 -3.377 -15.610 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -3.136 -3.912 -17.070 1.00 0.00 H new ATOM 0 HD11 ILE B 3 0.479 -5.704 -15.741 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -0.402 -5.176 -14.287 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -1.291 -5.870 -15.664 1.00 0.00 H new ATOM 1372 N THR B 4 -0.626 -1.106 -14.075 1.00 0.00 N ATOM 1373 CA THR B 4 0.391 -0.450 -13.260 1.00 0.00 C ATOM 1374 C THR B 4 1.755 -0.422 -13.950 1.00 0.00 C ATOM 1375 O THR B 4 2.324 -1.465 -14.286 1.00 0.00 O ATOM 1376 CB THR B 4 0.526 -1.157 -11.894 1.00 0.00 C ATOM 1377 OG1 THR B 4 -0.732 -1.142 -11.205 1.00 0.00 O ATOM 1378 CG2 THR B 4 1.584 -0.487 -11.028 1.00 0.00 C ATOM 0 H THR B 4 -1.217 -1.749 -13.548 1.00 0.00 H new ATOM 0 HA THR B 4 0.064 0.580 -13.115 1.00 0.00 H new ATOM 0 HB THR B 4 0.832 -2.187 -12.080 1.00 0.00 H new ATOM 0 HG1 THR B 4 -1.356 -1.753 -11.650 1.00 0.00 H new ATOM 0 HG21 THR B 4 1.656 -1.008 -10.073 1.00 0.00 H new ATOM 0 HG22 THR B 4 2.548 -0.526 -11.536 1.00 0.00 H new ATOM 0 HG23 THR B 4 1.307 0.553 -10.855 1.00 0.00 H new ATOM 1386 N SER B 5 2.261 0.784 -14.160 1.00 0.00 N ATOM 1387 CA SER B 5 3.547 0.986 -14.798 1.00 0.00 C ATOM 1388 C SER B 5 4.176 2.263 -14.243 1.00 0.00 C ATOM 1389 O SER B 5 3.669 2.831 -13.274 1.00 0.00 O ATOM 1390 CB SER B 5 3.363 1.071 -16.321 1.00 0.00 C ATOM 1391 OG SER B 5 4.609 1.105 -17.001 1.00 0.00 O ATOM 0 H SER B 5 1.790 1.648 -13.892 1.00 0.00 H new ATOM 0 HA SER B 5 4.211 0.147 -14.588 1.00 0.00 H new ATOM 0 HB2 SER B 5 2.784 0.214 -16.666 1.00 0.00 H new ATOM 0 HB3 SER B 5 2.789 1.964 -16.569 1.00 0.00 H new ATOM 0 HG SER B 5 4.453 1.157 -17.967 1.00 0.00 H new ATOM 1397 N LYS B 6 5.270 2.714 -14.845 1.00 0.00 N ATOM 1398 CA LYS B 6 5.947 3.922 -14.389 1.00 0.00 C ATOM 1399 C LYS B 6 5.131 5.164 -14.732 1.00 0.00 C ATOM 1400 O LYS B 6 5.001 6.074 -13.910 1.00 0.00 O ATOM 1401 CB LYS B 6 7.331 4.047 -15.026 1.00 0.00 C ATOM 1402 CG LYS B 6 8.276 2.902 -14.706 1.00 0.00 C ATOM 1403 CD LYS B 6 9.660 3.174 -15.269 1.00 0.00 C ATOM 1404 CE LYS B 6 10.594 1.995 -15.073 1.00 0.00 C ATOM 1405 NZ LYS B 6 10.146 0.797 -15.828 1.00 0.00 N ATOM 0 H LYS B 6 5.707 2.262 -15.649 1.00 0.00 H new ATOM 0 HA LYS B 6 6.054 3.845 -13.307 1.00 0.00 H new ATOM 0 HB2 LYS B 6 7.215 4.114 -16.108 1.00 0.00 H new ATOM 0 HB3 LYS B 6 7.786 4.981 -14.696 1.00 0.00 H new ATOM 0 HG2 LYS B 6 8.338 2.766 -13.626 1.00 0.00 H new ATOM 0 HG3 LYS B 6 7.885 1.974 -15.122 1.00 0.00 H new ATOM 0 HD2 LYS B 6 9.581 3.401 -16.332 1.00 0.00 H new ATOM 0 HD3 LYS B 6 10.082 4.055 -14.785 1.00 0.00 H new ATOM 0 HE2 LYS B 6 11.598 2.271 -15.394 1.00 0.00 H new ATOM 0 HE3 LYS B 6 10.654 1.753 -14.012 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 10.923 0.107 -15.878 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 9.331 0.367 -15.345 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 9.870 1.077 -16.791 1.00 0.00 H new ATOM 1419 N TYR B 7 4.584 5.184 -15.952 1.00 0.00 N ATOM 1420 CA TYR B 7 3.873 6.350 -16.478 1.00 0.00 C ATOM 1421 C TYR B 7 4.813 7.553 -16.511 1.00 0.00 C ATOM 1422 O TYR B 7 6.034 7.395 -16.570 1.00 0.00 O ATOM 1423 CB TYR B 7 2.635 6.680 -15.629 1.00 0.00 C ATOM 1424 CG TYR B 7 1.675 5.524 -15.458 1.00 0.00 C ATOM 1425 CD1 TYR B 7 1.023 4.958 -16.548 1.00 0.00 C ATOM 1426 CD2 TYR B 7 1.421 5.003 -14.198 1.00 0.00 C ATOM 1427 CE1 TYR B 7 0.146 3.901 -16.383 1.00 0.00 C ATOM 1428 CE2 TYR B 7 0.548 3.949 -14.023 1.00 0.00 C ATOM 1429 CZ TYR B 7 -0.088 3.403 -15.117 1.00 0.00 C ATOM 1430 OH TYR B 7 -0.960 2.358 -14.943 1.00 0.00 O ATOM 0 H TYR B 7 4.622 4.396 -16.598 1.00 0.00 H new ATOM 0 HA TYR B 7 3.537 6.116 -17.488 1.00 0.00 H new ATOM 0 HB2 TYR B 7 2.962 7.015 -14.645 1.00 0.00 H new ATOM 0 HB3 TYR B 7 2.104 7.513 -16.089 1.00 0.00 H new ATOM 0 HD1 TYR B 7 1.204 5.349 -17.538 1.00 0.00 H new ATOM 0 HD2 TYR B 7 1.916 5.430 -13.338 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -0.352 3.469 -17.238 1.00 0.00 H new ATOM 0 HE2 TYR B 7 0.364 3.554 -13.035 1.00 0.00 H new ATOM 0 HH TYR B 7 -0.631 1.573 -15.429 1.00 0.00 H new ATOM 1440 N THR B 8 4.250 8.748 -16.492 1.00 0.00 N ATOM 1441 CA THR B 8 5.054 9.950 -16.400 1.00 0.00 C ATOM 1442 C THR B 8 5.422 10.216 -14.939 1.00 0.00 C ATOM 1443 O THR B 8 4.597 10.671 -14.143 1.00 0.00 O ATOM 1444 CB THR B 8 4.338 11.173 -17.029 1.00 0.00 C ATOM 1445 OG1 THR B 8 5.050 12.386 -16.735 1.00 0.00 O ATOM 1446 CG2 THR B 8 2.895 11.286 -16.551 1.00 0.00 C ATOM 0 H THR B 8 3.244 8.910 -16.539 1.00 0.00 H new ATOM 0 HA THR B 8 5.968 9.793 -16.972 1.00 0.00 H new ATOM 0 HB THR B 8 4.326 11.022 -18.108 1.00 0.00 H new ATOM 0 HG1 THR B 8 4.584 13.146 -17.142 1.00 0.00 H new ATOM 0 HG21 THR B 8 2.426 12.155 -17.013 1.00 0.00 H new ATOM 0 HG22 THR B 8 2.347 10.386 -16.831 1.00 0.00 H new ATOM 0 HG23 THR B 8 2.879 11.398 -15.467 1.00 0.00 H new ATOM 1454 N ASP B 9 6.662 9.891 -14.584 1.00 0.00 N ATOM 1455 CA ASP B 9 7.138 10.041 -13.210 1.00 0.00 C ATOM 1456 C ASP B 9 7.123 11.503 -12.780 1.00 0.00 C ATOM 1457 O ASP B 9 7.199 11.813 -11.591 1.00 0.00 O ATOM 1458 CB ASP B 9 8.546 9.461 -13.053 1.00 0.00 C ATOM 1459 CG ASP B 9 9.584 10.180 -13.891 1.00 0.00 C ATOM 1460 OD1 ASP B 9 10.105 11.220 -13.438 1.00 0.00 O ATOM 1461 OD2 ASP B 9 9.889 9.704 -15.006 1.00 0.00 O ATOM 0 H ASP B 9 7.358 9.521 -15.231 1.00 0.00 H new ATOM 0 HA ASP B 9 6.458 9.485 -12.564 1.00 0.00 H new ATOM 0 HB2 ASP B 9 8.838 9.510 -12.004 1.00 0.00 H new ATOM 0 HB3 ASP B 9 8.531 8.407 -13.330 1.00 0.00 H new ATOM 1466 N GLU B 10 7.024 12.391 -13.761 1.00 0.00 N ATOM 1467 CA GLU B 10 6.892 13.818 -13.511 1.00 0.00 C ATOM 1468 C GLU B 10 5.595 14.093 -12.762 1.00 0.00 C ATOM 1469 O GLU B 10 5.587 14.772 -11.734 1.00 0.00 O ATOM 1470 CB GLU B 10 6.882 14.575 -14.838 1.00 0.00 C ATOM 1471 CG GLU B 10 8.061 14.243 -15.735 1.00 0.00 C ATOM 1472 CD GLU B 10 7.873 14.738 -17.152 1.00 0.00 C ATOM 1473 OE1 GLU B 10 7.923 15.964 -17.371 1.00 0.00 O ATOM 1474 OE2 GLU B 10 7.670 13.900 -18.053 1.00 0.00 O ATOM 0 H GLU B 10 7.033 12.142 -14.750 1.00 0.00 H new ATOM 0 HA GLU B 10 7.736 14.153 -12.908 1.00 0.00 H new ATOM 0 HB2 GLU B 10 5.957 14.349 -15.369 1.00 0.00 H new ATOM 0 HB3 GLU B 10 6.880 15.646 -14.636 1.00 0.00 H new ATOM 0 HG2 GLU B 10 8.966 14.684 -15.317 1.00 0.00 H new ATOM 0 HG3 GLU B 10 8.210 13.163 -15.748 1.00 0.00 H new ATOM 1481 N GLN B 11 4.505 13.541 -13.288 1.00 0.00 N ATOM 1482 CA GLN B 11 3.188 13.697 -12.687 1.00 0.00 C ATOM 1483 C GLN B 11 3.108 12.928 -11.378 1.00 0.00 C ATOM 1484 O GLN B 11 2.561 13.421 -10.392 1.00 0.00 O ATOM 1485 CB GLN B 11 2.106 13.203 -13.649 1.00 0.00 C ATOM 1486 CG GLN B 11 0.696 13.321 -13.096 1.00 0.00 C ATOM 1487 CD GLN B 11 -0.346 12.735 -14.026 1.00 0.00 C ATOM 1488 OE1 GLN B 11 -0.666 11.551 -13.949 1.00 0.00 O ATOM 1489 NE2 GLN B 11 -0.879 13.559 -14.915 1.00 0.00 N ATOM 0 H GLN B 11 4.511 12.977 -14.138 1.00 0.00 H new ATOM 0 HA GLN B 11 3.025 14.755 -12.483 1.00 0.00 H new ATOM 0 HB2 GLN B 11 2.171 13.771 -14.577 1.00 0.00 H new ATOM 0 HB3 GLN B 11 2.303 12.160 -13.898 1.00 0.00 H new ATOM 0 HG2 GLN B 11 0.644 12.814 -12.133 1.00 0.00 H new ATOM 0 HG3 GLN B 11 0.467 14.371 -12.916 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -0.585 14.535 -14.946 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -1.583 13.217 -15.569 1.00 0.00 H new ATOM 1498 N VAL B 12 3.661 11.719 -11.380 1.00 0.00 N ATOM 1499 CA VAL B 12 3.697 10.889 -10.182 1.00 0.00 C ATOM 1500 C VAL B 12 4.346 11.650 -9.032 1.00 0.00 C ATOM 1501 O VAL B 12 3.822 11.678 -7.921 1.00 0.00 O ATOM 1502 CB VAL B 12 4.466 9.573 -10.427 1.00 0.00 C ATOM 1503 CG1 VAL B 12 4.496 8.725 -9.165 1.00 0.00 C ATOM 1504 CG2 VAL B 12 3.845 8.795 -11.579 1.00 0.00 C ATOM 0 H VAL B 12 4.091 11.292 -12.200 1.00 0.00 H new ATOM 0 HA VAL B 12 2.667 10.641 -9.923 1.00 0.00 H new ATOM 0 HB VAL B 12 5.492 9.823 -10.696 1.00 0.00 H new ATOM 0 HG11 VAL B 12 5.043 7.802 -9.360 1.00 0.00 H new ATOM 0 HG12 VAL B 12 4.990 9.278 -8.367 1.00 0.00 H new ATOM 0 HG13 VAL B 12 3.476 8.486 -8.863 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.401 7.871 -11.736 1.00 0.00 H new ATOM 0 HG22 VAL B 12 2.808 8.558 -11.341 1.00 0.00 H new ATOM 0 HG23 VAL B 12 3.880 9.398 -12.486 1.00 0.00 H new ATOM 1514 N GLU B 13 5.477 12.285 -9.323 1.00 0.00 N ATOM 1515 CA GLU B 13 6.180 13.108 -8.344 1.00 0.00 C ATOM 1516 C GLU B 13 5.271 14.212 -7.810 1.00 0.00 C ATOM 1517 O GLU B 13 5.218 14.457 -6.605 1.00 0.00 O ATOM 1518 CB GLU B 13 7.417 13.738 -8.978 1.00 0.00 C ATOM 1519 CG GLU B 13 8.198 14.627 -8.029 1.00 0.00 C ATOM 1520 CD GLU B 13 8.865 15.777 -8.742 1.00 0.00 C ATOM 1521 OE1 GLU B 13 10.015 15.623 -9.196 1.00 0.00 O ATOM 1522 OE2 GLU B 13 8.233 16.844 -8.868 1.00 0.00 O ATOM 0 H GLU B 13 5.929 12.245 -10.236 1.00 0.00 H new ATOM 0 HA GLU B 13 6.480 12.465 -7.516 1.00 0.00 H new ATOM 0 HB2 GLU B 13 8.071 12.946 -9.343 1.00 0.00 H new ATOM 0 HB3 GLU B 13 7.112 14.325 -9.845 1.00 0.00 H new ATOM 0 HG2 GLU B 13 7.527 15.017 -7.264 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.954 14.032 -7.516 1.00 0.00 H new ATOM 1529 N LYS B 14 4.554 14.866 -8.717 1.00 0.00 N ATOM 1530 CA LYS B 14 3.676 15.971 -8.346 1.00 0.00 C ATOM 1531 C LYS B 14 2.569 15.488 -7.418 1.00 0.00 C ATOM 1532 O LYS B 14 2.298 16.103 -6.390 1.00 0.00 O ATOM 1533 CB LYS B 14 3.062 16.622 -9.590 1.00 0.00 C ATOM 1534 CG LYS B 14 4.090 17.166 -10.570 1.00 0.00 C ATOM 1535 CD LYS B 14 4.938 18.265 -9.949 1.00 0.00 C ATOM 1536 CE LYS B 14 6.084 18.667 -10.863 1.00 0.00 C ATOM 1537 NZ LYS B 14 7.038 17.548 -11.075 1.00 0.00 N ATOM 0 H LYS B 14 4.563 14.651 -9.714 1.00 0.00 H new ATOM 0 HA LYS B 14 4.278 16.714 -7.823 1.00 0.00 H new ATOM 0 HB2 LYS B 14 2.439 15.889 -10.102 1.00 0.00 H new ATOM 0 HB3 LYS B 14 2.407 17.435 -9.277 1.00 0.00 H new ATOM 0 HG2 LYS B 14 4.736 16.355 -10.906 1.00 0.00 H new ATOM 0 HG3 LYS B 14 3.581 17.555 -11.452 1.00 0.00 H new ATOM 0 HD2 LYS B 14 4.314 19.134 -9.742 1.00 0.00 H new ATOM 0 HD3 LYS B 14 5.336 17.923 -8.993 1.00 0.00 H new ATOM 0 HE2 LYS B 14 5.686 18.992 -11.824 1.00 0.00 H new ATOM 0 HE3 LYS B 14 6.612 19.518 -10.432 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 7.915 17.915 -11.498 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 7.255 17.099 -10.162 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 6.613 16.846 -11.714 1.00 0.00 H new ATOM 1551 N ILE B 15 1.943 14.374 -7.780 1.00 0.00 N ATOM 1552 CA ILE B 15 0.872 13.807 -6.974 1.00 0.00 C ATOM 1553 C ILE B 15 1.410 13.340 -5.621 1.00 0.00 C ATOM 1554 O ILE B 15 0.752 13.493 -4.592 1.00 0.00 O ATOM 1555 CB ILE B 15 0.174 12.633 -7.695 1.00 0.00 C ATOM 1556 CG1 ILE B 15 -0.338 13.083 -9.068 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.976 12.097 -6.847 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -0.977 11.974 -9.875 1.00 0.00 C ATOM 0 H ILE B 15 2.160 13.847 -8.626 1.00 0.00 H new ATOM 0 HA ILE B 15 0.133 14.593 -6.816 1.00 0.00 H new ATOM 0 HB ILE B 15 0.899 11.832 -7.840 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -1.064 13.884 -8.930 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.493 13.501 -9.636 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -1.458 11.270 -7.369 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.590 11.747 -5.890 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.703 12.891 -6.676 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -1.314 12.369 -10.833 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -0.248 11.182 -10.046 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -1.830 11.571 -9.328 1.00 0.00 H new ATOM 1570 N LEU B 16 2.617 12.783 -5.624 1.00 0.00 N ATOM 1571 CA LEU B 16 3.279 12.398 -4.384 1.00 0.00 C ATOM 1572 C LEU B 16 3.507 13.619 -3.500 1.00 0.00 C ATOM 1573 O LEU B 16 3.313 13.559 -2.289 1.00 0.00 O ATOM 1574 CB LEU B 16 4.613 11.699 -4.670 1.00 0.00 C ATOM 1575 CG LEU B 16 4.506 10.302 -5.285 1.00 0.00 C ATOM 1576 CD1 LEU B 16 5.886 9.760 -5.625 1.00 0.00 C ATOM 1577 CD2 LEU B 16 3.785 9.354 -4.340 1.00 0.00 C ATOM 0 H LEU B 16 3.155 12.589 -6.469 1.00 0.00 H new ATOM 0 HA LEU B 16 2.629 11.698 -3.858 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.197 12.329 -5.341 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.172 11.624 -3.737 1.00 0.00 H new ATOM 0 HG LEU B 16 3.927 10.379 -6.205 1.00 0.00 H new ATOM 0 HD11 LEU B 16 5.789 8.766 -6.061 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.372 10.424 -6.340 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.487 9.701 -4.718 1.00 0.00 H new ATOM 0 HD21 LEU B 16 3.719 8.366 -4.796 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.337 9.285 -3.403 1.00 0.00 H new ATOM 0 HD23 LEU B 16 2.781 9.730 -4.143 1.00 0.00 H new ATOM 1589 N ALA B 17 3.904 14.728 -4.117 1.00 0.00 N ATOM 1590 CA ALA B 17 4.112 15.981 -3.397 1.00 0.00 C ATOM 1591 C ALA B 17 2.803 16.487 -2.797 1.00 0.00 C ATOM 1592 O ALA B 17 2.792 17.056 -1.704 1.00 0.00 O ATOM 1593 CB ALA B 17 4.715 17.034 -4.317 1.00 0.00 C ATOM 0 H ALA B 17 4.089 14.785 -5.119 1.00 0.00 H new ATOM 0 HA ALA B 17 4.811 15.790 -2.582 1.00 0.00 H new ATOM 0 HB1 ALA B 17 4.862 17.961 -3.762 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.674 16.681 -4.695 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.040 17.216 -5.154 1.00 0.00 H new ATOM 1599 N GLU B 18 1.706 16.277 -3.519 1.00 0.00 N ATOM 1600 CA GLU B 18 0.380 16.631 -3.025 1.00 0.00 C ATOM 1601 C GLU B 18 0.083 15.866 -1.740 1.00 0.00 C ATOM 1602 O GLU B 18 -0.233 16.456 -0.705 1.00 0.00 O ATOM 1603 CB GLU B 18 -0.689 16.296 -4.072 1.00 0.00 C ATOM 1604 CG GLU B 18 -0.465 16.944 -5.431 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.820 18.413 -5.462 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -0.144 19.213 -4.785 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -1.781 18.774 -6.178 1.00 0.00 O ATOM 0 H GLU B 18 1.710 15.862 -4.451 1.00 0.00 H new ATOM 0 HA GLU B 18 0.361 17.703 -2.826 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.727 15.214 -4.201 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.662 16.606 -3.691 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.581 16.825 -5.714 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -1.060 16.418 -6.178 1.00 0.00 H new ATOM 1614 N VAL B 19 0.212 14.544 -1.818 1.00 0.00 N ATOM 1615 CA VAL B 19 -0.056 13.670 -0.682 1.00 0.00 C ATOM 1616 C VAL B 19 0.921 13.942 0.460 1.00 0.00 C ATOM 1617 O VAL B 19 0.522 14.009 1.622 1.00 0.00 O ATOM 1618 CB VAL B 19 0.025 12.180 -1.089 1.00 0.00 C ATOM 1619 CG1 VAL B 19 -0.280 11.274 0.097 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -0.926 11.891 -2.241 1.00 0.00 C ATOM 0 H VAL B 19 0.503 14.053 -2.663 1.00 0.00 H new ATOM 0 HA VAL B 19 -1.069 13.885 -0.341 1.00 0.00 H new ATOM 0 HB VAL B 19 1.043 11.973 -1.419 1.00 0.00 H new ATOM 0 HG11 VAL B 19 -0.216 10.232 -0.216 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.443 11.459 0.892 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -1.285 11.482 0.465 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -0.856 10.838 -2.515 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -1.947 12.120 -1.936 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.657 12.508 -3.099 1.00 0.00 H new ATOM 1630 N ALA B 20 2.194 14.115 0.119 1.00 0.00 N ATOM 1631 CA ALA B 20 3.230 14.383 1.110 1.00 0.00 C ATOM 1632 C ALA B 20 2.922 15.650 1.900 1.00 0.00 C ATOM 1633 O ALA B 20 3.157 15.712 3.107 1.00 0.00 O ATOM 1634 CB ALA B 20 4.592 14.496 0.443 1.00 0.00 C ATOM 0 H ALA B 20 2.534 14.074 -0.842 1.00 0.00 H new ATOM 0 HA ALA B 20 3.249 13.545 1.807 1.00 0.00 H new ATOM 0 HB1 ALA B 20 5.352 14.696 1.199 1.00 0.00 H new ATOM 0 HB2 ALA B 20 4.826 13.562 -0.068 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.576 15.311 -0.280 1.00 0.00 H new ATOM 1640 N LEU B 21 2.386 16.655 1.218 1.00 0.00 N ATOM 1641 CA LEU B 21 2.009 17.897 1.872 1.00 0.00 C ATOM 1642 C LEU B 21 0.856 17.649 2.838 1.00 0.00 C ATOM 1643 O LEU B 21 0.870 18.137 3.969 1.00 0.00 O ATOM 1644 CB LEU B 21 1.635 18.956 0.829 1.00 0.00 C ATOM 1645 CG LEU B 21 1.354 20.359 1.379 1.00 0.00 C ATOM 1646 CD1 LEU B 21 1.802 21.410 0.377 1.00 0.00 C ATOM 1647 CD2 LEU B 21 -0.127 20.535 1.690 1.00 0.00 C ATOM 0 H LEU B 21 2.204 16.632 0.215 1.00 0.00 H new ATOM 0 HA LEU B 21 2.859 18.271 2.442 1.00 0.00 H new ATOM 0 HB2 LEU B 21 2.444 19.026 0.102 1.00 0.00 H new ATOM 0 HB3 LEU B 21 0.752 18.613 0.290 1.00 0.00 H new ATOM 0 HG LEU B 21 1.916 20.482 2.305 1.00 0.00 H new ATOM 0 HD11 LEU B 21 1.598 22.404 0.776 1.00 0.00 H new ATOM 0 HD12 LEU B 21 2.871 21.305 0.193 1.00 0.00 H new ATOM 0 HD13 LEU B 21 1.258 21.276 -0.558 1.00 0.00 H new ATOM 0 HD21 LEU B 21 -0.300 21.538 2.079 1.00 0.00 H new ATOM 0 HD22 LEU B 21 -0.709 20.393 0.780 1.00 0.00 H new ATOM 0 HD23 LEU B 21 -0.432 19.800 2.434 1.00 0.00 H new ATOM 1659 N VAL B 22 -0.124 16.866 2.396 1.00 0.00 N ATOM 1660 CA VAL B 22 -1.268 16.517 3.231 1.00 0.00 C ATOM 1661 C VAL B 22 -0.808 15.775 4.482 1.00 0.00 C ATOM 1662 O VAL B 22 -1.213 16.103 5.600 1.00 0.00 O ATOM 1663 CB VAL B 22 -2.285 15.642 2.463 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.460 15.257 3.353 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -2.777 16.361 1.216 1.00 0.00 C ATOM 0 H VAL B 22 -0.148 16.460 1.461 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.758 17.448 3.516 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.777 14.727 2.159 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.159 14.642 2.787 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.096 14.695 4.213 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.966 16.159 3.697 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.492 15.729 0.690 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.261 17.295 1.502 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.932 16.575 0.562 1.00 0.00 H new ATOM 1675 N LEU B 23 0.059 14.790 4.287 1.00 0.00 N ATOM 1676 CA LEU B 23 0.567 13.987 5.387 1.00 0.00 C ATOM 1677 C LEU B 23 1.389 14.837 6.348 1.00 0.00 C ATOM 1678 O LEU B 23 1.282 14.687 7.562 1.00 0.00 O ATOM 1679 CB LEU B 23 1.407 12.819 4.863 1.00 0.00 C ATOM 1680 CG LEU B 23 0.676 11.873 3.903 1.00 0.00 C ATOM 1681 CD1 LEU B 23 1.550 10.678 3.556 1.00 0.00 C ATOM 1682 CD2 LEU B 23 -0.645 11.414 4.502 1.00 0.00 C ATOM 0 H LEU B 23 0.426 14.529 3.372 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.289 13.585 5.929 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.284 13.221 4.355 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.768 12.241 5.714 1.00 0.00 H new ATOM 0 HG LEU B 23 0.463 12.419 2.984 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.012 10.020 2.874 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.467 11.024 3.079 1.00 0.00 H new ATOM 0 HD13 LEU B 23 1.798 10.132 4.466 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -1.147 10.744 3.805 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.457 10.889 5.438 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.279 12.280 4.693 1.00 0.00 H new ATOM 1694 N GLU B 24 2.197 15.741 5.804 1.00 0.00 N ATOM 1695 CA GLU B 24 3.013 16.622 6.630 1.00 0.00 C ATOM 1696 C GLU B 24 2.130 17.601 7.402 1.00 0.00 C ATOM 1697 O GLU B 24 2.350 17.846 8.588 1.00 0.00 O ATOM 1698 CB GLU B 24 4.019 17.388 5.766 1.00 0.00 C ATOM 1699 CG GLU B 24 5.063 18.139 6.576 1.00 0.00 C ATOM 1700 CD GLU B 24 6.004 18.946 5.708 1.00 0.00 C ATOM 1701 OE1 GLU B 24 6.984 18.372 5.191 1.00 0.00 O ATOM 1702 OE2 GLU B 24 5.763 20.158 5.537 1.00 0.00 O ATOM 0 H GLU B 24 2.304 15.882 4.799 1.00 0.00 H new ATOM 0 HA GLU B 24 3.562 16.009 7.345 1.00 0.00 H new ATOM 0 HB2 GLU B 24 4.522 16.687 5.100 1.00 0.00 H new ATOM 0 HB3 GLU B 24 3.480 18.096 5.136 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.562 18.805 7.279 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.640 17.427 7.167 1.00 0.00 H new ATOM 1709 N LYS B 25 1.122 18.139 6.728 1.00 0.00 N ATOM 1710 CA LYS B 25 0.199 19.090 7.340 1.00 0.00 C ATOM 1711 C LYS B 25 -0.599 18.432 8.466 1.00 0.00 C ATOM 1712 O LYS B 25 -0.862 19.047 9.500 1.00 0.00 O ATOM 1713 CB LYS B 25 -0.742 19.658 6.273 1.00 0.00 C ATOM 1714 CG LYS B 25 -1.777 20.635 6.805 1.00 0.00 C ATOM 1715 CD LYS B 25 -2.558 21.270 5.669 1.00 0.00 C ATOM 1716 CE LYS B 25 -3.699 22.129 6.183 1.00 0.00 C ATOM 1717 NZ LYS B 25 -4.359 22.881 5.083 1.00 0.00 N ATOM 0 H LYS B 25 0.921 17.932 5.750 1.00 0.00 H new ATOM 0 HA LYS B 25 0.777 19.905 7.775 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -0.146 20.159 5.510 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -1.258 18.832 5.784 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -2.461 20.116 7.476 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -1.283 21.411 7.390 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -1.888 21.880 5.063 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -2.954 20.490 5.019 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -4.433 21.498 6.684 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -3.321 22.830 6.927 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -5.133 23.457 5.472 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -3.664 23.502 4.621 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -4.742 22.211 4.386 1.00 0.00 H new ATOM 1731 N HIS B 26 -0.966 17.171 8.269 1.00 0.00 N ATOM 1732 CA HIS B 26 -1.702 16.423 9.287 1.00 0.00 C ATOM 1733 C HIS B 26 -0.747 15.757 10.274 1.00 0.00 C ATOM 1734 O HIS B 26 -1.183 15.049 11.182 1.00 0.00 O ATOM 1735 CB HIS B 26 -2.614 15.367 8.649 1.00 0.00 C ATOM 1736 CG HIS B 26 -3.845 15.931 8.001 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -5.105 15.794 8.539 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -4.012 16.619 6.846 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -5.988 16.368 7.748 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -5.353 16.877 6.712 1.00 0.00 N ATOM 0 H HIS B 26 -0.768 16.645 7.418 1.00 0.00 H new ATOM 0 HA HIS B 26 -2.324 17.136 9.828 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -2.044 14.814 7.902 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -2.915 14.652 9.415 1.00 0.00 H new ATOM 0 HD1 HIS B 26 -5.322 15.320 9.416 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.233 16.911 6.157 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -7.053 16.414 7.920 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.787 17.380 5.938 1.00 0.00 H new ATOM 1749 N ALA B 27 0.553 15.993 10.081 1.00 0.00 N ATOM 1750 CA ALA B 27 1.596 15.462 10.963 1.00 0.00 C ATOM 1751 C ALA B 27 1.524 13.941 11.073 1.00 0.00 C ATOM 1752 O ALA B 27 1.608 13.381 12.166 1.00 0.00 O ATOM 1753 CB ALA B 27 1.506 16.104 12.341 1.00 0.00 C ATOM 0 H ALA B 27 0.912 16.557 9.310 1.00 0.00 H new ATOM 0 HA ALA B 27 2.560 15.712 10.521 1.00 0.00 H new ATOM 0 HB1 ALA B 27 2.288 15.698 12.983 1.00 0.00 H new ATOM 0 HB2 ALA B 27 1.635 17.182 12.249 1.00 0.00 H new ATOM 0 HB3 ALA B 27 0.530 15.891 12.778 1.00 0.00 H new ATOM 1759 N ALA B 28 1.380 13.282 9.934 1.00 0.00 N ATOM 1760 CA ALA B 28 1.282 11.830 9.892 1.00 0.00 C ATOM 1761 C ALA B 28 2.587 11.167 10.324 1.00 0.00 C ATOM 1762 O ALA B 28 3.672 11.535 9.868 1.00 0.00 O ATOM 1763 CB ALA B 28 0.887 11.371 8.497 1.00 0.00 C ATOM 0 H ALA B 28 1.328 13.732 9.020 1.00 0.00 H new ATOM 0 HA ALA B 28 0.509 11.526 10.598 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.817 10.283 8.478 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.079 11.802 8.232 1.00 0.00 H new ATOM 0 HB3 ALA B 28 1.639 11.699 7.780 1.00 0.00 H new ATOM 1769 N SER B 29 2.470 10.206 11.228 1.00 0.00 N ATOM 1770 CA SER B 29 3.609 9.418 11.667 1.00 0.00 C ATOM 1771 C SER B 29 3.829 8.250 10.700 1.00 0.00 C ATOM 1772 O SER B 29 2.900 7.861 9.998 1.00 0.00 O ATOM 1773 CB SER B 29 3.357 8.901 13.086 1.00 0.00 C ATOM 1774 OG SER B 29 2.950 9.956 13.944 1.00 0.00 O ATOM 0 H SER B 29 1.589 9.953 11.675 1.00 0.00 H new ATOM 0 HA SER B 29 4.505 10.039 11.674 1.00 0.00 H new ATOM 0 HB2 SER B 29 2.589 8.127 13.065 1.00 0.00 H new ATOM 0 HB3 SER B 29 4.264 8.439 13.476 1.00 0.00 H new ATOM 0 HG SER B 29 2.793 9.603 14.845 1.00 0.00 H new ATOM 1780 N PRO B 30 5.052 7.681 10.654 1.00 0.00 N ATOM 1781 CA PRO B 30 5.406 6.584 9.736 1.00 0.00 C ATOM 1782 C PRO B 30 4.364 5.460 9.694 1.00 0.00 C ATOM 1783 O PRO B 30 3.915 5.067 8.616 1.00 0.00 O ATOM 1784 CB PRO B 30 6.740 6.054 10.290 1.00 0.00 C ATOM 1785 CG PRO B 30 6.980 6.792 11.569 1.00 0.00 C ATOM 1786 CD PRO B 30 6.201 8.069 11.477 1.00 0.00 C ATOM 0 HA PRO B 30 5.463 6.942 8.708 1.00 0.00 H new ATOM 0 HB2 PRO B 30 6.690 4.979 10.464 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.551 6.226 9.583 1.00 0.00 H new ATOM 0 HG2 PRO B 30 6.655 6.200 12.425 1.00 0.00 H new ATOM 0 HG3 PRO B 30 8.042 6.995 11.706 1.00 0.00 H new ATOM 0 HD2 PRO B 30 5.894 8.429 12.459 1.00 0.00 H new ATOM 0 HD3 PRO B 30 6.782 8.866 11.013 1.00 0.00 H new ATOM 1794 N GLU B 31 3.986 4.958 10.869 1.00 0.00 N ATOM 1795 CA GLU B 31 2.977 3.903 10.977 1.00 0.00 C ATOM 1796 C GLU B 31 1.674 4.343 10.305 1.00 0.00 C ATOM 1797 O GLU B 31 1.091 3.608 9.510 1.00 0.00 O ATOM 1798 CB GLU B 31 2.720 3.580 12.454 1.00 0.00 C ATOM 1799 CG GLU B 31 1.754 2.423 12.690 1.00 0.00 C ATOM 1800 CD GLU B 31 2.365 1.059 12.421 1.00 0.00 C ATOM 1801 OE1 GLU B 31 3.606 0.948 12.378 1.00 0.00 O ATOM 1802 OE2 GLU B 31 1.604 0.075 12.285 1.00 0.00 O ATOM 0 H GLU B 31 4.365 5.266 11.764 1.00 0.00 H new ATOM 0 HA GLU B 31 3.346 3.010 10.473 1.00 0.00 H new ATOM 0 HB2 GLU B 31 3.671 3.346 12.932 1.00 0.00 H new ATOM 0 HB3 GLU B 31 2.327 4.471 12.945 1.00 0.00 H new ATOM 0 HG2 GLU B 31 1.403 2.458 13.721 1.00 0.00 H new ATOM 0 HG3 GLU B 31 0.880 2.553 12.051 1.00 0.00 H new ATOM 1809 N LEU B 32 1.246 5.562 10.616 1.00 0.00 N ATOM 1810 CA LEU B 32 0.028 6.130 10.049 1.00 0.00 C ATOM 1811 C LEU B 32 0.157 6.285 8.534 1.00 0.00 C ATOM 1812 O LEU B 32 -0.745 5.907 7.790 1.00 0.00 O ATOM 1813 CB LEU B 32 -0.266 7.484 10.705 1.00 0.00 C ATOM 1814 CG LEU B 32 -1.460 8.256 10.138 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -2.742 7.447 10.253 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -1.606 9.589 10.855 1.00 0.00 C ATOM 0 H LEU B 32 1.731 6.182 11.265 1.00 0.00 H new ATOM 0 HA LEU B 32 -0.801 5.451 10.248 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -0.436 7.321 11.769 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.622 8.110 10.616 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.276 8.440 9.080 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -3.573 8.021 9.842 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -2.635 6.515 9.698 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -2.939 7.224 11.302 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -2.458 10.131 10.445 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -1.765 9.414 11.919 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -0.700 10.178 10.716 1.00 0.00 H new ATOM 1828 N THR B 33 1.284 6.831 8.093 1.00 0.00 N ATOM 1829 CA THR B 33 1.562 7.016 6.673 1.00 0.00 C ATOM 1830 C THR B 33 1.473 5.696 5.911 1.00 0.00 C ATOM 1831 O THR B 33 0.801 5.598 4.880 1.00 0.00 O ATOM 1832 CB THR B 33 2.969 7.612 6.471 1.00 0.00 C ATOM 1833 OG1 THR B 33 3.033 8.924 7.043 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.340 7.664 4.996 1.00 0.00 C ATOM 0 H THR B 33 2.030 7.157 8.708 1.00 0.00 H new ATOM 0 HA THR B 33 0.809 7.702 6.284 1.00 0.00 H new ATOM 0 HB THR B 33 3.687 6.965 6.975 1.00 0.00 H new ATOM 0 HG1 THR B 33 3.036 8.855 8.021 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.338 8.089 4.887 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.328 6.656 4.582 1.00 0.00 H new ATOM 0 HG23 THR B 33 2.621 8.284 4.462 1.00 0.00 H new ATOM 1842 N LEU B 34 2.148 4.683 6.432 1.00 0.00 N ATOM 1843 CA LEU B 34 2.182 3.387 5.784 1.00 0.00 C ATOM 1844 C LEU B 34 0.807 2.727 5.852 1.00 0.00 C ATOM 1845 O LEU B 34 0.399 2.020 4.927 1.00 0.00 O ATOM 1846 CB LEU B 34 3.265 2.512 6.422 1.00 0.00 C ATOM 1847 CG LEU B 34 3.569 1.218 5.676 1.00 0.00 C ATOM 1848 CD1 LEU B 34 5.054 0.900 5.751 1.00 0.00 C ATOM 1849 CD2 LEU B 34 2.752 0.071 6.255 1.00 0.00 C ATOM 0 H LEU B 34 2.679 4.736 7.302 1.00 0.00 H new ATOM 0 HA LEU B 34 2.434 3.514 4.731 1.00 0.00 H new ATOM 0 HB2 LEU B 34 4.183 3.094 6.498 1.00 0.00 H new ATOM 0 HB3 LEU B 34 2.959 2.265 7.439 1.00 0.00 H new ATOM 0 HG LEU B 34 3.295 1.347 4.629 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.255 -0.027 5.214 1.00 0.00 H new ATOM 0 HD12 LEU B 34 5.623 1.712 5.299 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.349 0.786 6.794 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.979 -0.847 5.713 1.00 0.00 H new ATOM 0 HD22 LEU B 34 3.002 -0.058 7.308 1.00 0.00 H new ATOM 0 HD23 LEU B 34 1.690 0.296 6.159 1.00 0.00 H new ATOM 1861 N MET B 35 0.081 2.984 6.933 1.00 0.00 N ATOM 1862 CA MET B 35 -1.277 2.475 7.072 1.00 0.00 C ATOM 1863 C MET B 35 -2.200 3.145 6.056 1.00 0.00 C ATOM 1864 O MET B 35 -3.164 2.539 5.585 1.00 0.00 O ATOM 1865 CB MET B 35 -1.801 2.695 8.493 1.00 0.00 C ATOM 1866 CG MET B 35 -3.143 2.028 8.747 1.00 0.00 C ATOM 1867 SD MET B 35 -3.749 2.280 10.425 1.00 0.00 S ATOM 1868 CE MET B 35 -3.899 4.060 10.473 1.00 0.00 C ATOM 0 H MET B 35 0.408 3.540 7.723 1.00 0.00 H new ATOM 0 HA MET B 35 -1.260 1.402 6.879 1.00 0.00 H new ATOM 0 HB2 MET B 35 -1.071 2.311 9.206 1.00 0.00 H new ATOM 0 HB3 MET B 35 -1.894 3.765 8.677 1.00 0.00 H new ATOM 0 HG2 MET B 35 -3.875 2.417 8.040 1.00 0.00 H new ATOM 0 HG3 MET B 35 -3.053 0.959 8.556 1.00 0.00 H new ATOM 0 HE1 MET B 35 -4.704 4.339 11.153 1.00 0.00 H new ATOM 0 HE2 MET B 35 -2.962 4.495 10.821 1.00 0.00 H new ATOM 0 HE3 MET B 35 -4.123 4.433 9.474 1.00 0.00 H new ATOM 1878 N ILE B 36 -1.904 4.399 5.716 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.626 5.086 4.650 1.00 0.00 C ATOM 1880 C ILE B 36 -2.442 4.330 3.342 1.00 0.00 C ATOM 1881 O ILE B 36 -3.413 4.040 2.644 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.158 6.553 4.465 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -2.521 7.402 5.687 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.754 7.164 3.205 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -3.980 7.325 6.080 1.00 0.00 C ATOM 0 H ILE B 36 -1.174 4.955 6.161 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.678 5.111 4.935 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.073 6.541 4.361 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.911 7.083 6.532 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.265 8.442 5.483 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.409 8.193 3.101 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.439 6.586 2.336 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.842 7.152 3.274 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -4.155 7.954 6.953 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -4.599 7.673 5.253 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -4.239 6.293 6.318 1.00 0.00 H new ATOM 1897 N ALA B 37 -1.192 3.990 3.035 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.879 3.211 1.841 1.00 0.00 C ATOM 1899 C ALA B 37 -1.598 1.864 1.869 1.00 0.00 C ATOM 1900 O ALA B 37 -2.077 1.382 0.841 1.00 0.00 O ATOM 1901 CB ALA B 37 0.625 3.012 1.713 1.00 0.00 C ATOM 0 H ALA B 37 -0.379 4.242 3.598 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.229 3.765 0.970 1.00 0.00 H new ATOM 0 HB1 ALA B 37 0.840 2.429 0.817 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.116 3.983 1.641 1.00 0.00 H new ATOM 0 HB3 ALA B 37 0.998 2.481 2.589 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.679 1.273 3.056 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.406 0.031 3.226 1.00 0.00 C ATOM 1909 C GLY B 38 -3.874 0.182 2.888 1.00 0.00 C ATOM 1910 O GLY B 38 -4.445 -0.646 2.174 1.00 0.00 O ATOM 0 H GLY B 38 -1.251 1.636 3.908 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -1.965 -0.737 2.591 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.304 -0.310 4.256 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.483 1.248 3.398 1.00 0.00 N ATOM 1915 CA ASN B 39 -5.878 1.549 3.102 1.00 0.00 C ATOM 1916 C ASN B 39 -6.062 1.803 1.611 1.00 0.00 C ATOM 1917 O ASN B 39 -7.050 1.369 1.019 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.365 2.763 3.905 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.802 2.405 5.316 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -7.969 2.083 5.554 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -5.879 2.464 6.263 1.00 0.00 N ATOM 0 H ASN B 39 -4.031 1.919 4.019 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.475 0.685 3.392 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.566 3.503 3.955 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.199 3.229 3.379 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -6.123 2.239 7.228 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -4.924 2.734 6.028 1.00 0.00 H new ATOM 1928 N ILE B 40 -5.097 2.498 1.009 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.114 2.748 -0.430 1.00 0.00 C ATOM 1930 C ILE B 40 -5.160 1.431 -1.201 1.00 0.00 C ATOM 1931 O ILE B 40 -6.092 1.193 -1.970 1.00 0.00 O ATOM 1932 CB ILE B 40 -3.881 3.566 -0.894 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -3.895 4.968 -0.279 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -3.839 3.660 -2.415 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -2.659 5.781 -0.594 1.00 0.00 C ATOM 0 H ILE B 40 -4.295 2.897 1.496 1.00 0.00 H new ATOM 0 HA ILE B 40 -6.010 3.332 -0.639 1.00 0.00 H new ATOM 0 HB ILE B 40 -2.985 3.047 -0.552 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -4.773 5.504 -0.638 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -3.996 4.880 0.803 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -2.966 4.238 -2.720 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -3.777 2.658 -2.840 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -4.743 4.151 -2.774 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.740 6.762 -0.126 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -1.778 5.267 -0.210 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -2.568 5.901 -1.674 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.166 0.576 -0.968 1.00 0.00 N ATOM 1948 CA ALA B 41 -4.072 -0.700 -1.660 1.00 0.00 C ATOM 1949 C ALA B 41 -5.324 -1.541 -1.444 1.00 0.00 C ATOM 1950 O ALA B 41 -5.890 -2.072 -2.396 1.00 0.00 O ATOM 1951 CB ALA B 41 -2.836 -1.458 -1.203 1.00 0.00 C ATOM 0 H ALA B 41 -3.413 0.748 -0.302 1.00 0.00 H new ATOM 0 HA ALA B 41 -3.987 -0.498 -2.728 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -2.778 -2.411 -1.729 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -1.946 -0.868 -1.422 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -2.896 -1.639 -0.130 1.00 0.00 H new ATOM 1957 N THR B 42 -5.767 -1.636 -0.193 1.00 0.00 N ATOM 1958 CA THR B 42 -6.937 -2.440 0.141 1.00 0.00 C ATOM 1959 C THR B 42 -8.179 -1.931 -0.593 1.00 0.00 C ATOM 1960 O THR B 42 -8.907 -2.712 -1.199 1.00 0.00 O ATOM 1961 CB THR B 42 -7.221 -2.442 1.659 1.00 0.00 C ATOM 1962 OG1 THR B 42 -6.038 -2.796 2.393 1.00 0.00 O ATOM 1963 CG2 THR B 42 -8.335 -3.425 1.998 1.00 0.00 C ATOM 0 H THR B 42 -5.334 -1.167 0.603 1.00 0.00 H new ATOM 0 HA THR B 42 -6.714 -3.459 -0.175 1.00 0.00 H new ATOM 0 HB THR B 42 -7.533 -1.436 1.941 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.475 -2.002 2.510 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.519 -3.410 3.072 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.245 -3.140 1.470 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.039 -4.429 1.694 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.400 -0.619 -0.559 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.590 -0.034 -1.174 1.00 0.00 C ATOM 1973 C ASN B 43 -9.547 -0.188 -2.694 1.00 0.00 C ATOM 1974 O ASN B 43 -10.585 -0.372 -3.337 1.00 0.00 O ATOM 1975 CB ASN B 43 -9.733 1.441 -0.787 1.00 0.00 C ATOM 1976 CG ASN B 43 -11.051 2.040 -1.245 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -12.056 1.961 -0.541 1.00 0.00 O ATOM 1978 ND2 ASN B 43 -11.051 2.660 -2.415 1.00 0.00 N ATOM 0 H ASN B 43 -7.776 0.055 -0.116 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.461 -0.572 -0.800 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -9.651 1.538 0.296 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -8.910 2.008 -1.222 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -11.906 3.094 -2.762 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -10.196 2.703 -2.969 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.348 -0.132 -3.272 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.190 -0.399 -4.697 1.00 0.00 C ATOM 1987 C VAL B 44 -8.553 -1.852 -4.981 1.00 0.00 C ATOM 1988 O VAL B 44 -9.301 -2.147 -5.913 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.750 -0.125 -5.199 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.603 -0.514 -6.665 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.378 1.335 -5.003 1.00 0.00 C ATOM 0 H VAL B 44 -7.483 0.093 -2.781 1.00 0.00 H new ATOM 0 HA VAL B 44 -8.856 0.279 -5.230 1.00 0.00 H new ATOM 0 HB VAL B 44 -6.068 -0.738 -4.609 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.584 -0.312 -6.994 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -6.819 -1.576 -6.783 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -7.301 0.068 -7.267 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -5.363 1.503 -5.363 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -7.070 1.965 -5.562 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.434 1.586 -3.944 1.00 0.00 H new ATOM 2001 N LEU B 45 -8.044 -2.747 -4.140 1.00 0.00 N ATOM 2002 CA LEU B 45 -8.335 -4.171 -4.256 1.00 0.00 C ATOM 2003 C LEU B 45 -9.817 -4.442 -4.031 1.00 0.00 C ATOM 2004 O LEU B 45 -10.333 -5.486 -4.420 1.00 0.00 O ATOM 2005 CB LEU B 45 -7.503 -4.979 -3.255 1.00 0.00 C ATOM 2006 CG LEU B 45 -5.990 -4.911 -3.463 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -5.263 -5.662 -2.358 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -5.614 -5.468 -4.826 1.00 0.00 C ATOM 0 H LEU B 45 -7.424 -2.508 -3.366 1.00 0.00 H new ATOM 0 HA LEU B 45 -8.071 -4.482 -5.267 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.732 -4.627 -2.249 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -7.814 -6.022 -3.306 1.00 0.00 H new ATOM 0 HG LEU B 45 -5.685 -3.865 -3.423 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -4.187 -5.602 -2.524 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -5.507 -5.216 -1.394 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -5.573 -6.707 -2.363 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -4.533 -5.412 -4.957 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.934 -6.508 -4.895 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -6.105 -4.885 -5.605 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.495 -3.500 -3.398 1.00 0.00 N ATOM 2021 CA ASN B 46 -11.919 -3.627 -3.149 1.00 0.00 C ATOM 2022 C ASN B 46 -12.737 -3.086 -4.316 1.00 0.00 C ATOM 2023 O ASN B 46 -13.394 -3.846 -5.028 1.00 0.00 O ATOM 2024 CB ASN B 46 -12.322 -2.895 -1.858 1.00 0.00 C ATOM 2025 CG ASN B 46 -11.798 -3.560 -0.595 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -11.634 -4.871 -0.635 1.00 0.00 O flip ATOM 2027 ND2 ASN B 46 -11.545 -2.896 0.412 1.00 0.00 N flip ATOM 0 H ASN B 46 -10.080 -2.637 -3.047 1.00 0.00 H new ATOM 0 HA ASN B 46 -12.130 -4.690 -3.036 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.952 -1.871 -1.900 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.409 -2.839 -1.806 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -11.684 -1.886 0.405 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -11.196 -3.357 1.252 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.669 -1.777 -4.536 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.652 -1.107 -5.378 1.00 0.00 C ATOM 2036 C GLN B 47 -13.076 -0.547 -6.681 1.00 0.00 C ATOM 2037 O GLN B 47 -13.786 0.142 -7.410 1.00 0.00 O ATOM 2038 CB GLN B 47 -14.307 0.029 -4.587 1.00 0.00 C ATOM 2039 CG GLN B 47 -14.962 -0.428 -3.292 1.00 0.00 C ATOM 2040 CD GLN B 47 -15.601 0.705 -2.511 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -15.045 1.899 -2.625 1.00 0.00 O flip ATOM 2042 NE2 GLN B 47 -16.588 0.504 -1.802 1.00 0.00 N flip ATOM 0 H GLN B 47 -11.951 -1.165 -4.147 1.00 0.00 H new ATOM 0 HA GLN B 47 -14.381 -1.865 -5.662 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -13.553 0.782 -4.357 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -15.058 0.511 -5.214 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -15.721 -1.176 -3.521 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -14.214 -0.915 -2.666 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -16.989 -0.432 -1.740 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -17.004 1.273 -1.277 1.00 0.00 H new ATOM 2051 N ARG B 48 -11.815 -0.821 -6.994 1.00 0.00 N ATOM 2052 CA ARG B 48 -11.231 -0.259 -8.215 1.00 0.00 C ATOM 2053 C ARG B 48 -10.590 -1.308 -9.124 1.00 0.00 C ATOM 2054 O ARG B 48 -10.575 -1.139 -10.345 1.00 0.00 O ATOM 2055 CB ARG B 48 -10.224 0.851 -7.888 1.00 0.00 C ATOM 2056 CG ARG B 48 -10.878 2.207 -7.655 1.00 0.00 C ATOM 2057 CD ARG B 48 -9.849 3.327 -7.594 1.00 0.00 C ATOM 2058 NE ARG B 48 -10.479 4.648 -7.644 1.00 0.00 N ATOM 2059 CZ ARG B 48 -9.859 5.765 -8.036 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -8.572 5.733 -8.375 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -10.524 6.914 -8.088 1.00 0.00 N ATOM 0 H ARG B 48 -11.191 -1.409 -6.442 1.00 0.00 H new ATOM 0 HA ARG B 48 -12.066 0.167 -8.772 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.660 0.570 -6.999 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.509 0.936 -8.706 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -11.589 2.410 -8.456 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.444 2.182 -6.724 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -9.267 3.236 -6.677 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -9.151 3.225 -8.425 1.00 0.00 H new ATOM 0 HE ARG B 48 -11.456 4.720 -7.361 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -8.056 4.854 -8.336 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -8.102 6.587 -8.674 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.510 6.945 -7.828 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -10.049 7.765 -8.388 1.00 0.00 H new ATOM 2075 N VAL B 49 -10.062 -2.380 -8.552 1.00 0.00 N ATOM 2076 CA VAL B 49 -9.386 -3.401 -9.347 1.00 0.00 C ATOM 2077 C VAL B 49 -10.377 -4.469 -9.826 1.00 0.00 C ATOM 2078 O VAL B 49 -11.453 -4.636 -9.246 1.00 0.00 O ATOM 2079 CB VAL B 49 -8.242 -4.069 -8.547 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -8.790 -5.032 -7.507 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -7.266 -4.769 -9.476 1.00 0.00 C ATOM 0 H VAL B 49 -10.086 -2.567 -7.550 1.00 0.00 H new ATOM 0 HA VAL B 49 -8.957 -2.903 -10.217 1.00 0.00 H new ATOM 0 HB VAL B 49 -7.700 -3.283 -8.020 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -7.964 -5.486 -6.961 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -9.431 -4.490 -6.811 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -9.369 -5.811 -8.002 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -6.472 -5.230 -8.889 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -7.791 -5.538 -10.043 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -6.834 -4.042 -10.164 1.00 0.00 H new ATOM 2091 N ALA B 50 -10.015 -5.175 -10.895 1.00 0.00 N ATOM 2092 CA ALA B 50 -10.835 -6.262 -11.414 1.00 0.00 C ATOM 2093 C ALA B 50 -10.720 -7.499 -10.526 1.00 0.00 C ATOM 2094 O ALA B 50 -9.701 -7.699 -9.868 1.00 0.00 O ATOM 2095 CB ALA B 50 -10.430 -6.598 -12.844 1.00 0.00 C ATOM 0 H ALA B 50 -9.155 -5.011 -11.419 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.875 -5.935 -11.413 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.052 -7.412 -13.217 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.564 -5.720 -13.476 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.384 -6.903 -12.864 1.00 0.00 H new ATOM 2101 N ALA B 51 -11.766 -8.322 -10.512 1.00 0.00 N ATOM 2102 CA ALA B 51 -11.780 -9.546 -9.710 1.00 0.00 C ATOM 2103 C ALA B 51 -10.580 -10.436 -10.014 1.00 0.00 C ATOM 2104 O ALA B 51 -9.848 -10.830 -9.105 1.00 0.00 O ATOM 2105 CB ALA B 51 -13.070 -10.312 -9.940 1.00 0.00 C ATOM 0 H ALA B 51 -12.619 -8.164 -11.049 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.718 -9.252 -8.662 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -13.066 -11.220 -9.337 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -13.918 -9.690 -9.654 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -13.153 -10.577 -10.994 1.00 0.00 H new ATOM 2111 N SER B 52 -10.372 -10.737 -11.290 1.00 0.00 N ATOM 2112 CA SER B 52 -9.261 -11.585 -11.707 1.00 0.00 C ATOM 2113 C SER B 52 -7.925 -10.941 -11.353 1.00 0.00 C ATOM 2114 O SER B 52 -6.962 -11.621 -10.996 1.00 0.00 O ATOM 2115 CB SER B 52 -9.321 -11.818 -13.214 1.00 0.00 C ATOM 2116 OG SER B 52 -10.650 -12.084 -13.634 1.00 0.00 O ATOM 0 H SER B 52 -10.959 -10.406 -12.056 1.00 0.00 H new ATOM 0 HA SER B 52 -9.345 -12.537 -11.182 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.939 -10.941 -13.737 1.00 0.00 H new ATOM 0 HB3 SER B 52 -8.676 -12.655 -13.482 1.00 0.00 H new ATOM 0 HG SER B 52 -10.664 -12.228 -14.603 1.00 0.00 H new ATOM 2122 N GLN B 53 -7.880 -9.619 -11.440 1.00 0.00 N ATOM 2123 CA GLN B 53 -6.649 -8.883 -11.226 1.00 0.00 C ATOM 2124 C GLN B 53 -6.323 -8.793 -9.742 1.00 0.00 C ATOM 2125 O GLN B 53 -5.162 -8.685 -9.368 1.00 0.00 O ATOM 2126 CB GLN B 53 -6.765 -7.474 -11.813 1.00 0.00 C ATOM 2127 CG GLN B 53 -5.419 -6.806 -12.051 1.00 0.00 C ATOM 2128 CD GLN B 53 -4.536 -7.598 -12.994 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -3.768 -8.523 -12.443 1.00 0.00 O flip ATOM 2130 NE2 GLN B 53 -4.555 -7.395 -14.206 1.00 0.00 N flip ATOM 0 H GLN B 53 -8.687 -9.035 -11.658 1.00 0.00 H new ATOM 0 HA GLN B 53 -5.844 -9.418 -11.729 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -7.309 -7.525 -12.756 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.355 -6.855 -11.138 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -5.579 -5.809 -12.460 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -4.906 -6.680 -11.098 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -5.162 -6.672 -14.593 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.964 -7.950 -14.825 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.358 -8.877 -8.919 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.262 -8.644 -7.477 1.00 0.00 C ATOM 2141 C ARG B 54 -6.104 -9.417 -6.835 1.00 0.00 C ATOM 2142 O ARG B 54 -5.207 -8.826 -6.236 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.581 -9.040 -6.809 1.00 0.00 C ATOM 2144 CG ARG B 54 -9.013 -8.098 -5.701 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.323 -8.534 -5.058 1.00 0.00 C ATOM 2146 NE ARG B 54 -11.386 -8.780 -6.040 1.00 0.00 N ATOM 2147 CZ ARG B 54 -12.331 -7.890 -6.375 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -12.285 -6.647 -5.911 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -13.324 -8.249 -7.183 1.00 0.00 N ATOM 0 H ARG B 54 -8.300 -9.111 -9.232 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.064 -7.583 -7.327 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.364 -9.078 -7.566 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.483 -10.046 -6.401 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -8.234 -8.052 -4.940 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -9.125 -7.091 -6.104 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.153 -9.441 -4.478 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.652 -7.766 -4.358 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.407 -9.691 -6.499 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.525 -6.361 -5.293 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.009 -5.978 -6.172 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.366 -9.201 -7.547 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.043 -7.573 -7.438 1.00 0.00 H new ATOM 2163 N LYS B 55 -6.132 -10.735 -6.973 1.00 0.00 N ATOM 2164 CA LYS B 55 -5.138 -11.591 -6.338 1.00 0.00 C ATOM 2165 C LYS B 55 -3.762 -11.401 -6.968 1.00 0.00 C ATOM 2166 O LYS B 55 -2.748 -11.376 -6.268 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.573 -13.057 -6.438 1.00 0.00 C ATOM 2168 CG LYS B 55 -4.588 -14.044 -5.828 1.00 0.00 C ATOM 2169 CD LYS B 55 -4.322 -13.751 -4.358 1.00 0.00 C ATOM 2170 CE LYS B 55 -3.504 -14.857 -3.703 1.00 0.00 C ATOM 2171 NZ LYS B 55 -2.173 -15.036 -4.341 1.00 0.00 N ATOM 0 H LYS B 55 -6.833 -11.236 -7.519 1.00 0.00 H new ATOM 0 HA LYS B 55 -5.065 -11.310 -5.287 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -6.538 -13.172 -5.944 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -5.720 -13.310 -7.488 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -4.979 -15.056 -5.931 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -3.649 -14.007 -6.380 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -3.792 -12.803 -4.266 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -5.270 -13.639 -3.832 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -3.369 -14.627 -2.646 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -4.058 -15.794 -3.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -2.119 -15.981 -4.772 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -2.040 -14.312 -5.076 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -1.428 -14.940 -3.622 1.00 0.00 H new ATOM 2185 N LEU B 56 -3.736 -11.253 -8.283 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.483 -11.115 -9.009 1.00 0.00 C ATOM 2187 C LEU B 56 -1.793 -9.798 -8.680 1.00 0.00 C ATOM 2188 O LEU B 56 -0.615 -9.777 -8.340 1.00 0.00 O ATOM 2189 CB LEU B 56 -2.722 -11.210 -10.516 1.00 0.00 C ATOM 2190 CG LEU B 56 -3.199 -12.571 -11.013 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -3.474 -12.523 -12.506 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -2.164 -13.638 -10.691 1.00 0.00 C ATOM 0 H LEU B 56 -4.569 -11.225 -8.870 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.832 -11.931 -8.697 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.459 -10.459 -10.799 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -1.795 -10.957 -11.031 1.00 0.00 H new ATOM 0 HG LEU B 56 -4.128 -12.825 -10.503 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -3.813 -13.502 -12.845 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -4.245 -11.781 -12.710 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -2.561 -12.252 -13.036 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -2.515 -14.605 -11.050 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.222 -13.390 -11.179 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -2.013 -13.685 -9.613 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.537 -8.703 -8.765 1.00 0.00 N ATOM 2205 CA ILE B 57 -1.967 -7.376 -8.597 1.00 0.00 C ATOM 2206 C ILE B 57 -1.494 -7.167 -7.159 1.00 0.00 C ATOM 2207 O ILE B 57 -0.470 -6.528 -6.927 1.00 0.00 O ATOM 2208 CB ILE B 57 -2.975 -6.273 -9.011 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -2.268 -4.931 -9.202 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -4.095 -6.135 -7.989 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -3.181 -3.845 -9.727 1.00 0.00 C ATOM 0 H ILE B 57 -3.540 -8.710 -8.950 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.102 -7.300 -9.256 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.416 -6.573 -9.962 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -1.845 -4.612 -8.249 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -1.435 -5.062 -9.893 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.785 -5.354 -8.308 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.631 -7.081 -7.906 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.672 -5.872 -7.019 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -2.617 -2.919 -9.840 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.584 -4.145 -10.694 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -4.000 -3.688 -9.025 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.221 -7.740 -6.200 1.00 0.00 N ATOM 2224 CA ALA B 58 -1.837 -7.643 -4.794 1.00 0.00 C ATOM 2225 C ALA B 58 -0.543 -8.404 -4.532 1.00 0.00 C ATOM 2226 O ALA B 58 0.329 -7.941 -3.795 1.00 0.00 O ATOM 2227 CB ALA B 58 -2.948 -8.173 -3.904 1.00 0.00 C ATOM 0 H ALA B 58 -3.074 -8.273 -6.370 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.670 -6.592 -4.559 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.646 -8.094 -2.860 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.854 -7.588 -4.066 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -3.142 -9.218 -4.147 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.423 -9.566 -5.159 1.00 0.00 N ATOM 2234 CA GLU B 59 0.741 -10.419 -4.985 1.00 0.00 C ATOM 2235 C GLU B 59 1.950 -9.818 -5.700 1.00 0.00 C ATOM 2236 O GLU B 59 3.054 -9.789 -5.149 1.00 0.00 O ATOM 2237 CB GLU B 59 0.431 -11.824 -5.502 1.00 0.00 C ATOM 2238 CG GLU B 59 1.499 -12.856 -5.184 1.00 0.00 C ATOM 2239 CD GLU B 59 0.993 -14.271 -5.360 1.00 0.00 C ATOM 2240 OE1 GLU B 59 0.952 -14.757 -6.504 1.00 0.00 O ATOM 2241 OE2 GLU B 59 0.603 -14.894 -4.350 1.00 0.00 O ATOM 0 H GLU B 59 -1.125 -9.941 -5.798 1.00 0.00 H new ATOM 0 HA GLU B 59 0.984 -10.489 -3.925 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -0.516 -12.155 -5.075 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.296 -11.779 -6.583 1.00 0.00 H new ATOM 0 HG2 GLU B 59 2.361 -12.696 -5.832 1.00 0.00 H new ATOM 0 HG3 GLU B 59 1.841 -12.719 -4.158 1.00 0.00 H new ATOM 2248 N LYS B 60 1.729 -9.330 -6.920 1.00 0.00 N ATOM 2249 CA LYS B 60 2.769 -8.631 -7.674 1.00 0.00 C ATOM 2250 C LYS B 60 3.278 -7.436 -6.881 1.00 0.00 C ATOM 2251 O LYS B 60 4.482 -7.215 -6.772 1.00 0.00 O ATOM 2252 CB LYS B 60 2.229 -8.144 -9.025 1.00 0.00 C ATOM 2253 CG LYS B 60 1.922 -9.257 -10.017 1.00 0.00 C ATOM 2254 CD LYS B 60 1.199 -8.724 -11.248 1.00 0.00 C ATOM 2255 CE LYS B 60 2.035 -7.699 -12.003 1.00 0.00 C ATOM 2256 NZ LYS B 60 3.222 -8.313 -12.654 1.00 0.00 N ATOM 0 H LYS B 60 0.837 -9.406 -7.408 1.00 0.00 H new ATOM 0 HA LYS B 60 3.586 -9.331 -7.849 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.321 -7.567 -8.853 1.00 0.00 H new ATOM 0 HB3 LYS B 60 2.957 -7.467 -9.471 1.00 0.00 H new ATOM 0 HG2 LYS B 60 2.850 -9.742 -10.320 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.308 -10.017 -9.534 1.00 0.00 H new ATOM 0 HD2 LYS B 60 0.955 -9.553 -11.912 1.00 0.00 H new ATOM 0 HD3 LYS B 60 0.255 -8.270 -10.946 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.417 -7.215 -12.760 1.00 0.00 H new ATOM 0 HE3 LYS B 60 2.363 -6.921 -11.314 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 3.733 -7.589 -13.198 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 3.851 -8.708 -11.926 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 2.913 -9.072 -13.294 1.00 0.00 H new ATOM 2270 N PHE B 61 2.340 -6.678 -6.326 1.00 0.00 N ATOM 2271 CA PHE B 61 2.658 -5.494 -5.541 1.00 0.00 C ATOM 2272 C PHE B 61 3.515 -5.848 -4.331 1.00 0.00 C ATOM 2273 O PHE B 61 4.552 -5.225 -4.092 1.00 0.00 O ATOM 2274 CB PHE B 61 1.367 -4.806 -5.095 1.00 0.00 C ATOM 2275 CG PHE B 61 1.585 -3.646 -4.173 1.00 0.00 C ATOM 2276 CD1 PHE B 61 2.220 -2.501 -4.620 1.00 0.00 C ATOM 2277 CD2 PHE B 61 1.148 -3.698 -2.859 1.00 0.00 C ATOM 2278 CE1 PHE B 61 2.416 -1.431 -3.774 1.00 0.00 C ATOM 2279 CE2 PHE B 61 1.342 -2.631 -2.009 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.977 -1.496 -2.466 1.00 0.00 C ATOM 0 H PHE B 61 1.341 -6.867 -6.408 1.00 0.00 H new ATOM 0 HA PHE B 61 3.232 -4.811 -6.167 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.828 -4.460 -5.977 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.730 -5.538 -4.598 1.00 0.00 H new ATOM 0 HD1 PHE B 61 2.565 -2.445 -5.642 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.650 -4.585 -2.497 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.913 -0.542 -4.134 1.00 0.00 H new ATOM 0 HE2 PHE B 61 0.997 -2.684 -0.987 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.131 -0.658 -1.802 1.00 0.00 H new ATOM 2290 N ALA B 62 3.087 -6.856 -3.581 1.00 0.00 N ATOM 2291 CA ALA B 62 3.804 -7.279 -2.386 1.00 0.00 C ATOM 2292 C ALA B 62 5.216 -7.736 -2.731 1.00 0.00 C ATOM 2293 O ALA B 62 6.176 -7.377 -2.052 1.00 0.00 O ATOM 2294 CB ALA B 62 3.037 -8.387 -1.677 1.00 0.00 C ATOM 0 H ALA B 62 2.245 -7.396 -3.780 1.00 0.00 H new ATOM 0 HA ALA B 62 3.884 -6.425 -1.713 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.583 -8.695 -0.785 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.051 -8.021 -1.390 1.00 0.00 H new ATOM 0 HB3 ALA B 62 2.927 -9.240 -2.347 1.00 0.00 H new ATOM 2300 N GLN B 63 5.346 -8.507 -3.804 1.00 0.00 N ATOM 2301 CA GLN B 63 6.651 -8.998 -4.231 1.00 0.00 C ATOM 2302 C GLN B 63 7.522 -7.845 -4.723 1.00 0.00 C ATOM 2303 O GLN B 63 8.717 -7.792 -4.429 1.00 0.00 O ATOM 2304 CB GLN B 63 6.494 -10.060 -5.326 1.00 0.00 C ATOM 2305 CG GLN B 63 7.814 -10.647 -5.817 1.00 0.00 C ATOM 2306 CD GLN B 63 8.639 -11.266 -4.700 1.00 0.00 C ATOM 2307 OE1 GLN B 63 8.497 -12.447 -4.382 1.00 0.00 O ATOM 2308 NE2 GLN B 63 9.512 -10.469 -4.102 1.00 0.00 N ATOM 0 H GLN B 63 4.568 -8.805 -4.392 1.00 0.00 H new ATOM 0 HA GLN B 63 7.143 -9.458 -3.374 1.00 0.00 H new ATOM 0 HB2 GLN B 63 5.868 -10.868 -4.947 1.00 0.00 H new ATOM 0 HB3 GLN B 63 5.967 -9.619 -6.172 1.00 0.00 H new ATOM 0 HG2 GLN B 63 7.610 -11.405 -6.573 1.00 0.00 H new ATOM 0 HG3 GLN B 63 8.397 -9.863 -6.300 1.00 0.00 H new ATOM 0 HE21 GLN B 63 9.599 -9.496 -4.396 1.00 0.00 H new ATOM 0 HE22 GLN B 63 10.097 -10.828 -3.348 1.00 0.00 H new ATOM 2317 N ALA B 64 6.922 -6.918 -5.460 1.00 0.00 N ATOM 2318 CA ALA B 64 7.641 -5.743 -5.941 1.00 0.00 C ATOM 2319 C ALA B 64 8.125 -4.898 -4.767 1.00 0.00 C ATOM 2320 O ALA B 64 9.232 -4.355 -4.792 1.00 0.00 O ATOM 2321 CB ALA B 64 6.760 -4.914 -6.866 1.00 0.00 C ATOM 0 H ALA B 64 5.941 -6.956 -5.738 1.00 0.00 H new ATOM 0 HA ALA B 64 8.509 -6.080 -6.507 1.00 0.00 H new ATOM 0 HB1 ALA B 64 7.315 -4.043 -7.213 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.461 -5.519 -7.722 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.872 -4.586 -6.326 1.00 0.00 H new ATOM 2327 N LEU B 65 7.289 -4.810 -3.739 1.00 0.00 N ATOM 2328 CA LEU B 65 7.615 -4.068 -2.531 1.00 0.00 C ATOM 2329 C LEU B 65 8.791 -4.719 -1.798 1.00 0.00 C ATOM 2330 O LEU B 65 9.723 -4.039 -1.379 1.00 0.00 O ATOM 2331 CB LEU B 65 6.387 -3.995 -1.617 1.00 0.00 C ATOM 2332 CG LEU B 65 6.556 -3.142 -0.361 1.00 0.00 C ATOM 2333 CD1 LEU B 65 6.914 -1.716 -0.736 1.00 0.00 C ATOM 2334 CD2 LEU B 65 5.286 -3.162 0.472 1.00 0.00 C ATOM 0 H LEU B 65 6.369 -5.250 -3.721 1.00 0.00 H new ATOM 0 HA LEU B 65 7.908 -3.056 -2.810 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.549 -3.602 -2.193 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.119 -5.007 -1.315 1.00 0.00 H new ATOM 0 HG LEU B 65 7.367 -3.562 0.233 1.00 0.00 H new ATOM 0 HD11 LEU B 65 7.031 -1.120 0.169 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.848 -1.711 -1.297 1.00 0.00 H new ATOM 0 HD13 LEU B 65 6.120 -1.291 -1.350 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.425 -2.549 1.362 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.459 -2.765 -0.116 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.061 -4.187 0.768 1.00 0.00 H new ATOM 2346 N MET B 66 8.748 -6.042 -1.671 1.00 0.00 N ATOM 2347 CA MET B 66 9.806 -6.787 -0.986 1.00 0.00 C ATOM 2348 C MET B 66 11.108 -6.743 -1.779 1.00 0.00 C ATOM 2349 O MET B 66 12.198 -6.787 -1.210 1.00 0.00 O ATOM 2350 CB MET B 66 9.382 -8.240 -0.761 1.00 0.00 C ATOM 2351 CG MET B 66 8.138 -8.387 0.102 1.00 0.00 C ATOM 2352 SD MET B 66 8.340 -7.674 1.745 1.00 0.00 S ATOM 2353 CE MET B 66 6.676 -7.849 2.384 1.00 0.00 C ATOM 0 H MET B 66 7.992 -6.623 -2.033 1.00 0.00 H new ATOM 0 HA MET B 66 9.974 -6.313 -0.019 1.00 0.00 H new ATOM 0 HB2 MET B 66 9.201 -8.710 -1.728 1.00 0.00 H new ATOM 0 HB3 MET B 66 10.204 -8.781 -0.293 1.00 0.00 H new ATOM 0 HG2 MET B 66 7.296 -7.906 -0.397 1.00 0.00 H new ATOM 0 HG3 MET B 66 7.890 -9.444 0.198 1.00 0.00 H new ATOM 0 HE1 MET B 66 6.663 -7.586 3.442 1.00 0.00 H new ATOM 0 HE2 MET B 66 6.005 -7.187 1.837 1.00 0.00 H new ATOM 0 HE3 MET B 66 6.346 -8.881 2.263 1.00 0.00 H new ATOM 2363 N SER B 67 10.988 -6.657 -3.094 1.00 0.00 N ATOM 2364 CA SER B 67 12.155 -6.566 -3.962 1.00 0.00 C ATOM 2365 C SER B 67 12.798 -5.186 -3.830 1.00 0.00 C ATOM 2366 O SER B 67 14.020 -5.055 -3.840 1.00 0.00 O ATOM 2367 CB SER B 67 11.750 -6.841 -5.417 1.00 0.00 C ATOM 2368 OG SER B 67 12.877 -6.913 -6.276 1.00 0.00 O ATOM 0 H SER B 67 10.094 -6.648 -3.586 1.00 0.00 H new ATOM 0 HA SER B 67 12.886 -7.317 -3.660 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.194 -7.777 -5.468 1.00 0.00 H new ATOM 0 HB3 SER B 67 11.080 -6.053 -5.762 1.00 0.00 H new ATOM 0 HG SER B 67 12.579 -7.091 -7.193 1.00 0.00 H new ATOM 2374 N SER B 68 11.961 -4.167 -3.663 1.00 0.00 N ATOM 2375 CA SER B 68 12.433 -2.794 -3.538 1.00 0.00 C ATOM 2376 C SER B 68 12.741 -2.457 -2.081 1.00 0.00 C ATOM 2377 O SER B 68 13.088 -1.323 -1.751 1.00 0.00 O ATOM 2378 CB SER B 68 11.377 -1.841 -4.092 1.00 0.00 C ATOM 2379 OG SER B 68 10.970 -2.241 -5.392 1.00 0.00 O ATOM 0 H SER B 68 10.947 -4.268 -3.611 1.00 0.00 H new ATOM 0 HA SER B 68 13.354 -2.684 -4.110 1.00 0.00 H new ATOM 0 HB2 SER B 68 10.514 -1.820 -3.426 1.00 0.00 H new ATOM 0 HB3 SER B 68 11.777 -0.828 -4.127 1.00 0.00 H new ATOM 0 HG SER B 68 10.346 -2.993 -5.322 1.00 0.00 H new ATOM 2385 N LEU B 69 12.607 -3.452 -1.214 1.00 0.00 N ATOM 2386 CA LEU B 69 12.890 -3.281 0.199 1.00 0.00 C ATOM 2387 C LEU B 69 14.392 -3.158 0.425 1.00 0.00 C ATOM 2388 O LEU B 69 15.114 -4.156 0.441 1.00 0.00 O ATOM 2389 CB LEU B 69 12.331 -4.462 0.999 1.00 0.00 C ATOM 2390 CG LEU B 69 12.565 -4.399 2.512 1.00 0.00 C ATOM 2391 CD1 LEU B 69 11.817 -3.227 3.125 1.00 0.00 C ATOM 2392 CD2 LEU B 69 12.149 -5.703 3.174 1.00 0.00 C ATOM 0 H LEU B 69 12.302 -4.391 -1.470 1.00 0.00 H new ATOM 0 HA LEU B 69 12.408 -2.366 0.542 1.00 0.00 H new ATOM 0 HB2 LEU B 69 11.258 -4.528 0.817 1.00 0.00 H new ATOM 0 HB3 LEU B 69 12.776 -5.381 0.617 1.00 0.00 H new ATOM 0 HG LEU B 69 13.631 -4.251 2.684 1.00 0.00 H new ATOM 0 HD11 LEU B 69 11.998 -3.202 4.200 1.00 0.00 H new ATOM 0 HD12 LEU B 69 12.167 -2.297 2.676 1.00 0.00 H new ATOM 0 HD13 LEU B 69 10.749 -3.340 2.939 1.00 0.00 H new ATOM 0 HD21 LEU B 69 12.323 -5.638 4.248 1.00 0.00 H new ATOM 0 HD22 LEU B 69 11.090 -5.884 2.988 1.00 0.00 H new ATOM 0 HD23 LEU B 69 12.735 -6.524 2.761 1.00 0.00 H new ATOM 2404 N GLU B 70 14.863 -1.929 0.562 1.00 0.00 N ATOM 2405 CA GLU B 70 16.270 -1.683 0.809 1.00 0.00 C ATOM 2406 C GLU B 70 16.608 -1.919 2.273 1.00 0.00 C ATOM 2407 O GLU B 70 16.255 -1.126 3.144 1.00 0.00 O ATOM 2408 CB GLU B 70 16.654 -0.262 0.401 1.00 0.00 C ATOM 2409 CG GLU B 70 16.563 -0.009 -1.095 1.00 0.00 C ATOM 2410 CD GLU B 70 17.222 1.293 -1.497 1.00 0.00 C ATOM 2411 OE1 GLU B 70 18.466 1.370 -1.448 1.00 0.00 O ATOM 2412 OE2 GLU B 70 16.507 2.252 -1.855 1.00 0.00 O ATOM 0 H GLU B 70 14.289 -1.087 0.506 1.00 0.00 H new ATOM 0 HA GLU B 70 16.844 -2.383 0.202 1.00 0.00 H new ATOM 0 HB2 GLU B 70 16.005 0.443 0.920 1.00 0.00 H new ATOM 0 HB3 GLU B 70 17.673 -0.061 0.733 1.00 0.00 H new ATOM 0 HG2 GLU B 70 17.035 -0.833 -1.630 1.00 0.00 H new ATOM 0 HG3 GLU B 70 15.515 0.008 -1.396 1.00 0.00 H new ATOM 2419 N THR B 71 17.262 -3.032 2.540 1.00 0.00 N ATOM 2420 CA THR B 71 17.699 -3.349 3.881 1.00 0.00 C ATOM 2421 C THR B 71 18.974 -4.192 3.821 1.00 0.00 C ATOM 2422 O THR B 71 19.110 -5.057 2.957 1.00 0.00 O ATOM 2423 CB THR B 71 16.588 -4.085 4.677 1.00 0.00 C ATOM 2424 OG1 THR B 71 16.936 -4.154 6.065 1.00 0.00 O ATOM 2425 CG2 THR B 71 16.347 -5.491 4.141 1.00 0.00 C ATOM 0 H THR B 71 17.503 -3.734 1.840 1.00 0.00 H new ATOM 0 HA THR B 71 17.912 -2.418 4.406 1.00 0.00 H new ATOM 0 HB THR B 71 15.667 -3.514 4.557 1.00 0.00 H new ATOM 0 HG1 THR B 71 16.227 -4.619 6.557 1.00 0.00 H new ATOM 0 HG21 THR B 71 15.563 -5.973 4.724 1.00 0.00 H new ATOM 0 HG22 THR B 71 16.040 -5.435 3.097 1.00 0.00 H new ATOM 0 HG23 THR B 71 17.266 -6.072 4.218 1.00 0.00 H new ATOM 2433 N PRO B 72 19.947 -3.913 4.701 1.00 0.00 N ATOM 2434 CA PRO B 72 21.214 -4.640 4.734 1.00 0.00 C ATOM 2435 C PRO B 72 21.136 -5.928 5.554 1.00 0.00 C ATOM 2436 O PRO B 72 20.053 -6.487 5.755 1.00 0.00 O ATOM 2437 CB PRO B 72 22.149 -3.633 5.403 1.00 0.00 C ATOM 2438 CG PRO B 72 21.275 -2.876 6.343 1.00 0.00 C ATOM 2439 CD PRO B 72 19.899 -2.850 5.724 1.00 0.00 C ATOM 0 HA PRO B 72 21.533 -4.967 3.744 1.00 0.00 H new ATOM 0 HB2 PRO B 72 22.959 -4.135 5.932 1.00 0.00 H new ATOM 0 HB3 PRO B 72 22.609 -2.971 4.669 1.00 0.00 H new ATOM 0 HG2 PRO B 72 21.251 -3.356 7.321 1.00 0.00 H new ATOM 0 HG3 PRO B 72 21.652 -1.864 6.493 1.00 0.00 H new ATOM 0 HD2 PRO B 72 19.124 -3.044 6.466 1.00 0.00 H new ATOM 0 HD3 PRO B 72 19.679 -1.879 5.280 1.00 0.00 H new ATOM 2447 N LYS B 73 22.304 -6.391 6.001 1.00 0.00 N ATOM 2448 CA LYS B 73 22.432 -7.574 6.859 1.00 0.00 C ATOM 2449 C LYS B 73 22.205 -8.872 6.092 1.00 0.00 C ATOM 2450 O LYS B 73 22.080 -9.938 6.694 1.00 0.00 O ATOM 2451 CB LYS B 73 21.492 -7.509 8.068 1.00 0.00 C ATOM 2452 CG LYS B 73 21.882 -6.461 9.095 1.00 0.00 C ATOM 2453 CD LYS B 73 21.027 -6.576 10.345 1.00 0.00 C ATOM 2454 CE LYS B 73 21.456 -5.587 11.414 1.00 0.00 C ATOM 2455 NZ LYS B 73 20.696 -5.781 12.675 1.00 0.00 N ATOM 0 H LYS B 73 23.197 -5.953 5.777 1.00 0.00 H new ATOM 0 HA LYS B 73 23.460 -7.571 7.221 1.00 0.00 H new ATOM 0 HB2 LYS B 73 20.480 -7.302 7.719 1.00 0.00 H new ATOM 0 HB3 LYS B 73 21.469 -8.486 8.551 1.00 0.00 H new ATOM 0 HG2 LYS B 73 22.933 -6.578 9.358 1.00 0.00 H new ATOM 0 HG3 LYS B 73 21.770 -5.466 8.664 1.00 0.00 H new ATOM 0 HD2 LYS B 73 19.982 -6.403 10.088 1.00 0.00 H new ATOM 0 HD3 LYS B 73 21.094 -7.590 10.740 1.00 0.00 H new ATOM 0 HE2 LYS B 73 22.522 -5.702 11.610 1.00 0.00 H new ATOM 0 HE3 LYS B 73 21.306 -4.570 11.051 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 21.015 -5.089 13.383 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 19.681 -5.647 12.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 20.859 -6.743 13.034 1.00 0.00 H new ATOM 2469 N THR B 74 22.167 -8.792 4.767 1.00 0.00 N ATOM 2470 CA THR B 74 22.105 -9.993 3.951 1.00 0.00 C ATOM 2471 C THR B 74 23.472 -10.682 3.989 1.00 0.00 C ATOM 2472 O THR B 74 23.569 -11.907 3.913 1.00 0.00 O ATOM 2473 CB THR B 74 21.676 -9.686 2.490 1.00 0.00 C ATOM 2474 OG1 THR B 74 21.436 -10.904 1.772 1.00 0.00 O ATOM 2475 CG2 THR B 74 22.726 -8.864 1.755 1.00 0.00 C ATOM 0 H THR B 74 22.178 -7.918 4.242 1.00 0.00 H new ATOM 0 HA THR B 74 21.343 -10.656 4.360 1.00 0.00 H new ATOM 0 HB THR B 74 20.757 -9.102 2.539 1.00 0.00 H new ATOM 0 HG1 THR B 74 21.165 -10.695 0.854 1.00 0.00 H new ATOM 0 HG21 THR B 74 22.389 -8.670 0.737 1.00 0.00 H new ATOM 0 HG22 THR B 74 22.876 -7.917 2.274 1.00 0.00 H new ATOM 0 HG23 THR B 74 23.666 -9.415 1.727 1.00 0.00 H new ATOM 2483 N HIS B 75 24.515 -9.859 4.133 1.00 0.00 N ATOM 2484 CA HIS B 75 25.885 -10.317 4.354 1.00 0.00 C ATOM 2485 C HIS B 75 26.419 -11.150 3.190 1.00 0.00 C ATOM 2486 O HIS B 75 26.253 -12.370 3.147 1.00 0.00 O ATOM 2487 CB HIS B 75 25.996 -11.093 5.674 1.00 0.00 C ATOM 2488 CG HIS B 75 27.383 -11.574 5.975 1.00 0.00 C ATOM 2489 ND1 HIS B 75 28.463 -10.730 6.106 1.00 0.00 N ATOM 2490 CD2 HIS B 75 27.863 -12.825 6.148 1.00 0.00 C ATOM 2491 CE1 HIS B 75 29.549 -11.443 6.346 1.00 0.00 C ATOM 2492 NE2 HIS B 75 29.213 -12.720 6.377 1.00 0.00 N ATOM 0 H HIS B 75 24.428 -8.843 4.098 1.00 0.00 H new ATOM 0 HA HIS B 75 26.509 -9.425 4.419 1.00 0.00 H new ATOM 0 HB2 HIS B 75 25.657 -10.455 6.490 1.00 0.00 H new ATOM 0 HB3 HIS B 75 25.323 -11.950 5.639 1.00 0.00 H new ATOM 0 HD2 HIS B 75 27.290 -13.740 6.113 1.00 0.00 H new ATOM 0 HE1 HIS B 75 30.544 -11.048 6.492 1.00 0.00 H new ATOM 0 HE2 HIS B 75 29.850 -13.499 6.543 1.00 0.00 H new ATOM 2501 N LEU B 76 27.062 -10.472 2.251 1.00 0.00 N ATOM 2502 CA LEU B 76 27.756 -11.146 1.167 1.00 0.00 C ATOM 2503 C LEU B 76 28.936 -11.922 1.733 1.00 0.00 C ATOM 2504 O LEU B 76 29.695 -11.401 2.552 1.00 0.00 O ATOM 2505 CB LEU B 76 28.239 -10.135 0.125 1.00 0.00 C ATOM 2506 CG LEU B 76 27.137 -9.284 -0.511 1.00 0.00 C ATOM 2507 CD1 LEU B 76 27.725 -8.299 -1.509 1.00 0.00 C ATOM 2508 CD2 LEU B 76 26.106 -10.170 -1.188 1.00 0.00 C ATOM 0 H LEU B 76 27.117 -9.454 2.219 1.00 0.00 H new ATOM 0 HA LEU B 76 27.068 -11.835 0.677 1.00 0.00 H new ATOM 0 HB2 LEU B 76 28.965 -9.471 0.594 1.00 0.00 H new ATOM 0 HB3 LEU B 76 28.763 -10.673 -0.665 1.00 0.00 H new ATOM 0 HG LEU B 76 26.644 -8.718 0.280 1.00 0.00 H new ATOM 0 HD11 LEU B 76 26.924 -7.705 -1.949 1.00 0.00 H new ATOM 0 HD12 LEU B 76 28.428 -7.640 -0.999 1.00 0.00 H new ATOM 0 HD13 LEU B 76 28.245 -8.845 -2.296 1.00 0.00 H new ATOM 0 HD21 LEU B 76 25.330 -9.549 -1.635 1.00 0.00 H new ATOM 0 HD22 LEU B 76 26.589 -10.762 -1.965 1.00 0.00 H new ATOM 0 HD23 LEU B 76 25.658 -10.836 -0.450 1.00 0.00 H new ATOM 2520 N GLU B 77 29.086 -13.164 1.309 1.00 0.00 N ATOM 2521 CA GLU B 77 30.096 -14.034 1.878 1.00 0.00 C ATOM 2522 C GLU B 77 31.230 -14.313 0.911 1.00 0.00 C ATOM 2523 O GLU B 77 31.070 -14.242 -0.309 1.00 0.00 O ATOM 2524 CB GLU B 77 29.479 -15.358 2.325 1.00 0.00 C ATOM 2525 CG GLU B 77 29.205 -15.429 3.817 1.00 0.00 C ATOM 2526 CD GLU B 77 30.461 -15.252 4.649 1.00 0.00 C ATOM 2527 OE1 GLU B 77 31.577 -15.314 4.086 1.00 0.00 O ATOM 2528 OE2 GLU B 77 30.339 -15.039 5.873 1.00 0.00 O ATOM 0 H GLU B 77 28.522 -13.591 0.574 1.00 0.00 H new ATOM 0 HA GLU B 77 30.508 -13.508 2.739 1.00 0.00 H new ATOM 0 HB2 GLU B 77 28.545 -15.515 1.785 1.00 0.00 H new ATOM 0 HB3 GLU B 77 30.148 -16.173 2.048 1.00 0.00 H new ATOM 0 HG2 GLU B 77 28.483 -14.659 4.087 1.00 0.00 H new ATOM 0 HG3 GLU B 77 28.749 -16.390 4.054 1.00 0.00 H new ATOM 2535 N HIS B 78 32.382 -14.618 1.484 1.00 0.00 N ATOM 2536 CA HIS B 78 33.535 -15.067 0.728 1.00 0.00 C ATOM 2537 C HIS B 78 34.144 -16.288 1.401 1.00 0.00 C ATOM 2538 O HIS B 78 35.181 -16.794 0.973 1.00 0.00 O ATOM 2539 CB HIS B 78 34.573 -13.952 0.584 1.00 0.00 C ATOM 2540 CG HIS B 78 34.251 -12.981 -0.508 1.00 0.00 C ATOM 2541 ND1 HIS B 78 33.503 -11.841 -0.316 1.00 0.00 N ATOM 2542 CD2 HIS B 78 34.579 -12.995 -1.820 1.00 0.00 C ATOM 2543 CE1 HIS B 78 33.382 -11.199 -1.462 1.00 0.00 C ATOM 2544 NE2 HIS B 78 34.026 -11.878 -2.391 1.00 0.00 N ATOM 0 H HIS B 78 32.543 -14.560 2.490 1.00 0.00 H new ATOM 0 HA HIS B 78 33.208 -15.339 -0.276 1.00 0.00 H new ATOM 0 HB2 HIS B 78 34.651 -13.413 1.528 1.00 0.00 H new ATOM 0 HB3 HIS B 78 35.549 -14.397 0.389 1.00 0.00 H new ATOM 0 HD2 HIS B 78 35.168 -13.747 -2.325 1.00 0.00 H new ATOM 0 HE1 HIS B 78 32.846 -10.274 -1.614 1.00 0.00 H new ATOM 0 HE2 HIS B 78 34.101 -11.615 -3.374 1.00 0.00 H new ATOM 2553 N HIS B 79 33.486 -16.749 2.464 1.00 0.00 N ATOM 2554 CA HIS B 79 33.873 -17.988 3.128 1.00 0.00 C ATOM 2555 C HIS B 79 33.522 -19.163 2.226 1.00 0.00 C ATOM 2556 O HIS B 79 32.353 -19.526 2.086 1.00 0.00 O ATOM 2557 CB HIS B 79 33.163 -18.118 4.482 1.00 0.00 C ATOM 2558 CG HIS B 79 33.564 -19.324 5.281 1.00 0.00 C ATOM 2559 ND1 HIS B 79 34.628 -19.331 6.158 1.00 0.00 N ATOM 2560 CD2 HIS B 79 33.019 -20.564 5.350 1.00 0.00 C ATOM 2561 CE1 HIS B 79 34.720 -20.517 6.727 1.00 0.00 C ATOM 2562 NE2 HIS B 79 33.755 -21.284 6.258 1.00 0.00 N ATOM 0 H HIS B 79 32.682 -16.281 2.882 1.00 0.00 H new ATOM 0 HA HIS B 79 34.947 -17.980 3.313 1.00 0.00 H new ATOM 0 HB2 HIS B 79 33.365 -17.224 5.071 1.00 0.00 H new ATOM 0 HB3 HIS B 79 32.087 -18.152 4.312 1.00 0.00 H new ATOM 0 HD2 HIS B 79 32.164 -20.919 4.794 1.00 0.00 H new ATOM 0 HE1 HIS B 79 35.461 -20.811 7.455 1.00 0.00 H new ATOM 0 HE2 HIS B 79 33.584 -22.253 6.526 1.00 0.00 H new ATOM 2571 N HIS B 80 34.533 -19.735 1.600 1.00 0.00 N ATOM 2572 CA HIS B 80 34.323 -20.776 0.610 1.00 0.00 C ATOM 2573 C HIS B 80 34.388 -22.160 1.227 1.00 0.00 C ATOM 2574 O HIS B 80 34.777 -22.328 2.384 1.00 0.00 O ATOM 2575 CB HIS B 80 35.365 -20.674 -0.506 1.00 0.00 C ATOM 2576 CG HIS B 80 35.149 -19.530 -1.441 1.00 0.00 C ATOM 2577 ND1 HIS B 80 36.097 -18.564 -1.679 1.00 0.00 N ATOM 2578 CD2 HIS B 80 34.097 -19.224 -2.231 1.00 0.00 C ATOM 2579 CE1 HIS B 80 35.638 -17.711 -2.574 1.00 0.00 C ATOM 2580 NE2 HIS B 80 34.423 -18.089 -2.931 1.00 0.00 N ATOM 0 H HIS B 80 35.512 -19.496 1.760 1.00 0.00 H new ATOM 0 HA HIS B 80 33.325 -20.628 0.197 1.00 0.00 H new ATOM 0 HB2 HIS B 80 36.354 -20.580 -0.057 1.00 0.00 H new ATOM 0 HB3 HIS B 80 35.361 -21.602 -1.078 1.00 0.00 H new ATOM 0 HD2 HIS B 80 33.169 -19.772 -2.299 1.00 0.00 H new ATOM 0 HE1 HIS B 80 36.166 -16.848 -2.952 1.00 0.00 H new ATOM 0 HE2 HIS B 80 33.828 -17.617 -3.612 1.00 0.00 H new ATOM 2589 N HIS B 81 33.987 -23.143 0.439 1.00 0.00 N ATOM 2590 CA HIS B 81 34.133 -24.539 0.813 1.00 0.00 C ATOM 2591 C HIS B 81 35.520 -25.017 0.424 1.00 0.00 C ATOM 2592 O HIS B 81 36.204 -24.377 -0.377 1.00 0.00 O ATOM 2593 CB HIS B 81 33.088 -25.411 0.110 1.00 0.00 C ATOM 2594 CG HIS B 81 31.689 -25.231 0.610 1.00 0.00 C ATOM 2595 ND1 HIS B 81 30.842 -26.289 0.841 1.00 0.00 N ATOM 2596 CD2 HIS B 81 30.979 -24.114 0.896 1.00 0.00 C ATOM 2597 CE1 HIS B 81 29.673 -25.834 1.243 1.00 0.00 C ATOM 2598 NE2 HIS B 81 29.725 -24.514 1.287 1.00 0.00 N ATOM 0 H HIS B 81 33.554 -22.997 -0.473 1.00 0.00 H new ATOM 0 HA HIS B 81 33.988 -24.624 1.890 1.00 0.00 H new ATOM 0 HB2 HIS B 81 33.109 -25.192 -0.957 1.00 0.00 H new ATOM 0 HB3 HIS B 81 33.370 -26.458 0.226 1.00 0.00 H new ATOM 0 HD2 HIS B 81 31.334 -23.096 0.829 1.00 0.00 H new ATOM 0 HE1 HIS B 81 28.815 -26.439 1.495 1.00 0.00 H new ATOM 0 HE2 HIS B 81 28.962 -23.897 1.565 1.00 0.00 H new ATOM 2607 N HIS B 82 35.936 -26.130 0.990 1.00 0.00 N ATOM 2608 CA HIS B 82 37.201 -26.732 0.620 1.00 0.00 C ATOM 2609 C HIS B 82 36.951 -27.863 -0.361 1.00 0.00 C ATOM 2610 O HIS B 82 36.256 -28.827 -0.043 1.00 0.00 O ATOM 2611 CB HIS B 82 37.938 -27.256 1.851 1.00 0.00 C ATOM 2612 CG HIS B 82 39.314 -27.771 1.550 1.00 0.00 C ATOM 2613 ND1 HIS B 82 39.569 -29.067 1.156 1.00 0.00 N ATOM 2614 CD2 HIS B 82 40.517 -27.152 1.595 1.00 0.00 C ATOM 2615 CE1 HIS B 82 40.866 -29.222 0.975 1.00 0.00 C ATOM 2616 NE2 HIS B 82 41.467 -28.075 1.234 1.00 0.00 N ATOM 0 H HIS B 82 35.418 -26.637 1.708 1.00 0.00 H new ATOM 0 HA HIS B 82 37.828 -25.973 0.152 1.00 0.00 H new ATOM 0 HB2 HIS B 82 38.011 -26.457 2.589 1.00 0.00 H new ATOM 0 HB3 HIS B 82 37.351 -28.055 2.304 1.00 0.00 H new ATOM 0 HD2 HIS B 82 40.696 -26.122 1.865 1.00 0.00 H new ATOM 0 HE1 HIS B 82 41.355 -30.134 0.667 1.00 0.00 H new ATOM 0 HE2 HIS B 82 42.471 -27.903 1.176 1.00 0.00 H new ATOM 2625 N HIS B 83 37.508 -27.740 -1.550 1.00 0.00 N ATOM 2626 CA HIS B 83 37.324 -28.748 -2.572 1.00 0.00 C ATOM 2627 C HIS B 83 38.548 -29.648 -2.628 1.00 0.00 C ATOM 2628 O HIS B 83 39.396 -29.459 -3.523 1.00 0.00 O ATOM 2629 CB HIS B 83 37.073 -28.090 -3.932 1.00 0.00 C ATOM 2630 CG HIS B 83 36.567 -29.042 -4.973 1.00 0.00 C ATOM 2631 ND1 HIS B 83 37.367 -29.601 -5.946 1.00 0.00 N ATOM 2632 CD2 HIS B 83 35.324 -29.526 -5.192 1.00 0.00 C ATOM 2633 CE1 HIS B 83 36.638 -30.384 -6.715 1.00 0.00 C ATOM 2634 NE2 HIS B 83 35.393 -30.357 -6.281 1.00 0.00 N ATOM 2635 OXT HIS B 83 38.672 -30.528 -1.758 1.00 0.00 O ATOM 0 H HIS B 83 38.091 -26.952 -1.831 1.00 0.00 H new ATOM 0 HA HIS B 83 36.452 -29.354 -2.324 1.00 0.00 H new ATOM 0 HB2 HIS B 83 36.351 -27.282 -3.808 1.00 0.00 H new ATOM 0 HB3 HIS B 83 38.000 -27.638 -4.285 1.00 0.00 H new ATOM 0 HD2 HIS B 83 34.439 -29.300 -4.615 1.00 0.00 H new ATOM 0 HE1 HIS B 83 36.999 -30.953 -7.559 1.00 0.00 H new ATOM 0 HE2 HIS B 83 34.611 -30.869 -6.688 1.00 0.00 H new TER 2644 HIS B 83