USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1118 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 92 THR OG1 : rot 104:sc=-0.00819 USER MOD Set 1.2: A 116 MET CE :methyl -115:sc= -0.401 (180deg=-0.67) USER MOD Set 2.1: A 81 MET CE :methyl -112:sc= -1.4 (180deg=-6.22!) USER MOD Set 2.2: A 130 THR OG1 : rot -72:sc= 0.553 USER MOD Set 3.1: A 8 HIS : no HE2:sc= -0.313 K(o=-0.32,f=-4.3!) USER MOD Set 3.2: A 137 HIS : no HD1:sc=-0.00293 X(o=-0.32,f=-0.44) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HE2:sc= 0.522 K(o=0.52,f=-1.8!) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.0072) USER MOD Single : A 6 HIS : no HD1:sc= -0.0111 X(o=-0.011,f=0) USER MOD Single : A 7 HIS :FLIP no HD1:sc= -0.56 F(o=-1.2,f=-0.56) USER MOD Single : A 10 MET CE :methyl 147:sc= -1.98 (180deg=-4.7!) USER MOD Single : A 14 HIS : no HD1:sc=-0.00658 X(o=-0.0066,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -2:sc= 0.345 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.148 K(o=-0.15,f=-1.4) USER MOD Single : A 51 TYR OH : rot 180:sc= -1.73! USER MOD Single : A 55 ASN : amide:sc= -0.47 K(o=-0.47,f=-1.4!) USER MOD Single : A 60 CYS SG : rot 106:sc= 0.417 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 156:sc= 1.25 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ -153:sc= 0 (180deg=-0.23) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 73:sc= -1.31! USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 175:sc= -0.182 (180deg=-0.218) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0798) USER MOD Single : A 97 LYS NZ :NH3+ 152:sc= -0.145 (180deg=-0.784) USER MOD Single : A 104 SER OG : rot 180:sc= 0.0736 USER MOD Single : A 105 THR OG1 : rot 173:sc= 0.452 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 83:sc= 1.14 USER MOD Single : A 126 SER OG : rot -99:sc= 1.04 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 ASN : amide:sc= -0.247 X(o=-0.25,f=-0.74) USER MOD Single : A 136 THR OG1 : rot -71:sc= 0.349 USER MOD Single : A 138 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.032 15.715 0.245 1.00 60.42 N ATOM 2 CA MET A 1 -0.339 16.725 -0.761 1.00 63.44 C ATOM 3 C MET A 1 0.659 16.664 -1.914 1.00 12.42 C ATOM 4 O MET A 1 1.722 16.056 -1.796 1.00 32.24 O ATOM 5 CB MET A 1 -0.327 18.120 -0.134 1.00 54.02 C ATOM 6 CG MET A 1 -1.469 19.007 -0.604 1.00 61.14 C ATOM 7 SD MET A 1 -2.686 19.317 0.689 1.00 1.04 S ATOM 8 CE MET A 1 -1.963 20.741 1.500 1.00 24.13 C ATOM 0 H1 MET A 1 -0.723 15.775 1.019 1.00 60.42 H new ATOM 0 H2 MET A 1 -0.077 14.770 -0.187 1.00 60.42 H new ATOM 0 H3 MET A 1 0.924 15.879 0.621 1.00 60.42 H new ATOM 0 HA MET A 1 -1.335 16.520 -1.154 1.00 63.44 H new ATOM 0 HB2 MET A 1 -0.376 18.022 0.951 1.00 54.02 H new ATOM 0 HB3 MET A 1 0.620 18.606 -0.368 1.00 54.02 H new ATOM 0 HG2 MET A 1 -1.065 19.958 -0.953 1.00 61.14 H new ATOM 0 HG3 MET A 1 -1.961 18.538 -1.456 1.00 61.14 H new ATOM 0 HE1 MET A 1 -2.602 21.053 2.326 1.00 24.13 H new ATOM 0 HE2 MET A 1 -0.977 20.480 1.883 1.00 24.13 H new ATOM 0 HE3 MET A 1 -1.869 21.558 0.785 1.00 24.13 H new ATOM 18 N ALA A 2 0.309 17.299 -3.028 1.00 15.24 N ATOM 19 CA ALA A 2 1.174 17.319 -4.200 1.00 70.53 C ATOM 20 C ALA A 2 2.418 18.165 -3.951 1.00 33.12 C ATOM 21 O ALA A 2 2.371 19.393 -4.029 1.00 22.02 O ATOM 22 CB ALA A 2 0.412 17.840 -5.410 1.00 23.01 C ATOM 0 H ALA A 2 -0.568 17.807 -3.143 1.00 15.24 H new ATOM 0 HA ALA A 2 1.496 16.297 -4.400 1.00 70.53 H new ATOM 0 HB1 ALA A 2 1.071 17.849 -6.278 1.00 23.01 H new ATOM 0 HB2 ALA A 2 -0.442 17.192 -5.609 1.00 23.01 H new ATOM 0 HB3 ALA A 2 0.060 18.852 -5.210 1.00 23.01 H new ATOM 28 N HIS A 3 3.529 17.501 -3.650 1.00 22.23 N ATOM 29 CA HIS A 3 4.786 18.193 -3.388 1.00 63.14 C ATOM 30 C HIS A 3 5.681 18.180 -4.624 1.00 72.43 C ATOM 31 O HIS A 3 6.018 19.231 -5.170 1.00 64.43 O ATOM 32 CB HIS A 3 5.514 17.545 -2.211 1.00 24.15 C ATOM 33 CG HIS A 3 5.025 18.011 -0.874 1.00 43.40 C ATOM 34 ND1 HIS A 3 3.730 17.826 -0.440 1.00 73.30 N ATOM 35 CD2 HIS A 3 5.667 18.658 0.127 1.00 31.13 C ATOM 36 CE1 HIS A 3 3.595 18.339 0.770 1.00 40.34 C ATOM 37 NE2 HIS A 3 4.756 18.850 1.137 1.00 3.20 N ATOM 0 H HIS A 3 3.585 16.485 -3.581 1.00 22.23 H new ATOM 0 HA HIS A 3 4.556 19.229 -3.138 1.00 63.14 H new ATOM 0 HB2 HIS A 3 5.398 16.463 -2.274 1.00 24.15 H new ATOM 0 HB3 HIS A 3 6.580 17.757 -2.293 1.00 24.15 H new ATOM 0 HD1 HIS A 3 2.991 17.365 -0.970 1.00 73.30 H new ATOM 0 HD2 HIS A 3 6.702 18.966 0.131 1.00 31.13 H new ATOM 0 HE1 HIS A 3 2.689 18.340 1.359 1.00 40.34 H new ATOM 45 N HIS A 4 6.062 16.983 -5.060 1.00 42.11 N ATOM 46 CA HIS A 4 6.918 16.833 -6.232 1.00 1.33 C ATOM 47 C HIS A 4 6.388 15.741 -7.155 1.00 64.43 C ATOM 48 O HIS A 4 5.732 14.799 -6.708 1.00 1.50 O ATOM 49 CB HIS A 4 8.350 16.507 -5.805 1.00 53.22 C ATOM 50 CG HIS A 4 9.387 16.990 -6.771 1.00 43.52 C ATOM 51 ND1 HIS A 4 9.830 18.296 -6.809 1.00 61.24 N ATOM 52 CD2 HIS A 4 10.071 16.334 -7.737 1.00 44.24 C ATOM 53 CE1 HIS A 4 10.740 18.422 -7.758 1.00 64.04 C ATOM 54 NE2 HIS A 4 10.906 17.246 -8.336 1.00 74.24 N ATOM 0 H HIS A 4 5.792 16.104 -4.620 1.00 42.11 H new ATOM 0 HA HIS A 4 6.916 17.777 -6.777 1.00 1.33 H new ATOM 0 HB2 HIS A 4 8.540 16.952 -4.828 1.00 53.22 H new ATOM 0 HB3 HIS A 4 8.449 15.428 -5.688 1.00 53.22 H new ATOM 0 HD2 HIS A 4 9.978 15.288 -7.990 1.00 44.24 H new ATOM 0 HE1 HIS A 4 11.260 19.332 -8.017 1.00 64.04 H new ATOM 0 HE2 HIS A 4 11.549 17.047 -9.102 1.00 74.24 H new ATOM 62 N HIS A 5 6.677 15.872 -8.446 1.00 41.12 N ATOM 63 CA HIS A 5 6.229 14.896 -9.433 1.00 65.31 C ATOM 64 C HIS A 5 7.241 14.768 -10.568 1.00 72.22 C ATOM 65 O HIS A 5 7.242 15.567 -11.505 1.00 61.13 O ATOM 66 CB HIS A 5 4.864 15.295 -9.993 1.00 61.25 C ATOM 67 CG HIS A 5 3.715 14.620 -9.309 1.00 63.13 C ATOM 68 ND1 HIS A 5 3.072 15.155 -8.213 1.00 41.54 N ATOM 69 CD2 HIS A 5 3.094 13.447 -9.572 1.00 74.24 C ATOM 70 CE1 HIS A 5 2.106 14.340 -7.831 1.00 14.10 C ATOM 71 NE2 HIS A 5 2.097 13.296 -8.640 1.00 22.24 N ATOM 0 H HIS A 5 7.219 16.644 -8.833 1.00 41.12 H new ATOM 0 HA HIS A 5 6.141 13.929 -8.938 1.00 65.31 H new ATOM 0 HB2 HIS A 5 4.746 16.375 -9.904 1.00 61.25 H new ATOM 0 HB3 HIS A 5 4.833 15.058 -11.056 1.00 61.25 H new ATOM 0 HD2 HIS A 5 3.337 12.758 -10.367 1.00 74.24 H new ATOM 0 HE1 HIS A 5 1.437 14.500 -6.998 1.00 14.10 H new ATOM 0 HE2 HIS A 5 1.454 12.506 -8.582 1.00 22.24 H new ATOM 79 N HIS A 6 8.101 13.758 -10.477 1.00 52.23 N ATOM 80 CA HIS A 6 9.117 13.526 -11.497 1.00 65.20 C ATOM 81 C HIS A 6 9.604 12.080 -11.459 1.00 43.44 C ATOM 82 O HIS A 6 10.790 11.809 -11.651 1.00 60.41 O ATOM 83 CB HIS A 6 10.297 14.479 -11.298 1.00 74.31 C ATOM 84 CG HIS A 6 11.078 14.734 -12.550 1.00 10.30 C ATOM 85 ND1 HIS A 6 10.718 15.686 -13.481 1.00 2.14 N ATOM 86 CD2 HIS A 6 12.208 14.157 -13.022 1.00 34.11 C ATOM 87 CE1 HIS A 6 11.592 15.682 -14.472 1.00 33.04 C ATOM 88 NE2 HIS A 6 12.506 14.763 -14.217 1.00 50.24 N ATOM 0 H HIS A 6 8.114 13.088 -9.708 1.00 52.23 H new ATOM 0 HA HIS A 6 8.668 13.715 -12.472 1.00 65.20 H new ATOM 0 HB2 HIS A 6 9.926 15.428 -10.911 1.00 74.31 H new ATOM 0 HB3 HIS A 6 10.964 14.066 -10.541 1.00 74.31 H new ATOM 0 HD2 HIS A 6 12.770 13.367 -12.547 1.00 34.11 H new ATOM 0 HE1 HIS A 6 11.564 16.321 -15.342 1.00 33.04 H new ATOM 0 HE2 HIS A 6 13.304 14.540 -14.812 1.00 50.24 H new ATOM 96 N HIS A 7 8.682 11.156 -11.210 1.00 54.53 N ATOM 97 CA HIS A 7 9.017 9.738 -11.147 1.00 41.43 C ATOM 98 C HIS A 7 7.866 8.884 -11.669 1.00 34.15 C ATOM 99 O HIS A 7 6.903 9.401 -12.236 1.00 34.01 O ATOM 100 CB HIS A 7 9.357 9.336 -9.712 1.00 12.32 C ATOM 101 CG HIS A 7 10.414 10.192 -9.084 1.00 71.13 C ATOM 102 ND1 HIS A 7 10.336 11.412 -8.503 1.00 15.52 N flip ATOM 103 CD2 HIS A 7 11.739 9.816 -9.008 1.00 60.05 C flip ATOM 104 CE1 HIS A 7 11.602 11.748 -8.090 1.00 64.24 C flip ATOM 105 NE2 HIS A 7 12.429 10.768 -8.405 1.00 33.53 N flip ATOM 0 H HIS A 7 7.697 11.364 -11.048 1.00 54.53 H new ATOM 0 HA HIS A 7 9.888 9.567 -11.780 1.00 41.43 H new ATOM 0 HB2 HIS A 7 8.453 9.386 -9.105 1.00 12.32 H new ATOM 0 HB3 HIS A 7 9.689 8.298 -9.703 1.00 12.32 H new ATOM 0 HD2 HIS A 7 12.148 8.889 -9.382 1.00 60.05 H new ATOM 0 HE1 HIS A 7 11.876 12.665 -7.589 1.00 64.24 H new ATOM 0 HE2 HIS A 7 13.431 10.749 -8.215 1.00 33.53 H new ATOM 113 N HIS A 8 7.972 7.573 -11.473 1.00 52.41 N ATOM 114 CA HIS A 8 6.939 6.647 -11.924 1.00 1.12 C ATOM 115 C HIS A 8 6.814 6.671 -13.444 1.00 60.32 C ATOM 116 O HIS A 8 6.277 7.618 -14.018 1.00 32.34 O ATOM 117 CB HIS A 8 5.595 6.998 -11.284 1.00 63.13 C ATOM 118 CG HIS A 8 5.715 7.516 -9.884 1.00 63.40 C ATOM 119 ND1 HIS A 8 5.130 8.691 -9.464 1.00 3.34 N ATOM 120 CD2 HIS A 8 6.357 7.009 -8.805 1.00 14.31 C ATOM 121 CE1 HIS A 8 5.408 8.887 -8.187 1.00 20.20 C ATOM 122 NE2 HIS A 8 6.151 7.880 -7.763 1.00 74.02 N ATOM 0 H HIS A 8 8.762 7.129 -11.005 1.00 52.41 H new ATOM 0 HA HIS A 8 7.228 5.642 -11.617 1.00 1.12 H new ATOM 0 HB2 HIS A 8 5.094 7.747 -11.898 1.00 63.13 H new ATOM 0 HB3 HIS A 8 4.961 6.112 -11.281 1.00 63.13 H new ATOM 0 HD1 HIS A 8 4.570 9.312 -10.048 1.00 3.34 H new ATOM 0 HD2 HIS A 8 6.925 6.091 -8.770 1.00 14.31 H new ATOM 0 HE1 HIS A 8 5.083 9.727 -7.591 1.00 20.20 H new ATOM 130 N ALA A 9 7.314 5.623 -14.091 1.00 24.14 N ATOM 131 CA ALA A 9 7.257 5.523 -15.544 1.00 5.33 C ATOM 132 C ALA A 9 7.726 4.152 -16.019 1.00 33.03 C ATOM 133 O ALA A 9 7.077 3.518 -16.850 1.00 53.02 O ATOM 134 CB ALA A 9 8.098 6.620 -16.181 1.00 74.02 C ATOM 0 H ALA A 9 7.763 4.831 -13.631 1.00 24.14 H new ATOM 0 HA ALA A 9 6.219 5.650 -15.852 1.00 5.33 H new ATOM 0 HB1 ALA A 9 8.047 6.534 -17.266 1.00 74.02 H new ATOM 0 HB2 ALA A 9 7.717 7.594 -15.876 1.00 74.02 H new ATOM 0 HB3 ALA A 9 9.134 6.518 -15.858 1.00 74.02 H new ATOM 140 N MET A 10 8.856 3.700 -15.486 1.00 3.52 N ATOM 141 CA MET A 10 9.411 2.403 -15.856 1.00 14.41 C ATOM 142 C MET A 10 8.703 1.277 -15.110 1.00 32.21 C ATOM 143 O MET A 10 8.356 0.252 -15.697 1.00 61.21 O ATOM 144 CB MET A 10 10.911 2.363 -15.560 1.00 21.10 C ATOM 145 CG MET A 10 11.728 3.305 -16.430 1.00 73.51 C ATOM 146 SD MET A 10 12.223 4.803 -15.557 1.00 72.34 S ATOM 147 CE MET A 10 11.447 6.058 -16.572 1.00 75.13 C ATOM 0 H MET A 10 9.406 4.213 -14.796 1.00 3.52 H new ATOM 0 HA MET A 10 9.256 2.260 -16.925 1.00 14.41 H new ATOM 0 HB2 MET A 10 11.073 2.617 -14.512 1.00 21.10 H new ATOM 0 HB3 MET A 10 11.274 1.345 -15.701 1.00 21.10 H new ATOM 0 HG2 MET A 10 12.618 2.785 -16.785 1.00 73.51 H new ATOM 0 HG3 MET A 10 11.145 3.578 -17.310 1.00 73.51 H new ATOM 0 HE1 MET A 10 11.140 6.895 -15.945 1.00 75.13 H new ATOM 0 HE2 MET A 10 12.155 6.408 -17.323 1.00 75.13 H new ATOM 0 HE3 MET A 10 10.572 5.636 -17.067 1.00 75.13 H new ATOM 157 N VAL A 11 8.491 1.473 -13.812 1.00 45.43 N ATOM 158 CA VAL A 11 7.824 0.474 -12.986 1.00 44.23 C ATOM 159 C VAL A 11 6.316 0.697 -12.964 1.00 44.24 C ATOM 160 O VAL A 11 5.550 -0.206 -12.628 1.00 61.23 O ATOM 161 CB VAL A 11 8.356 0.495 -11.541 1.00 64.30 C ATOM 162 CG1 VAL A 11 9.797 0.009 -11.495 1.00 42.43 C ATOM 163 CG2 VAL A 11 8.236 1.891 -10.949 1.00 43.04 C ATOM 0 H VAL A 11 8.772 2.315 -13.310 1.00 45.43 H new ATOM 0 HA VAL A 11 8.038 -0.498 -13.430 1.00 44.23 H new ATOM 0 HB VAL A 11 7.750 -0.183 -10.940 1.00 64.30 H new ATOM 0 HG11 VAL A 11 10.156 0.031 -10.466 1.00 42.43 H new ATOM 0 HG12 VAL A 11 9.849 -1.011 -11.876 1.00 42.43 H new ATOM 0 HG13 VAL A 11 10.420 0.658 -12.110 1.00 42.43 H new ATOM 0 HG21 VAL A 11 8.617 1.887 -9.928 1.00 43.04 H new ATOM 0 HG22 VAL A 11 8.816 2.592 -11.550 1.00 43.04 H new ATOM 0 HG23 VAL A 11 7.189 2.196 -10.945 1.00 43.04 H new ATOM 173 N ILE A 12 5.897 1.905 -13.325 1.00 43.41 N ATOM 174 CA ILE A 12 4.480 2.246 -13.349 1.00 3.44 C ATOM 175 C ILE A 12 3.828 1.795 -14.651 1.00 12.31 C ATOM 176 O ILE A 12 2.633 1.501 -14.689 1.00 70.10 O ATOM 177 CB ILE A 12 4.263 3.761 -13.176 1.00 40.45 C ATOM 178 CG1 ILE A 12 2.909 4.033 -12.519 1.00 35.13 C ATOM 179 CG2 ILE A 12 4.355 4.466 -14.522 1.00 24.13 C ATOM 180 CD1 ILE A 12 3.012 4.419 -11.060 1.00 11.32 C ATOM 0 H ILE A 12 6.518 2.664 -13.605 1.00 43.41 H new ATOM 0 HA ILE A 12 4.015 1.723 -12.513 1.00 3.44 H new ATOM 0 HB ILE A 12 5.046 4.153 -12.527 1.00 40.45 H new ATOM 0 HG12 ILE A 12 2.404 4.831 -13.063 1.00 35.13 H new ATOM 0 HG13 ILE A 12 2.286 3.143 -12.608 1.00 35.13 H new ATOM 0 HG21 ILE A 12 4.200 5.536 -14.384 1.00 24.13 H new ATOM 0 HG22 ILE A 12 5.340 4.296 -14.955 1.00 24.13 H new ATOM 0 HG23 ILE A 12 3.591 4.072 -15.192 1.00 24.13 H new ATOM 0 HD11 ILE A 12 2.014 4.597 -10.659 1.00 11.32 H new ATOM 0 HD12 ILE A 12 3.488 3.612 -10.503 1.00 11.32 H new ATOM 0 HD13 ILE A 12 3.608 5.327 -10.965 1.00 11.32 H new ATOM 192 N ASP A 13 4.620 1.742 -15.716 1.00 24.34 N ATOM 193 CA ASP A 13 4.121 1.323 -17.020 1.00 50.12 C ATOM 194 C ASP A 13 3.397 -0.016 -16.921 1.00 12.22 C ATOM 195 O ASP A 13 2.471 -0.291 -17.685 1.00 21.10 O ATOM 196 CB ASP A 13 5.272 1.221 -18.022 1.00 42.20 C ATOM 197 CG ASP A 13 4.905 0.403 -19.244 1.00 63.23 C ATOM 198 OD1 ASP A 13 4.009 0.834 -20.000 1.00 64.24 O ATOM 199 OD2 ASP A 13 5.515 -0.668 -19.445 1.00 73.33 O ATOM 0 H ASP A 13 5.611 1.984 -15.702 1.00 24.34 H new ATOM 0 HA ASP A 13 3.412 2.074 -17.368 1.00 50.12 H new ATOM 0 HB2 ASP A 13 5.568 2.223 -18.334 1.00 42.20 H new ATOM 0 HB3 ASP A 13 6.136 0.771 -17.533 1.00 42.20 H new ATOM 204 N HIS A 14 3.825 -0.846 -15.975 1.00 0.21 N ATOM 205 CA HIS A 14 3.218 -2.157 -15.776 1.00 14.11 C ATOM 206 C HIS A 14 1.855 -2.028 -15.102 1.00 53.44 C ATOM 207 O HIS A 14 0.932 -2.788 -15.396 1.00 61.50 O ATOM 208 CB HIS A 14 4.134 -3.044 -14.933 1.00 31.21 C ATOM 209 CG HIS A 14 5.443 -3.351 -15.592 1.00 43.43 C ATOM 210 ND1 HIS A 14 6.556 -3.771 -14.896 1.00 25.42 N ATOM 211 CD2 HIS A 14 5.813 -3.297 -16.893 1.00 44.22 C ATOM 212 CE1 HIS A 14 7.555 -3.962 -15.739 1.00 41.54 C ATOM 213 NE2 HIS A 14 7.130 -3.681 -16.958 1.00 42.11 N ATOM 0 H HIS A 14 4.590 -0.634 -15.334 1.00 0.21 H new ATOM 0 HA HIS A 14 3.078 -2.617 -16.754 1.00 14.11 H new ATOM 0 HB2 HIS A 14 4.324 -2.553 -13.979 1.00 31.21 H new ATOM 0 HB3 HIS A 14 3.619 -3.979 -14.714 1.00 31.21 H new ATOM 0 HD2 HIS A 14 5.189 -3.006 -17.725 1.00 44.22 H new ATOM 0 HE1 HIS A 14 8.549 -4.292 -15.477 1.00 41.54 H new ATOM 0 HE2 HIS A 14 7.689 -3.740 -17.809 1.00 42.11 H new ATOM 221 N ILE A 15 1.736 -1.061 -14.199 1.00 1.15 N ATOM 222 CA ILE A 15 0.486 -0.833 -13.484 1.00 42.22 C ATOM 223 C ILE A 15 -0.636 -0.459 -14.446 1.00 74.02 C ATOM 224 O ILE A 15 -1.814 -0.671 -14.155 1.00 74.15 O ATOM 225 CB ILE A 15 0.635 0.280 -12.430 1.00 23.11 C ATOM 226 CG1 ILE A 15 1.755 -0.066 -11.446 1.00 70.22 C ATOM 227 CG2 ILE A 15 -0.679 0.490 -11.692 1.00 43.35 C ATOM 228 CD1 ILE A 15 2.035 1.028 -10.440 1.00 44.34 C ATOM 0 H ILE A 15 2.490 -0.423 -13.945 1.00 1.15 H new ATOM 0 HA ILE A 15 0.235 -1.767 -12.981 1.00 42.22 H new ATOM 0 HB ILE A 15 0.897 1.208 -12.938 1.00 23.11 H new ATOM 0 HG12 ILE A 15 1.490 -0.979 -10.913 1.00 70.22 H new ATOM 0 HG13 ILE A 15 2.667 -0.276 -12.005 1.00 70.22 H new ATOM 0 HG21 ILE A 15 -0.558 1.280 -10.950 1.00 43.35 H new ATOM 0 HG22 ILE A 15 -1.454 0.776 -12.403 1.00 43.35 H new ATOM 0 HG23 ILE A 15 -0.968 -0.435 -11.193 1.00 43.35 H new ATOM 0 HD11 ILE A 15 2.840 0.714 -9.775 1.00 44.34 H new ATOM 0 HD12 ILE A 15 2.331 1.937 -10.964 1.00 44.34 H new ATOM 0 HD13 ILE A 15 1.136 1.223 -9.855 1.00 44.34 H new ATOM 240 N LEU A 16 -0.264 0.097 -15.594 1.00 21.32 N ATOM 241 CA LEU A 16 -1.239 0.499 -16.601 1.00 73.23 C ATOM 242 C LEU A 16 -2.110 -0.682 -17.018 1.00 61.33 C ATOM 243 O LEU A 16 -3.282 -0.515 -17.355 1.00 73.22 O ATOM 244 CB LEU A 16 -0.528 1.080 -17.825 1.00 32.23 C ATOM 245 CG LEU A 16 -1.377 1.225 -19.088 1.00 50.13 C ATOM 246 CD1 LEU A 16 -0.948 2.450 -19.881 1.00 75.03 C ATOM 247 CD2 LEU A 16 -1.277 -0.029 -19.945 1.00 13.32 C ATOM 0 H LEU A 16 0.706 0.280 -15.850 1.00 21.32 H new ATOM 0 HA LEU A 16 -1.881 1.264 -16.164 1.00 73.23 H new ATOM 0 HB2 LEU A 16 -0.136 2.062 -17.560 1.00 32.23 H new ATOM 0 HB3 LEU A 16 0.328 0.447 -18.058 1.00 32.23 H new ATOM 0 HG LEU A 16 -2.417 1.356 -18.791 1.00 50.13 H new ATOM 0 HD11 LEU A 16 -1.563 2.537 -20.777 1.00 75.03 H new ATOM 0 HD12 LEU A 16 -1.072 3.342 -19.267 1.00 75.03 H new ATOM 0 HD13 LEU A 16 0.099 2.349 -20.168 1.00 75.03 H new ATOM 0 HD21 LEU A 16 -1.888 0.092 -20.840 1.00 13.32 H new ATOM 0 HD22 LEU A 16 -0.238 -0.191 -20.234 1.00 13.32 H new ATOM 0 HD23 LEU A 16 -1.633 -0.888 -19.376 1.00 13.32 H new ATOM 259 N LYS A 17 -1.529 -1.877 -16.991 1.00 74.13 N ATOM 260 CA LYS A 17 -2.252 -3.088 -17.363 1.00 1.12 C ATOM 261 C LYS A 17 -3.361 -3.389 -16.360 1.00 55.42 C ATOM 262 O LYS A 17 -4.291 -4.140 -16.656 1.00 73.11 O ATOM 263 CB LYS A 17 -1.290 -4.275 -17.446 1.00 60.24 C ATOM 264 CG LYS A 17 -0.617 -4.419 -18.801 1.00 14.14 C ATOM 265 CD LYS A 17 0.862 -4.733 -18.658 1.00 24.12 C ATOM 266 CE LYS A 17 1.084 -6.126 -18.089 1.00 30.14 C ATOM 267 NZ LYS A 17 1.701 -7.042 -19.088 1.00 3.33 N ATOM 0 H LYS A 17 -0.559 -2.033 -16.715 1.00 74.13 H new ATOM 0 HA LYS A 17 -2.705 -2.925 -18.341 1.00 1.12 H new ATOM 0 HB2 LYS A 17 -0.524 -4.165 -16.679 1.00 60.24 H new ATOM 0 HB3 LYS A 17 -1.836 -5.191 -17.222 1.00 60.24 H new ATOM 0 HG2 LYS A 17 -1.105 -5.212 -19.368 1.00 14.14 H new ATOM 0 HG3 LYS A 17 -0.741 -3.497 -19.370 1.00 14.14 H new ATOM 0 HD2 LYS A 17 1.347 -4.655 -19.631 1.00 24.12 H new ATOM 0 HD3 LYS A 17 1.331 -3.994 -18.008 1.00 24.12 H new ATOM 0 HE2 LYS A 17 1.726 -6.061 -17.211 1.00 30.14 H new ATOM 0 HE3 LYS A 17 0.131 -6.539 -17.758 1.00 30.14 H new ATOM 0 HZ1 LYS A 17 1.836 -7.981 -18.661 1.00 3.33 H new ATOM 0 HZ2 LYS A 17 1.077 -7.124 -19.916 1.00 3.33 H new ATOM 0 HZ3 LYS A 17 2.622 -6.661 -19.386 1.00 3.33 H new ATOM 281 N CYS A 18 -3.258 -2.797 -15.175 1.00 52.15 N ATOM 282 CA CYS A 18 -4.254 -3.001 -14.129 1.00 62.43 C ATOM 283 C CYS A 18 -5.516 -2.195 -14.415 1.00 12.41 C ATOM 284 O CYS A 18 -6.632 -2.675 -14.213 1.00 44.21 O ATOM 285 CB CYS A 18 -3.680 -2.609 -12.767 1.00 14.11 C ATOM 286 SG CYS A 18 -4.203 -3.682 -11.409 1.00 60.30 S ATOM 0 H CYS A 18 -2.495 -2.172 -14.915 1.00 52.15 H new ATOM 0 HA CYS A 18 -4.517 -4.059 -14.113 1.00 62.43 H new ATOM 0 HB2 CYS A 18 -2.592 -2.621 -12.826 1.00 14.11 H new ATOM 0 HB3 CYS A 18 -3.976 -1.585 -12.541 1.00 14.11 H new ATOM 0 HG CYS A 18 -3.664 -3.271 -10.299 1.00 60.30 H new ATOM 292 N VAL A 19 -5.333 -0.965 -14.885 1.00 4.45 N ATOM 293 CA VAL A 19 -6.456 -0.090 -15.197 1.00 74.04 C ATOM 294 C VAL A 19 -6.932 -0.298 -16.631 1.00 11.02 C ATOM 295 O VAL A 19 -8.102 -0.081 -16.946 1.00 34.14 O ATOM 296 CB VAL A 19 -6.086 1.392 -15.001 1.00 41.00 C ATOM 297 CG1 VAL A 19 -5.991 2.101 -16.343 1.00 52.32 C ATOM 298 CG2 VAL A 19 -7.098 2.078 -14.096 1.00 50.42 C ATOM 0 H VAL A 19 -4.416 -0.552 -15.058 1.00 4.45 H new ATOM 0 HA VAL A 19 -7.260 -0.350 -14.508 1.00 74.04 H new ATOM 0 HB VAL A 19 -5.109 1.444 -14.520 1.00 41.00 H new ATOM 0 HG11 VAL A 19 -5.729 3.147 -16.184 1.00 52.32 H new ATOM 0 HG12 VAL A 19 -5.225 1.623 -16.953 1.00 52.32 H new ATOM 0 HG13 VAL A 19 -6.952 2.042 -16.855 1.00 52.32 H new ATOM 0 HG21 VAL A 19 -6.821 3.125 -13.968 1.00 50.42 H new ATOM 0 HG22 VAL A 19 -8.089 2.017 -14.546 1.00 50.42 H new ATOM 0 HG23 VAL A 19 -7.110 1.585 -13.124 1.00 50.42 H new ATOM 308 N PHE A 20 -6.017 -0.720 -17.497 1.00 22.42 N ATOM 309 CA PHE A 20 -6.342 -0.958 -18.898 1.00 53.33 C ATOM 310 C PHE A 20 -7.009 -2.318 -19.079 1.00 63.41 C ATOM 311 O PHE A 20 -7.664 -2.571 -20.090 1.00 72.20 O ATOM 312 CB PHE A 20 -5.079 -0.878 -19.758 1.00 0.32 C ATOM 313 CG PHE A 20 -5.346 -0.473 -21.179 1.00 42.14 C ATOM 314 CD1 PHE A 20 -5.861 -1.384 -22.088 1.00 2.51 C ATOM 315 CD2 PHE A 20 -5.081 0.818 -21.607 1.00 51.14 C ATOM 316 CE1 PHE A 20 -6.108 -1.014 -23.397 1.00 21.32 C ATOM 317 CE2 PHE A 20 -5.327 1.193 -22.915 1.00 5.12 C ATOM 318 CZ PHE A 20 -5.839 0.276 -23.811 1.00 33.41 C ATOM 0 H PHE A 20 -5.044 -0.904 -17.253 1.00 22.42 H new ATOM 0 HA PHE A 20 -7.041 -0.185 -19.219 1.00 53.33 H new ATOM 0 HB2 PHE A 20 -4.388 -0.164 -19.309 1.00 0.32 H new ATOM 0 HB3 PHE A 20 -4.583 -1.849 -19.752 1.00 0.32 H new ATOM 0 HD1 PHE A 20 -6.072 -2.394 -21.770 1.00 2.51 H new ATOM 0 HD2 PHE A 20 -4.678 1.539 -20.911 1.00 51.14 H new ATOM 0 HE1 PHE A 20 -6.511 -1.733 -24.095 1.00 21.32 H new ATOM 0 HE2 PHE A 20 -5.119 2.203 -23.236 1.00 5.12 H new ATOM 0 HZ PHE A 20 -6.029 0.567 -24.834 1.00 33.41 H new ATOM 328 N ASP A 21 -6.835 -3.191 -18.092 1.00 54.24 N ATOM 329 CA ASP A 21 -7.420 -4.526 -18.141 1.00 64.10 C ATOM 330 C ASP A 21 -8.942 -4.456 -18.065 1.00 64.44 C ATOM 331 O ASP A 21 -9.642 -4.981 -18.931 1.00 60.43 O ATOM 332 CB ASP A 21 -6.878 -5.385 -16.997 1.00 15.22 C ATOM 333 CG ASP A 21 -7.723 -6.619 -16.750 1.00 60.41 C ATOM 334 OD1 ASP A 21 -8.731 -6.512 -16.021 1.00 71.22 O ATOM 335 OD2 ASP A 21 -7.375 -7.693 -17.285 1.00 73.21 O ATOM 0 H ASP A 21 -6.294 -2.998 -17.249 1.00 54.24 H new ATOM 0 HA ASP A 21 -7.143 -4.983 -19.091 1.00 64.10 H new ATOM 0 HB2 ASP A 21 -5.856 -5.688 -17.226 1.00 15.22 H new ATOM 0 HB3 ASP A 21 -6.837 -4.788 -16.086 1.00 15.22 H new ATOM 340 N LYS A 22 -9.448 -3.806 -17.023 1.00 41.55 N ATOM 341 CA LYS A 22 -10.887 -3.666 -16.833 1.00 62.33 C ATOM 342 C LYS A 22 -11.539 -3.031 -18.058 1.00 25.45 C ATOM 343 O LYS A 22 -12.630 -3.429 -18.467 1.00 44.44 O ATOM 344 CB LYS A 22 -11.178 -2.821 -15.591 1.00 74.32 C ATOM 345 CG LYS A 22 -12.078 -3.514 -14.582 1.00 50.50 C ATOM 346 CD LYS A 22 -11.296 -3.980 -13.366 1.00 20.23 C ATOM 347 CE LYS A 22 -10.414 -5.175 -13.695 1.00 2.31 C ATOM 348 NZ LYS A 22 -9.513 -5.528 -12.563 1.00 11.23 N ATOM 0 H LYS A 22 -8.882 -3.367 -16.296 1.00 41.55 H new ATOM 0 HA LYS A 22 -11.309 -4.662 -16.695 1.00 62.33 H new ATOM 0 HB2 LYS A 22 -10.235 -2.563 -15.108 1.00 74.32 H new ATOM 0 HB3 LYS A 22 -11.645 -1.885 -15.899 1.00 74.32 H new ATOM 0 HG2 LYS A 22 -12.868 -2.831 -14.268 1.00 50.50 H new ATOM 0 HG3 LYS A 22 -12.564 -4.369 -15.053 1.00 50.50 H new ATOM 0 HD2 LYS A 22 -10.679 -3.162 -12.994 1.00 20.23 H new ATOM 0 HD3 LYS A 22 -11.988 -4.246 -12.567 1.00 20.23 H new ATOM 0 HE2 LYS A 22 -11.041 -6.032 -13.941 1.00 2.31 H new ATOM 0 HE3 LYS A 22 -9.816 -4.953 -14.579 1.00 2.31 H new ATOM 0 HZ1 LYS A 22 -8.929 -6.347 -12.827 1.00 11.23 H new ATOM 0 HZ2 LYS A 22 -8.897 -4.719 -12.344 1.00 11.23 H new ATOM 0 HZ3 LYS A 22 -10.083 -5.765 -11.726 1.00 11.23 H new ATOM 362 N ILE A 23 -10.863 -2.045 -18.637 1.00 63.13 N ATOM 363 CA ILE A 23 -11.376 -1.358 -19.816 1.00 64.10 C ATOM 364 C ILE A 23 -11.733 -2.350 -20.918 1.00 52.51 C ATOM 365 O ILE A 23 -12.689 -2.143 -21.667 1.00 10.12 O ATOM 366 CB ILE A 23 -10.355 -0.344 -20.365 1.00 11.40 C ATOM 367 CG1 ILE A 23 -10.163 0.806 -19.374 1.00 41.41 C ATOM 368 CG2 ILE A 23 -10.809 0.185 -21.717 1.00 51.42 C ATOM 369 CD1 ILE A 23 -8.929 1.638 -19.646 1.00 11.30 C ATOM 0 H ILE A 23 -9.959 -1.704 -18.309 1.00 63.13 H new ATOM 0 HA ILE A 23 -12.274 -0.825 -19.505 1.00 64.10 H new ATOM 0 HB ILE A 23 -9.398 -0.849 -20.497 1.00 11.40 H new ATOM 0 HG12 ILE A 23 -11.041 1.452 -19.405 1.00 41.41 H new ATOM 0 HG13 ILE A 23 -10.102 0.399 -18.365 1.00 41.41 H new ATOM 0 HG21 ILE A 23 -10.077 0.901 -22.092 1.00 51.42 H new ATOM 0 HG22 ILE A 23 -10.900 -0.643 -22.420 1.00 51.42 H new ATOM 0 HG23 ILE A 23 -11.776 0.677 -21.609 1.00 51.42 H new ATOM 0 HD11 ILE A 23 -8.857 2.434 -18.905 1.00 11.30 H new ATOM 0 HD12 ILE A 23 -8.043 1.005 -19.587 1.00 11.30 H new ATOM 0 HD13 ILE A 23 -8.997 2.075 -20.642 1.00 11.30 H new ATOM 381 N CYS A 24 -10.961 -3.426 -21.010 1.00 72.54 N ATOM 382 CA CYS A 24 -11.197 -4.452 -22.021 1.00 1.22 C ATOM 383 C CYS A 24 -12.313 -5.396 -21.587 1.00 31.32 C ATOM 384 O CYS A 24 -12.970 -6.023 -22.419 1.00 2.03 O ATOM 385 CB CYS A 24 -9.915 -5.244 -22.282 1.00 50.12 C ATOM 386 SG CYS A 24 -8.742 -4.409 -23.375 1.00 65.15 S ATOM 0 H CYS A 24 -10.167 -3.612 -20.398 1.00 72.54 H new ATOM 0 HA CYS A 24 -11.503 -3.956 -22.942 1.00 1.22 H new ATOM 0 HB2 CYS A 24 -9.426 -5.448 -21.329 1.00 50.12 H new ATOM 0 HB3 CYS A 24 -10.178 -6.208 -22.718 1.00 50.12 H new ATOM 0 HG CYS A 24 -7.690 -5.156 -23.534 1.00 65.15 H new ATOM 392 N LYS A 25 -12.522 -5.495 -20.278 1.00 71.04 N ATOM 393 CA LYS A 25 -13.558 -6.363 -19.732 1.00 32.31 C ATOM 394 C LYS A 25 -14.928 -5.697 -19.818 1.00 63.13 C ATOM 395 O LYS A 25 -15.851 -6.232 -20.434 1.00 25.05 O ATOM 396 CB LYS A 25 -13.242 -6.716 -18.277 1.00 23.12 C ATOM 397 CG LYS A 25 -13.883 -8.012 -17.812 1.00 14.23 C ATOM 398 CD LYS A 25 -12.998 -9.210 -18.109 1.00 31.52 C ATOM 399 CE LYS A 25 -12.294 -9.708 -16.856 1.00 1.44 C ATOM 400 NZ LYS A 25 -11.439 -10.895 -17.134 1.00 33.04 N ATOM 0 H LYS A 25 -11.987 -4.984 -19.576 1.00 71.04 H new ATOM 0 HA LYS A 25 -13.580 -7.277 -20.325 1.00 32.31 H new ATOM 0 HB2 LYS A 25 -12.161 -6.792 -18.157 1.00 23.12 H new ATOM 0 HB3 LYS A 25 -13.578 -5.903 -17.634 1.00 23.12 H new ATOM 0 HG2 LYS A 25 -14.077 -7.959 -16.741 1.00 14.23 H new ATOM 0 HG3 LYS A 25 -14.847 -8.139 -18.305 1.00 14.23 H new ATOM 0 HD2 LYS A 25 -13.601 -10.013 -18.532 1.00 31.52 H new ATOM 0 HD3 LYS A 25 -12.257 -8.938 -18.860 1.00 31.52 H new ATOM 0 HE2 LYS A 25 -11.681 -8.908 -16.442 1.00 1.44 H new ATOM 0 HE3 LYS A 25 -13.036 -9.964 -16.100 1.00 1.44 H new ATOM 0 HZ1 LYS A 25 -10.977 -11.204 -16.255 1.00 33.04 H new ATOM 0 HZ2 LYS A 25 -12.028 -11.668 -17.505 1.00 33.04 H new ATOM 0 HZ3 LYS A 25 -10.714 -10.644 -17.836 1.00 33.04 H new ATOM 414 N ILE A 26 -15.052 -4.528 -19.200 1.00 3.32 N ATOM 415 CA ILE A 26 -16.308 -3.788 -19.210 1.00 22.21 C ATOM 416 C ILE A 26 -16.831 -3.612 -20.632 1.00 24.04 C ATOM 417 O ILE A 26 -18.038 -3.531 -20.855 1.00 23.42 O ATOM 418 CB ILE A 26 -16.150 -2.402 -18.557 1.00 73.14 C ATOM 419 CG1 ILE A 26 -17.521 -1.759 -18.338 1.00 51.45 C ATOM 420 CG2 ILE A 26 -15.271 -1.508 -19.419 1.00 21.02 C ATOM 421 CD1 ILE A 26 -17.518 -0.674 -17.284 1.00 31.43 C ATOM 0 H ILE A 26 -14.298 -4.072 -18.686 1.00 3.32 H new ATOM 0 HA ILE A 26 -17.024 -4.373 -18.632 1.00 22.21 H new ATOM 0 HB ILE A 26 -15.668 -2.526 -17.587 1.00 73.14 H new ATOM 0 HG12 ILE A 26 -17.870 -1.338 -19.281 1.00 51.45 H new ATOM 0 HG13 ILE A 26 -18.234 -2.532 -18.050 1.00 51.45 H new ATOM 0 HG21 ILE A 26 -15.169 -0.532 -18.945 1.00 21.02 H new ATOM 0 HG22 ILE A 26 -14.287 -1.963 -19.529 1.00 21.02 H new ATOM 0 HG23 ILE A 26 -15.727 -1.388 -20.402 1.00 21.02 H new ATOM 0 HD11 ILE A 26 -18.522 -0.263 -17.182 1.00 31.43 H new ATOM 0 HD12 ILE A 26 -17.199 -1.094 -16.330 1.00 31.43 H new ATOM 0 HD13 ILE A 26 -16.830 0.118 -17.579 1.00 31.43 H new ATOM 433 N GLY A 27 -15.912 -3.555 -21.591 1.00 51.34 N ATOM 434 CA GLY A 27 -16.300 -3.390 -22.980 1.00 63.21 C ATOM 435 C GLY A 27 -17.194 -4.512 -23.469 1.00 61.23 C ATOM 436 O GLY A 27 -18.144 -4.279 -24.217 1.00 50.23 O ATOM 0 H GLY A 27 -14.907 -3.620 -21.431 1.00 51.34 H new ATOM 0 HA2 GLY A 27 -16.818 -2.439 -23.099 1.00 63.21 H new ATOM 0 HA3 GLY A 27 -15.405 -3.345 -23.601 1.00 63.21 H new ATOM 440 N THR A 28 -16.890 -5.736 -23.048 1.00 43.00 N ATOM 441 CA THR A 28 -17.671 -6.899 -23.450 1.00 3.10 C ATOM 442 C THR A 28 -18.792 -7.178 -22.456 1.00 72.30 C ATOM 443 O THR A 28 -19.817 -7.759 -22.811 1.00 13.01 O ATOM 444 CB THR A 28 -16.786 -8.154 -23.575 1.00 13.23 C ATOM 445 OG1 THR A 28 -16.014 -8.330 -22.382 1.00 11.53 O ATOM 446 CG2 THR A 28 -15.857 -8.044 -24.774 1.00 75.25 C ATOM 0 H THR A 28 -16.108 -5.947 -22.428 1.00 43.00 H new ATOM 0 HA THR A 28 -18.102 -6.669 -24.424 1.00 3.10 H new ATOM 0 HB THR A 28 -17.436 -9.017 -23.717 1.00 13.23 H new ATOM 0 HG1 THR A 28 -16.194 -7.591 -21.764 1.00 11.53 H new ATOM 0 HG21 THR A 28 -15.242 -8.942 -24.842 1.00 75.25 H new ATOM 0 HG22 THR A 28 -16.448 -7.940 -25.684 1.00 75.25 H new ATOM 0 HG23 THR A 28 -15.214 -7.172 -24.657 1.00 75.25 H new ATOM 454 N GLU A 29 -18.590 -6.760 -21.210 1.00 74.42 N ATOM 455 CA GLU A 29 -19.586 -6.967 -20.165 1.00 53.23 C ATOM 456 C GLU A 29 -20.776 -6.030 -20.355 1.00 72.41 C ATOM 457 O GLU A 29 -21.915 -6.388 -20.054 1.00 51.43 O ATOM 458 CB GLU A 29 -18.964 -6.745 -18.785 1.00 44.34 C ATOM 459 CG GLU A 29 -18.077 -7.890 -18.326 1.00 45.35 C ATOM 460 CD GLU A 29 -18.854 -8.983 -17.620 1.00 31.11 C ATOM 461 OE1 GLU A 29 -20.096 -9.006 -17.751 1.00 20.41 O ATOM 462 OE2 GLU A 29 -18.222 -9.815 -16.936 1.00 44.23 O ATOM 0 H GLU A 29 -17.747 -6.277 -20.900 1.00 74.42 H new ATOM 0 HA GLU A 29 -19.940 -7.996 -20.235 1.00 53.23 H new ATOM 0 HB2 GLU A 29 -18.377 -5.827 -18.804 1.00 44.34 H new ATOM 0 HB3 GLU A 29 -19.761 -6.599 -18.056 1.00 44.34 H new ATOM 0 HG2 GLU A 29 -17.563 -8.314 -19.188 1.00 45.35 H new ATOM 0 HG3 GLU A 29 -17.310 -7.504 -17.655 1.00 45.35 H new ATOM 469 N SER A 30 -20.503 -4.830 -20.856 1.00 1.33 N ATOM 470 CA SER A 30 -21.549 -3.840 -21.082 1.00 12.41 C ATOM 471 C SER A 30 -22.439 -4.247 -22.252 1.00 42.05 C ATOM 472 O SER A 30 -23.556 -3.751 -22.401 1.00 4.43 O ATOM 473 CB SER A 30 -20.931 -2.466 -21.350 1.00 54.11 C ATOM 474 OG SER A 30 -20.744 -1.747 -20.144 1.00 2.34 O ATOM 0 H SER A 30 -19.566 -4.520 -21.113 1.00 1.33 H new ATOM 0 HA SER A 30 -22.163 -3.785 -20.183 1.00 12.41 H new ATOM 0 HB2 SER A 30 -19.974 -2.587 -21.857 1.00 54.11 H new ATOM 0 HB3 SER A 30 -21.577 -1.898 -22.019 1.00 54.11 H new ATOM 0 HG SER A 30 -20.346 -0.873 -20.342 1.00 2.34 H new ATOM 480 N VAL A 31 -21.935 -5.155 -23.082 1.00 51.15 N ATOM 481 CA VAL A 31 -22.683 -5.631 -24.240 1.00 20.11 C ATOM 482 C VAL A 31 -23.998 -6.277 -23.817 1.00 44.10 C ATOM 483 O VAL A 31 -24.925 -6.400 -24.616 1.00 40.33 O ATOM 484 CB VAL A 31 -21.864 -6.647 -25.058 1.00 32.41 C ATOM 485 CG1 VAL A 31 -22.630 -7.073 -26.301 1.00 42.14 C ATOM 486 CG2 VAL A 31 -20.510 -6.064 -25.430 1.00 5.44 C ATOM 0 H VAL A 31 -21.012 -5.576 -22.974 1.00 51.15 H new ATOM 0 HA VAL A 31 -22.893 -4.760 -24.861 1.00 20.11 H new ATOM 0 HB VAL A 31 -21.696 -7.531 -24.443 1.00 32.41 H new ATOM 0 HG11 VAL A 31 -22.036 -7.791 -26.866 1.00 42.14 H new ATOM 0 HG12 VAL A 31 -23.573 -7.534 -26.007 1.00 42.14 H new ATOM 0 HG13 VAL A 31 -22.831 -6.200 -26.922 1.00 42.14 H new ATOM 0 HG21 VAL A 31 -19.945 -6.796 -26.008 1.00 5.44 H new ATOM 0 HG22 VAL A 31 -20.653 -5.163 -26.027 1.00 5.44 H new ATOM 0 HG23 VAL A 31 -19.960 -5.815 -24.523 1.00 5.44 H new ATOM 496 N GLU A 32 -24.070 -6.688 -22.555 1.00 2.43 N ATOM 497 CA GLU A 32 -25.272 -7.321 -22.026 1.00 22.51 C ATOM 498 C GLU A 32 -26.258 -6.276 -21.514 1.00 53.32 C ATOM 499 O GLU A 32 -27.414 -6.238 -21.936 1.00 22.53 O ATOM 500 CB GLU A 32 -24.910 -8.292 -20.899 1.00 51.42 C ATOM 501 CG GLU A 32 -24.585 -9.694 -21.385 1.00 23.23 C ATOM 502 CD GLU A 32 -23.106 -9.888 -21.660 1.00 12.11 C ATOM 503 OE1 GLU A 32 -22.324 -9.948 -20.688 1.00 72.53 O ATOM 504 OE2 GLU A 32 -22.731 -9.979 -22.848 1.00 35.32 O ATOM 0 H GLU A 32 -23.311 -6.594 -21.880 1.00 2.43 H new ATOM 0 HA GLU A 32 -25.746 -7.875 -22.836 1.00 22.51 H new ATOM 0 HB2 GLU A 32 -24.053 -7.898 -20.353 1.00 51.42 H new ATOM 0 HB3 GLU A 32 -25.740 -8.344 -20.195 1.00 51.42 H new ATOM 0 HG2 GLU A 32 -24.910 -10.418 -20.638 1.00 23.23 H new ATOM 0 HG3 GLU A 32 -25.150 -9.899 -22.294 1.00 23.23 H new ATOM 511 N ALA A 33 -25.793 -5.428 -20.602 1.00 60.14 N ATOM 512 CA ALA A 33 -26.633 -4.381 -20.034 1.00 44.10 C ATOM 513 C ALA A 33 -27.218 -3.493 -21.127 1.00 5.42 C ATOM 514 O ALA A 33 -28.240 -2.838 -20.927 1.00 42.02 O ATOM 515 CB ALA A 33 -25.836 -3.546 -19.042 1.00 40.15 C ATOM 0 H ALA A 33 -24.839 -5.446 -20.241 1.00 60.14 H new ATOM 0 HA ALA A 33 -27.461 -4.858 -19.509 1.00 44.10 H new ATOM 0 HB1 ALA A 33 -26.475 -2.768 -18.625 1.00 40.15 H new ATOM 0 HB2 ALA A 33 -25.472 -4.186 -18.238 1.00 40.15 H new ATOM 0 HB3 ALA A 33 -24.989 -3.086 -19.551 1.00 40.15 H new ATOM 521 N GLY A 34 -26.561 -3.474 -22.283 1.00 72.41 N ATOM 522 CA GLY A 34 -27.031 -2.662 -23.390 1.00 20.00 C ATOM 523 C GLY A 34 -28.238 -3.265 -24.080 1.00 53.02 C ATOM 524 O GLY A 34 -29.171 -2.551 -24.451 1.00 23.45 O ATOM 0 H GLY A 34 -25.712 -4.006 -22.472 1.00 72.41 H new ATOM 0 HA2 GLY A 34 -27.285 -1.667 -23.025 1.00 20.00 H new ATOM 0 HA3 GLY A 34 -26.226 -2.540 -24.114 1.00 20.00 H new ATOM 528 N ARG A 35 -28.221 -4.582 -24.255 1.00 73.32 N ATOM 529 CA ARG A 35 -29.322 -5.280 -24.909 1.00 21.54 C ATOM 530 C ARG A 35 -30.388 -5.685 -23.894 1.00 43.22 C ATOM 531 O ARG A 35 -31.537 -5.942 -24.254 1.00 53.25 O ATOM 532 CB ARG A 35 -28.804 -6.519 -25.642 1.00 34.42 C ATOM 533 CG ARG A 35 -27.641 -6.232 -26.576 1.00 63.24 C ATOM 534 CD ARG A 35 -27.822 -4.908 -27.301 1.00 50.32 C ATOM 535 NE ARG A 35 -29.120 -4.821 -27.966 1.00 5.31 N ATOM 536 CZ ARG A 35 -29.374 -3.997 -28.977 1.00 24.23 C ATOM 537 NH1 ARG A 35 -28.424 -3.195 -29.437 1.00 51.41 N ATOM 538 NH2 ARG A 35 -30.580 -3.976 -29.530 1.00 3.14 N ATOM 0 H ARG A 35 -27.457 -5.187 -23.953 1.00 73.32 H new ATOM 0 HA ARG A 35 -29.773 -4.600 -25.632 1.00 21.54 H new ATOM 0 HB2 ARG A 35 -28.494 -7.262 -24.907 1.00 34.42 H new ATOM 0 HB3 ARG A 35 -29.620 -6.959 -26.216 1.00 34.42 H new ATOM 0 HG2 ARG A 35 -26.712 -6.212 -26.006 1.00 63.24 H new ATOM 0 HG3 ARG A 35 -27.551 -7.038 -27.305 1.00 63.24 H new ATOM 0 HD2 ARG A 35 -27.724 -4.088 -26.589 1.00 50.32 H new ATOM 0 HD3 ARG A 35 -27.028 -4.787 -28.038 1.00 50.32 H new ATOM 0 HE ARG A 35 -29.872 -5.426 -27.636 1.00 5.31 H new ATOM 0 HH11 ARG A 35 -27.496 -3.210 -29.015 1.00 51.41 H new ATOM 0 HH12 ARG A 35 -28.621 -2.563 -30.213 1.00 51.41 H new ATOM 0 HH21 ARG A 35 -31.313 -4.593 -29.179 1.00 3.14 H new ATOM 0 HH22 ARG A 35 -30.774 -3.343 -30.306 1.00 3.14 H new ATOM 552 N LEU A 36 -29.999 -5.740 -22.625 1.00 43.52 N ATOM 553 CA LEU A 36 -30.920 -6.113 -21.558 1.00 33.11 C ATOM 554 C LEU A 36 -31.795 -4.930 -21.155 1.00 20.22 C ATOM 555 O LEU A 36 -32.982 -5.092 -20.871 1.00 72.01 O ATOM 556 CB LEU A 36 -30.144 -6.625 -20.343 1.00 73.53 C ATOM 557 CG LEU A 36 -30.070 -8.145 -20.186 1.00 51.33 C ATOM 558 CD1 LEU A 36 -31.463 -8.733 -20.021 1.00 42.12 C ATOM 559 CD2 LEU A 36 -29.363 -8.770 -21.380 1.00 21.34 C ATOM 0 H LEU A 36 -29.052 -5.531 -22.310 1.00 43.52 H new ATOM 0 HA LEU A 36 -31.565 -6.908 -21.931 1.00 33.11 H new ATOM 0 HB2 LEU A 36 -29.127 -6.235 -20.395 1.00 73.53 H new ATOM 0 HB3 LEU A 36 -30.599 -6.209 -19.444 1.00 73.53 H new ATOM 0 HG LEU A 36 -29.494 -8.371 -19.289 1.00 51.33 H new ATOM 0 HD11 LEU A 36 -31.390 -9.815 -19.911 1.00 42.12 H new ATOM 0 HD12 LEU A 36 -31.934 -8.309 -19.135 1.00 42.12 H new ATOM 0 HD13 LEU A 36 -32.064 -8.497 -20.899 1.00 42.12 H new ATOM 0 HD21 LEU A 36 -29.319 -9.852 -21.252 1.00 21.34 H new ATOM 0 HD22 LEU A 36 -29.912 -8.535 -22.292 1.00 21.34 H new ATOM 0 HD23 LEU A 36 -28.351 -8.372 -21.453 1.00 21.34 H new ATOM 571 N ILE A 37 -31.201 -3.742 -21.134 1.00 40.10 N ATOM 572 CA ILE A 37 -31.927 -2.532 -20.769 1.00 50.22 C ATOM 573 C ILE A 37 -32.876 -2.103 -21.883 1.00 70.23 C ATOM 574 O ILE A 37 -34.046 -1.814 -21.637 1.00 53.33 O ATOM 575 CB ILE A 37 -30.965 -1.371 -20.455 1.00 62.10 C ATOM 576 CG1 ILE A 37 -30.586 -1.381 -18.973 1.00 10.14 C ATOM 577 CG2 ILE A 37 -31.597 -0.041 -20.837 1.00 42.10 C ATOM 578 CD1 ILE A 37 -30.211 -2.751 -18.454 1.00 21.41 C ATOM 0 H ILE A 37 -30.219 -3.591 -21.365 1.00 40.10 H new ATOM 0 HA ILE A 37 -32.503 -2.768 -19.874 1.00 50.22 H new ATOM 0 HB ILE A 37 -30.057 -1.502 -21.044 1.00 62.10 H new ATOM 0 HG12 ILE A 37 -29.749 -0.700 -18.816 1.00 10.14 H new ATOM 0 HG13 ILE A 37 -31.423 -0.997 -18.390 1.00 10.14 H new ATOM 0 HG21 ILE A 37 -30.905 0.770 -20.609 1.00 42.10 H new ATOM 0 HG22 ILE A 37 -31.821 -0.038 -21.904 1.00 42.10 H new ATOM 0 HG23 ILE A 37 -32.519 0.099 -20.272 1.00 42.10 H new ATOM 0 HD11 ILE A 37 -29.954 -2.682 -17.397 1.00 21.41 H new ATOM 0 HD12 ILE A 37 -31.054 -3.431 -18.579 1.00 21.41 H new ATOM 0 HD13 ILE A 37 -29.354 -3.129 -19.012 1.00 21.41 H new ATOM 590 N GLU A 38 -32.363 -2.067 -23.109 1.00 61.01 N ATOM 591 CA GLU A 38 -33.166 -1.675 -24.261 1.00 41.33 C ATOM 592 C GLU A 38 -34.386 -2.579 -24.407 1.00 72.24 C ATOM 593 O GLU A 38 -35.525 -2.110 -24.399 1.00 33.54 O ATOM 594 CB GLU A 38 -32.324 -1.725 -25.538 1.00 54.13 C ATOM 595 CG GLU A 38 -31.157 -0.753 -25.536 1.00 43.34 C ATOM 596 CD GLU A 38 -31.545 0.627 -26.032 1.00 33.30 C ATOM 597 OE1 GLU A 38 -32.341 1.302 -25.346 1.00 5.00 O ATOM 598 OE2 GLU A 38 -31.053 1.031 -27.106 1.00 72.35 O ATOM 0 H GLU A 38 -31.396 -2.304 -23.330 1.00 61.01 H new ATOM 0 HA GLU A 38 -33.510 -0.653 -24.101 1.00 41.33 H new ATOM 0 HB2 GLU A 38 -31.943 -2.737 -25.672 1.00 54.13 H new ATOM 0 HB3 GLU A 38 -32.964 -1.510 -26.394 1.00 54.13 H new ATOM 0 HG2 GLU A 38 -30.758 -0.672 -24.525 1.00 43.34 H new ATOM 0 HG3 GLU A 38 -30.358 -1.149 -26.163 1.00 43.34 H new ATOM 605 N LEU A 39 -34.140 -3.878 -24.542 1.00 41.42 N ATOM 606 CA LEU A 39 -35.218 -4.849 -24.691 1.00 22.42 C ATOM 607 C LEU A 39 -36.261 -4.677 -23.592 1.00 34.32 C ATOM 608 O LEU A 39 -37.458 -4.849 -23.826 1.00 3.14 O ATOM 609 CB LEU A 39 -34.656 -6.272 -24.659 1.00 14.04 C ATOM 610 CG LEU A 39 -34.229 -6.855 -26.006 1.00 23.53 C ATOM 611 CD1 LEU A 39 -33.381 -5.855 -26.776 1.00 12.21 C ATOM 612 CD2 LEU A 39 -33.469 -8.158 -25.805 1.00 64.54 C ATOM 0 H LEU A 39 -33.204 -4.283 -24.551 1.00 41.42 H new ATOM 0 HA LEU A 39 -35.700 -4.676 -25.653 1.00 22.42 H new ATOM 0 HB2 LEU A 39 -33.795 -6.286 -23.990 1.00 14.04 H new ATOM 0 HB3 LEU A 39 -35.409 -6.929 -24.224 1.00 14.04 H new ATOM 0 HG LEU A 39 -35.125 -7.066 -26.590 1.00 23.53 H new ATOM 0 HD11 LEU A 39 -33.086 -6.288 -27.732 1.00 12.21 H new ATOM 0 HD12 LEU A 39 -33.958 -4.947 -26.951 1.00 12.21 H new ATOM 0 HD13 LEU A 39 -32.490 -5.612 -26.198 1.00 12.21 H new ATOM 0 HD21 LEU A 39 -33.172 -8.559 -26.774 1.00 64.54 H new ATOM 0 HD22 LEU A 39 -32.580 -7.972 -25.202 1.00 64.54 H new ATOM 0 HD23 LEU A 39 -34.109 -8.878 -25.295 1.00 64.54 H new ATOM 624 N SER A 40 -35.800 -4.335 -22.393 1.00 71.21 N ATOM 625 CA SER A 40 -36.694 -4.141 -21.257 1.00 65.10 C ATOM 626 C SER A 40 -37.772 -3.112 -21.583 1.00 64.14 C ATOM 627 O SER A 40 -38.925 -3.258 -21.180 1.00 11.30 O ATOM 628 CB SER A 40 -35.900 -3.693 -20.028 1.00 52.00 C ATOM 629 OG SER A 40 -36.502 -4.161 -18.834 1.00 33.42 O ATOM 0 H SER A 40 -34.813 -4.187 -22.183 1.00 71.21 H new ATOM 0 HA SER A 40 -37.179 -5.093 -21.041 1.00 65.10 H new ATOM 0 HB2 SER A 40 -34.878 -4.067 -20.095 1.00 52.00 H new ATOM 0 HB3 SER A 40 -35.840 -2.605 -20.007 1.00 52.00 H new ATOM 0 HG SER A 40 -35.975 -3.863 -18.063 1.00 33.42 H new ATOM 635 N GLN A 41 -37.386 -2.073 -22.316 1.00 51.45 N ATOM 636 CA GLN A 41 -38.319 -1.019 -22.697 1.00 11.43 C ATOM 637 C GLN A 41 -39.087 -1.401 -23.958 1.00 13.53 C ATOM 638 O GLN A 41 -40.285 -1.140 -24.068 1.00 43.25 O ATOM 639 CB GLN A 41 -37.572 0.297 -22.920 1.00 4.35 C ATOM 640 CG GLN A 41 -36.425 0.518 -21.946 1.00 51.10 C ATOM 641 CD GLN A 41 -36.888 0.582 -20.504 1.00 12.11 C ATOM 642 OE1 GLN A 41 -38.078 0.742 -20.228 1.00 45.22 O ATOM 643 NE2 GLN A 41 -35.949 0.457 -19.574 1.00 65.31 N ATOM 0 H GLN A 41 -36.434 -1.938 -22.658 1.00 51.45 H new ATOM 0 HA GLN A 41 -39.033 -0.890 -21.884 1.00 11.43 H new ATOM 0 HB2 GLN A 41 -37.182 0.316 -23.938 1.00 4.35 H new ATOM 0 HB3 GLN A 41 -38.276 1.124 -22.833 1.00 4.35 H new ATOM 0 HG2 GLN A 41 -35.700 -0.289 -22.055 1.00 51.10 H new ATOM 0 HG3 GLN A 41 -35.911 1.445 -22.200 1.00 51.10 H new ATOM 0 HE21 GLN A 41 -34.975 0.326 -19.847 1.00 65.31 H new ATOM 0 HE22 GLN A 41 -36.202 0.492 -18.586 1.00 65.31 H new ATOM 652 N GLU A 42 -38.390 -2.019 -24.905 1.00 63.13 N ATOM 653 CA GLU A 42 -39.007 -2.435 -26.159 1.00 33.41 C ATOM 654 C GLU A 42 -37.991 -3.128 -27.062 1.00 72.42 C ATOM 655 O GLU A 42 -38.328 -4.058 -27.794 1.00 64.04 O ATOM 656 CB GLU A 42 -39.609 -1.229 -26.882 1.00 14.21 C ATOM 657 CG GLU A 42 -39.951 -1.500 -28.337 1.00 50.45 C ATOM 658 CD GLU A 42 -41.297 -0.926 -28.737 1.00 45.14 C ATOM 659 OE1 GLU A 42 -41.685 0.122 -28.180 1.00 64.04 O ATOM 660 OE2 GLU A 42 -41.961 -1.526 -29.608 1.00 52.33 O ATOM 0 H GLU A 42 -37.398 -2.243 -24.828 1.00 63.13 H new ATOM 0 HA GLU A 42 -39.802 -3.143 -25.925 1.00 33.41 H new ATOM 0 HB2 GLU A 42 -40.512 -0.915 -26.358 1.00 14.21 H new ATOM 0 HB3 GLU A 42 -38.906 -0.398 -26.832 1.00 14.21 H new ATOM 0 HG2 GLU A 42 -39.175 -1.075 -28.974 1.00 50.45 H new ATOM 0 HG3 GLU A 42 -39.953 -2.576 -28.512 1.00 50.45 H new ATOM 667 N GLY A 43 -36.745 -2.668 -27.004 1.00 53.44 N ATOM 668 CA GLY A 43 -35.699 -3.253 -27.822 1.00 71.30 C ATOM 669 C GLY A 43 -35.705 -2.720 -29.241 1.00 10.11 C ATOM 670 O GLY A 43 -34.861 -3.092 -30.055 1.00 75.52 O ATOM 0 H GLY A 43 -36.441 -1.900 -26.405 1.00 53.44 H new ATOM 0 HA2 GLY A 43 -34.730 -3.051 -27.366 1.00 71.30 H new ATOM 0 HA3 GLY A 43 -35.822 -4.336 -27.844 1.00 71.30 H new ATOM 674 N GLY A 44 -36.661 -1.845 -29.539 1.00 30.02 N ATOM 675 CA GLY A 44 -36.757 -1.275 -30.870 1.00 64.31 C ATOM 676 C GLY A 44 -35.652 -0.276 -31.154 1.00 34.23 C ATOM 677 O GLY A 44 -34.976 0.189 -30.237 1.00 60.24 O ATOM 0 H GLY A 44 -37.371 -1.521 -28.882 1.00 30.02 H new ATOM 0 HA2 GLY A 44 -36.717 -2.076 -31.609 1.00 64.31 H new ATOM 0 HA3 GLY A 44 -37.724 -0.785 -30.983 1.00 64.31 H new ATOM 681 N GLY A 45 -35.468 0.054 -32.429 1.00 31.05 N ATOM 682 CA GLY A 45 -34.436 1.001 -32.808 1.00 23.33 C ATOM 683 C GLY A 45 -34.316 1.157 -34.311 1.00 23.43 C ATOM 684 O GLY A 45 -35.089 0.570 -35.066 1.00 70.24 O ATOM 0 H GLY A 45 -36.015 -0.318 -33.206 1.00 31.05 H new ATOM 0 HA2 GLY A 45 -34.655 1.971 -32.362 1.00 23.33 H new ATOM 0 HA3 GLY A 45 -33.479 0.673 -32.402 1.00 23.33 H new ATOM 688 N GLY A 46 -33.343 1.952 -34.746 1.00 53.11 N ATOM 689 CA GLY A 46 -33.144 2.171 -36.167 1.00 30.11 C ATOM 690 C GLY A 46 -31.968 1.387 -36.715 1.00 0.12 C ATOM 691 O GLY A 46 -32.148 0.414 -37.446 1.00 41.31 O ATOM 0 H GLY A 46 -32.689 2.448 -34.140 1.00 53.11 H new ATOM 0 HA2 GLY A 46 -34.048 1.887 -36.705 1.00 30.11 H new ATOM 0 HA3 GLY A 46 -32.985 3.234 -36.349 1.00 30.11 H new ATOM 695 N GLY A 47 -30.759 1.813 -36.362 1.00 23.22 N ATOM 696 CA GLY A 47 -29.566 1.134 -36.834 1.00 32.21 C ATOM 697 C GLY A 47 -29.496 -0.307 -36.368 1.00 15.12 C ATOM 698 O GLY A 47 -30.490 -0.866 -35.906 1.00 72.21 O ATOM 0 H GLY A 47 -30.584 2.616 -35.758 1.00 23.22 H new ATOM 0 HA2 GLY A 47 -29.543 1.162 -37.923 1.00 32.21 H new ATOM 0 HA3 GLY A 47 -28.684 1.669 -36.483 1.00 32.21 H new ATOM 702 N GLY A 48 -28.318 -0.911 -36.490 1.00 51.23 N ATOM 703 CA GLY A 48 -28.145 -2.291 -36.075 1.00 50.45 C ATOM 704 C GLY A 48 -27.610 -2.408 -34.662 1.00 64.43 C ATOM 705 O GLY A 48 -27.404 -1.412 -33.969 1.00 23.34 O ATOM 0 H GLY A 48 -27.480 -0.469 -36.869 1.00 51.23 H new ATOM 0 HA2 GLY A 48 -29.101 -2.810 -36.142 1.00 50.45 H new ATOM 0 HA3 GLY A 48 -27.462 -2.791 -36.762 1.00 50.45 H new ATOM 709 N PRO A 49 -27.377 -3.651 -34.215 1.00 70.31 N ATOM 710 CA PRO A 49 -26.860 -3.925 -32.871 1.00 34.31 C ATOM 711 C PRO A 49 -25.408 -3.490 -32.708 1.00 51.41 C ATOM 712 O PRO A 49 -24.878 -3.463 -31.597 1.00 30.15 O ATOM 713 CB PRO A 49 -26.979 -5.446 -32.748 1.00 73.43 C ATOM 714 CG PRO A 49 -26.936 -5.944 -34.152 1.00 23.12 C ATOM 715 CD PRO A 49 -27.600 -4.885 -34.987 1.00 60.15 C ATOM 0 HA PRO A 49 -27.408 -3.377 -32.105 1.00 34.31 H new ATOM 0 HB2 PRO A 49 -26.163 -5.860 -32.156 1.00 73.43 H new ATOM 0 HB3 PRO A 49 -27.908 -5.732 -32.255 1.00 73.43 H new ATOM 0 HG2 PRO A 49 -25.909 -6.109 -34.476 1.00 23.12 H new ATOM 0 HG3 PRO A 49 -27.457 -6.897 -34.244 1.00 23.12 H new ATOM 0 HD2 PRO A 49 -27.158 -4.822 -35.981 1.00 60.15 H new ATOM 0 HD3 PRO A 49 -28.662 -5.088 -35.122 1.00 60.15 H new ATOM 723 N LEU A 50 -24.769 -3.148 -33.822 1.00 35.32 N ATOM 724 CA LEU A 50 -23.377 -2.713 -33.803 1.00 13.15 C ATOM 725 C LEU A 50 -23.272 -1.242 -33.411 1.00 61.51 C ATOM 726 O LEU A 50 -22.226 -0.786 -32.948 1.00 71.14 O ATOM 727 CB LEU A 50 -22.734 -2.935 -35.172 1.00 61.24 C ATOM 728 CG LEU A 50 -22.854 -4.346 -35.749 1.00 70.15 C ATOM 729 CD1 LEU A 50 -22.832 -5.382 -34.636 1.00 54.21 C ATOM 730 CD2 LEU A 50 -24.124 -4.477 -36.578 1.00 21.22 C ATOM 0 H LEU A 50 -25.193 -3.164 -34.750 1.00 35.32 H new ATOM 0 HA LEU A 50 -22.846 -3.307 -33.059 1.00 13.15 H new ATOM 0 HB2 LEU A 50 -23.181 -2.236 -35.879 1.00 61.24 H new ATOM 0 HB3 LEU A 50 -21.676 -2.682 -35.100 1.00 61.24 H new ATOM 0 HG LEU A 50 -21.999 -4.525 -36.400 1.00 70.15 H new ATOM 0 HD11 LEU A 50 -22.918 -6.380 -35.066 1.00 54.21 H new ATOM 0 HD12 LEU A 50 -21.895 -5.304 -34.085 1.00 54.21 H new ATOM 0 HD13 LEU A 50 -23.667 -5.205 -33.958 1.00 54.21 H new ATOM 0 HD21 LEU A 50 -24.193 -5.487 -36.981 1.00 21.22 H new ATOM 0 HD22 LEU A 50 -24.991 -4.277 -35.949 1.00 21.22 H new ATOM 0 HD23 LEU A 50 -24.098 -3.760 -37.399 1.00 21.22 H new ATOM 742 N TYR A 51 -24.362 -0.507 -33.598 1.00 1.43 N ATOM 743 CA TYR A 51 -24.392 0.913 -33.264 1.00 73.52 C ATOM 744 C TYR A 51 -24.172 1.126 -31.770 1.00 21.33 C ATOM 745 O TYR A 51 -23.675 2.169 -31.346 1.00 43.41 O ATOM 746 CB TYR A 51 -25.727 1.529 -33.687 1.00 62.23 C ATOM 747 CG TYR A 51 -25.662 3.024 -33.902 1.00 12.12 C ATOM 748 CD1 TYR A 51 -25.647 3.901 -32.824 1.00 23.41 C ATOM 749 CD2 TYR A 51 -25.616 3.560 -35.183 1.00 2.41 C ATOM 750 CE1 TYR A 51 -25.589 5.267 -33.016 1.00 4.45 C ATOM 751 CE2 TYR A 51 -25.556 4.926 -35.384 1.00 30.11 C ATOM 752 CZ TYR A 51 -25.543 5.775 -34.297 1.00 52.22 C ATOM 753 OH TYR A 51 -25.484 7.136 -34.492 1.00 42.12 O ATOM 0 H TYR A 51 -25.236 -0.870 -33.979 1.00 1.43 H new ATOM 0 HA TYR A 51 -23.584 1.405 -33.805 1.00 73.52 H new ATOM 0 HB2 TYR A 51 -26.062 1.052 -34.608 1.00 62.23 H new ATOM 0 HB3 TYR A 51 -26.476 1.312 -32.925 1.00 62.23 H new ATOM 0 HD1 TYR A 51 -25.681 3.507 -31.819 1.00 23.41 H new ATOM 0 HD2 TYR A 51 -25.627 2.898 -36.036 1.00 2.41 H new ATOM 0 HE1 TYR A 51 -25.580 5.934 -32.167 1.00 4.45 H new ATOM 0 HE2 TYR A 51 -25.520 5.326 -36.386 1.00 30.11 H new ATOM 0 HH TYR A 51 -25.456 7.328 -35.453 1.00 42.12 H new ATOM 763 N PHE A 52 -24.545 0.128 -30.975 1.00 52.20 N ATOM 764 CA PHE A 52 -24.389 0.205 -29.527 1.00 74.32 C ATOM 765 C PHE A 52 -22.917 0.317 -29.144 1.00 3.32 C ATOM 766 O PHE A 52 -22.523 1.220 -28.405 1.00 31.33 O ATOM 767 CB PHE A 52 -25.009 -1.025 -28.860 1.00 70.25 C ATOM 768 CG PHE A 52 -24.425 -1.334 -27.512 1.00 23.23 C ATOM 769 CD1 PHE A 52 -24.929 -0.733 -26.370 1.00 4.14 C ATOM 770 CD2 PHE A 52 -23.372 -2.226 -27.386 1.00 31.21 C ATOM 771 CE1 PHE A 52 -24.392 -1.015 -25.127 1.00 52.05 C ATOM 772 CE2 PHE A 52 -22.832 -2.513 -26.146 1.00 42.53 C ATOM 773 CZ PHE A 52 -23.343 -1.907 -25.016 1.00 14.25 C ATOM 0 H PHE A 52 -24.957 -0.743 -31.309 1.00 52.20 H new ATOM 0 HA PHE A 52 -24.906 1.099 -29.178 1.00 74.32 H new ATOM 0 HB2 PHE A 52 -26.083 -0.869 -28.755 1.00 70.25 H new ATOM 0 HB3 PHE A 52 -24.875 -1.888 -29.512 1.00 70.25 H new ATOM 0 HD1 PHE A 52 -25.750 -0.037 -26.451 1.00 4.14 H new ATOM 0 HD2 PHE A 52 -22.968 -2.703 -28.267 1.00 31.21 H new ATOM 0 HE1 PHE A 52 -24.792 -0.538 -24.244 1.00 52.05 H new ATOM 0 HE2 PHE A 52 -22.012 -3.210 -26.062 1.00 42.53 H new ATOM 0 HZ PHE A 52 -22.923 -2.130 -24.046 1.00 14.25 H new ATOM 783 N VAL A 53 -22.107 -0.607 -29.652 1.00 1.53 N ATOM 784 CA VAL A 53 -20.678 -0.612 -29.364 1.00 4.20 C ATOM 785 C VAL A 53 -19.944 0.429 -30.203 1.00 33.40 C ATOM 786 O VAL A 53 -18.892 0.930 -29.808 1.00 45.35 O ATOM 787 CB VAL A 53 -20.057 -1.997 -29.627 1.00 34.04 C ATOM 788 CG1 VAL A 53 -19.402 -2.037 -30.999 1.00 20.33 C ATOM 789 CG2 VAL A 53 -19.055 -2.347 -28.537 1.00 42.43 C ATOM 0 H VAL A 53 -22.416 -1.361 -30.265 1.00 1.53 H new ATOM 0 HA VAL A 53 -20.568 -0.367 -28.308 1.00 4.20 H new ATOM 0 HB VAL A 53 -20.852 -2.742 -29.610 1.00 34.04 H new ATOM 0 HG11 VAL A 53 -18.969 -3.023 -31.167 1.00 20.33 H new ATOM 0 HG12 VAL A 53 -20.150 -1.834 -31.765 1.00 20.33 H new ATOM 0 HG13 VAL A 53 -18.617 -1.283 -31.050 1.00 20.33 H new ATOM 0 HG21 VAL A 53 -18.626 -3.329 -28.739 1.00 42.43 H new ATOM 0 HG22 VAL A 53 -18.261 -1.601 -28.520 1.00 42.43 H new ATOM 0 HG23 VAL A 53 -19.559 -2.363 -27.571 1.00 42.43 H new ATOM 799 N VAL A 54 -20.508 0.749 -31.363 1.00 41.43 N ATOM 800 CA VAL A 54 -19.909 1.732 -32.258 1.00 41.05 C ATOM 801 C VAL A 54 -20.035 3.141 -31.691 1.00 54.41 C ATOM 802 O VAL A 54 -19.176 3.992 -31.917 1.00 62.14 O ATOM 803 CB VAL A 54 -20.561 1.692 -33.653 1.00 62.44 C ATOM 804 CG1 VAL A 54 -20.355 3.013 -34.377 1.00 55.45 C ATOM 805 CG2 VAL A 54 -20.002 0.535 -34.469 1.00 13.13 C ATOM 0 H VAL A 54 -21.379 0.342 -31.705 1.00 41.43 H new ATOM 0 HA VAL A 54 -18.854 1.474 -32.350 1.00 41.05 H new ATOM 0 HB VAL A 54 -21.633 1.536 -33.530 1.00 62.44 H new ATOM 0 HG11 VAL A 54 -20.822 2.966 -35.361 1.00 55.45 H new ATOM 0 HG12 VAL A 54 -20.807 3.819 -33.799 1.00 55.45 H new ATOM 0 HG13 VAL A 54 -19.288 3.203 -34.491 1.00 55.45 H new ATOM 0 HG21 VAL A 54 -20.474 0.522 -35.452 1.00 13.13 H new ATOM 0 HG22 VAL A 54 -18.925 0.658 -34.585 1.00 13.13 H new ATOM 0 HG23 VAL A 54 -20.206 -0.405 -33.956 1.00 13.13 H new ATOM 815 N ASN A 55 -21.114 3.381 -30.952 1.00 5.22 N ATOM 816 CA ASN A 55 -21.353 4.688 -30.351 1.00 52.43 C ATOM 817 C ASN A 55 -20.722 4.774 -28.965 1.00 44.31 C ATOM 818 O ASN A 55 -20.413 5.862 -28.478 1.00 30.11 O ATOM 819 CB ASN A 55 -22.856 4.962 -30.257 1.00 64.13 C ATOM 820 CG ASN A 55 -23.440 4.531 -28.926 1.00 24.32 C ATOM 821 OD1 ASN A 55 -23.277 5.213 -27.914 1.00 22.21 O ATOM 822 ND2 ASN A 55 -24.124 3.393 -28.921 1.00 30.22 N ATOM 0 H ASN A 55 -21.836 2.688 -30.755 1.00 5.22 H new ATOM 0 HA ASN A 55 -20.891 5.442 -30.988 1.00 52.43 H new ATOM 0 HB2 ASN A 55 -23.038 6.027 -30.403 1.00 64.13 H new ATOM 0 HB3 ASN A 55 -23.369 4.437 -31.063 1.00 64.13 H new ATOM 0 HD21 ASN A 55 -24.540 3.052 -28.054 1.00 30.22 H new ATOM 0 HD22 ASN A 55 -24.234 2.860 -29.784 1.00 30.22 H new ATOM 829 N VAL A 56 -20.532 3.619 -28.335 1.00 5.52 N ATOM 830 CA VAL A 56 -19.935 3.563 -27.006 1.00 10.24 C ATOM 831 C VAL A 56 -18.415 3.483 -27.088 1.00 61.14 C ATOM 832 O VAL A 56 -17.710 3.920 -26.179 1.00 3.44 O ATOM 833 CB VAL A 56 -20.459 2.356 -26.206 1.00 31.41 C ATOM 834 CG1 VAL A 56 -19.579 1.137 -26.440 1.00 3.43 C ATOM 835 CG2 VAL A 56 -20.536 2.691 -24.724 1.00 54.42 C ATOM 0 H VAL A 56 -20.783 2.710 -28.724 1.00 5.52 H new ATOM 0 HA VAL A 56 -20.220 4.481 -26.493 1.00 10.24 H new ATOM 0 HB VAL A 56 -21.465 2.121 -26.555 1.00 31.41 H new ATOM 0 HG11 VAL A 56 -19.965 0.294 -25.867 1.00 3.43 H new ATOM 0 HG12 VAL A 56 -19.580 0.885 -27.501 1.00 3.43 H new ATOM 0 HG13 VAL A 56 -18.560 1.357 -26.121 1.00 3.43 H new ATOM 0 HG21 VAL A 56 -20.908 1.826 -24.174 1.00 54.42 H new ATOM 0 HG22 VAL A 56 -19.543 2.954 -24.358 1.00 54.42 H new ATOM 0 HG23 VAL A 56 -21.212 3.533 -24.576 1.00 54.42 H new ATOM 845 N ILE A 57 -17.916 2.922 -28.185 1.00 34.11 N ATOM 846 CA ILE A 57 -16.479 2.786 -28.387 1.00 74.21 C ATOM 847 C ILE A 57 -15.914 3.985 -29.140 1.00 52.31 C ATOM 848 O ILE A 57 -14.735 4.312 -29.011 1.00 22.51 O ATOM 849 CB ILE A 57 -16.139 1.500 -29.163 1.00 74.15 C ATOM 850 CG1 ILE A 57 -16.491 0.266 -28.329 1.00 55.45 C ATOM 851 CG2 ILE A 57 -14.667 1.485 -29.545 1.00 43.30 C ATOM 852 CD1 ILE A 57 -15.611 0.088 -27.113 1.00 4.23 C ATOM 0 H ILE A 57 -18.486 2.555 -28.947 1.00 34.11 H new ATOM 0 HA ILE A 57 -16.025 2.734 -27.398 1.00 74.21 H new ATOM 0 HB ILE A 57 -16.732 1.478 -30.077 1.00 74.15 H new ATOM 0 HG12 ILE A 57 -17.530 0.339 -28.008 1.00 55.45 H new ATOM 0 HG13 ILE A 57 -16.413 -0.621 -28.957 1.00 55.45 H new ATOM 0 HG21 ILE A 57 -14.443 0.570 -30.093 1.00 43.30 H new ATOM 0 HG22 ILE A 57 -14.445 2.348 -30.173 1.00 43.30 H new ATOM 0 HG23 ILE A 57 -14.057 1.527 -28.643 1.00 43.30 H new ATOM 0 HD11 ILE A 57 -15.918 -0.806 -26.570 1.00 4.23 H new ATOM 0 HD12 ILE A 57 -14.573 -0.017 -27.428 1.00 4.23 H new ATOM 0 HD13 ILE A 57 -15.707 0.958 -26.464 1.00 4.23 H new ATOM 864 N GLU A 58 -16.765 4.639 -29.925 1.00 61.22 N ATOM 865 CA GLU A 58 -16.350 5.803 -30.698 1.00 44.51 C ATOM 866 C GLU A 58 -15.635 6.819 -29.811 1.00 35.03 C ATOM 867 O GLU A 58 -14.471 7.158 -30.024 1.00 73.34 O ATOM 868 CB GLU A 58 -17.560 6.457 -31.368 1.00 13.24 C ATOM 869 CG GLU A 58 -17.560 6.332 -32.882 1.00 21.31 C ATOM 870 CD GLU A 58 -16.571 7.271 -33.545 1.00 11.02 C ATOM 871 OE1 GLU A 58 -15.358 7.135 -33.283 1.00 5.23 O ATOM 872 OE2 GLU A 58 -17.010 8.141 -34.325 1.00 12.51 O ATOM 0 H GLU A 58 -17.745 4.382 -30.042 1.00 61.22 H new ATOM 0 HA GLU A 58 -15.656 5.466 -31.468 1.00 44.51 H new ATOM 0 HB2 GLU A 58 -18.471 6.005 -30.975 1.00 13.24 H new ATOM 0 HB3 GLU A 58 -17.587 7.513 -31.099 1.00 13.24 H new ATOM 0 HG2 GLU A 58 -17.321 5.305 -33.158 1.00 21.31 H new ATOM 0 HG3 GLU A 58 -18.561 6.539 -33.260 1.00 21.31 H new ATOM 879 N PRO A 59 -16.349 7.318 -28.790 1.00 71.52 N ATOM 880 CA PRO A 59 -15.805 8.301 -27.850 1.00 4.24 C ATOM 881 C PRO A 59 -14.737 7.704 -26.939 1.00 60.24 C ATOM 882 O PRO A 59 -13.775 8.378 -26.570 1.00 2.01 O ATOM 883 CB PRO A 59 -17.028 8.725 -27.033 1.00 4.44 C ATOM 884 CG PRO A 59 -17.961 7.567 -27.118 1.00 44.11 C ATOM 885 CD PRO A 59 -17.742 6.959 -28.476 1.00 32.12 C ATOM 0 HA PRO A 59 -15.311 9.126 -28.364 1.00 4.24 H new ATOM 0 HB2 PRO A 59 -16.758 8.941 -25.999 1.00 4.44 H new ATOM 0 HB3 PRO A 59 -17.481 9.629 -27.439 1.00 4.44 H new ATOM 0 HG2 PRO A 59 -17.758 6.843 -26.329 1.00 44.11 H new ATOM 0 HG3 PRO A 59 -18.995 7.889 -26.997 1.00 44.11 H new ATOM 0 HD2 PRO A 59 -17.885 5.878 -28.460 1.00 32.12 H new ATOM 0 HD3 PRO A 59 -18.437 7.362 -29.213 1.00 32.12 H new ATOM 893 N CYS A 60 -14.913 6.437 -26.582 1.00 64.41 N ATOM 894 CA CYS A 60 -13.963 5.748 -25.714 1.00 55.32 C ATOM 895 C CYS A 60 -12.600 5.627 -26.387 1.00 52.43 C ATOM 896 O CYS A 60 -11.563 5.654 -25.724 1.00 13.11 O ATOM 897 CB CYS A 60 -14.490 4.360 -25.348 1.00 22.13 C ATOM 898 SG CYS A 60 -15.616 4.347 -23.934 1.00 14.25 S ATOM 0 H CYS A 60 -15.704 5.866 -26.879 1.00 64.41 H new ATOM 0 HA CYS A 60 -13.847 6.336 -24.804 1.00 55.32 H new ATOM 0 HB2 CYS A 60 -15.004 3.939 -26.212 1.00 22.13 H new ATOM 0 HB3 CYS A 60 -13.644 3.708 -25.131 1.00 22.13 H new ATOM 0 HG CYS A 60 -16.835 4.174 -24.352 1.00 14.25 H new ATOM 904 N LYS A 61 -12.609 5.493 -27.709 1.00 63.31 N ATOM 905 CA LYS A 61 -11.374 5.367 -28.474 1.00 24.22 C ATOM 906 C LYS A 61 -10.445 6.547 -28.206 1.00 52.11 C ATOM 907 O LYS A 61 -9.316 6.371 -27.748 1.00 61.13 O ATOM 908 CB LYS A 61 -11.683 5.277 -29.970 1.00 22.41 C ATOM 909 CG LYS A 61 -12.212 3.920 -30.401 1.00 32.22 C ATOM 910 CD LYS A 61 -11.112 3.054 -30.992 1.00 11.11 C ATOM 911 CE LYS A 61 -11.122 3.101 -32.512 1.00 72.21 C ATOM 912 NZ LYS A 61 -10.730 1.794 -33.110 1.00 14.42 N ATOM 0 H LYS A 61 -13.458 5.469 -28.273 1.00 63.31 H new ATOM 0 HA LYS A 61 -10.872 4.453 -28.157 1.00 24.22 H new ATOM 0 HB2 LYS A 61 -12.416 6.042 -30.228 1.00 22.41 H new ATOM 0 HB3 LYS A 61 -10.777 5.500 -30.534 1.00 22.41 H new ATOM 0 HG2 LYS A 61 -12.655 3.412 -29.544 1.00 32.22 H new ATOM 0 HG3 LYS A 61 -13.005 4.055 -31.137 1.00 32.22 H new ATOM 0 HD2 LYS A 61 -10.144 3.392 -30.623 1.00 11.11 H new ATOM 0 HD3 LYS A 61 -11.239 2.024 -30.658 1.00 11.11 H new ATOM 0 HE2 LYS A 61 -12.118 3.376 -32.860 1.00 72.21 H new ATOM 0 HE3 LYS A 61 -10.439 3.877 -32.856 1.00 72.21 H new ATOM 0 HZ1 LYS A 61 -10.749 1.867 -34.147 1.00 14.42 H new ATOM 0 HZ2 LYS A 61 -9.770 1.544 -32.798 1.00 14.42 H new ATOM 0 HZ3 LYS A 61 -11.397 1.058 -32.803 1.00 14.42 H new ATOM 926 N LYS A 62 -10.929 7.751 -28.493 1.00 4.11 N ATOM 927 CA LYS A 62 -10.144 8.962 -28.281 1.00 21.54 C ATOM 928 C LYS A 62 -9.674 9.059 -26.833 1.00 32.53 C ATOM 929 O LYS A 62 -8.664 9.698 -26.539 1.00 11.32 O ATOM 930 CB LYS A 62 -10.968 10.199 -28.644 1.00 72.45 C ATOM 931 CG LYS A 62 -10.791 10.645 -30.085 1.00 40.33 C ATOM 932 CD LYS A 62 -11.518 9.722 -31.049 1.00 14.43 C ATOM 933 CE LYS A 62 -12.210 10.505 -32.155 1.00 31.43 C ATOM 934 NZ LYS A 62 -11.234 11.088 -33.116 1.00 64.50 N ATOM 0 H LYS A 62 -11.861 7.914 -28.873 1.00 4.11 H new ATOM 0 HA LYS A 62 -9.267 8.914 -28.927 1.00 21.54 H new ATOM 0 HB2 LYS A 62 -12.022 9.989 -28.464 1.00 72.45 H new ATOM 0 HB3 LYS A 62 -10.689 11.019 -27.982 1.00 72.45 H new ATOM 0 HG2 LYS A 62 -11.166 11.662 -30.201 1.00 40.33 H new ATOM 0 HG3 LYS A 62 -9.730 10.667 -30.332 1.00 40.33 H new ATOM 0 HD2 LYS A 62 -10.809 9.020 -31.488 1.00 14.43 H new ATOM 0 HD3 LYS A 62 -12.255 9.132 -30.504 1.00 14.43 H new ATOM 0 HE2 LYS A 62 -12.898 9.849 -32.689 1.00 31.43 H new ATOM 0 HE3 LYS A 62 -12.808 11.303 -31.715 1.00 31.43 H new ATOM 0 HZ1 LYS A 62 -11.745 11.613 -33.854 1.00 64.50 H new ATOM 0 HZ2 LYS A 62 -10.594 11.734 -32.612 1.00 64.50 H new ATOM 0 HZ3 LYS A 62 -10.681 10.325 -33.555 1.00 64.50 H new ATOM 948 N PHE A 63 -10.412 8.419 -25.932 1.00 33.52 N ATOM 949 CA PHE A 63 -10.071 8.432 -24.514 1.00 44.52 C ATOM 950 C PHE A 63 -9.032 7.361 -24.194 1.00 74.25 C ATOM 951 O PHE A 63 -8.286 7.475 -23.222 1.00 73.31 O ATOM 952 CB PHE A 63 -11.324 8.215 -23.664 1.00 23.54 C ATOM 953 CG PHE A 63 -11.237 8.835 -22.299 1.00 20.04 C ATOM 954 CD1 PHE A 63 -10.563 8.192 -21.273 1.00 10.34 C ATOM 955 CD2 PHE A 63 -11.829 10.061 -22.041 1.00 42.15 C ATOM 956 CE1 PHE A 63 -10.483 8.761 -20.015 1.00 65.24 C ATOM 957 CE2 PHE A 63 -11.751 10.635 -20.786 1.00 72.33 C ATOM 958 CZ PHE A 63 -11.076 9.984 -19.772 1.00 72.02 C ATOM 0 H PHE A 63 -11.251 7.884 -26.159 1.00 33.52 H new ATOM 0 HA PHE A 63 -9.645 9.407 -24.277 1.00 44.52 H new ATOM 0 HB2 PHE A 63 -12.185 8.629 -24.188 1.00 23.54 H new ATOM 0 HB3 PHE A 63 -11.500 7.145 -23.558 1.00 23.54 H new ATOM 0 HD1 PHE A 63 -10.095 7.236 -21.458 1.00 10.34 H new ATOM 0 HD2 PHE A 63 -12.358 10.574 -22.830 1.00 42.15 H new ATOM 0 HE1 PHE A 63 -9.957 8.249 -19.223 1.00 65.24 H new ATOM 0 HE2 PHE A 63 -12.217 11.591 -20.599 1.00 72.33 H new ATOM 0 HZ PHE A 63 -11.012 10.431 -18.791 1.00 72.02 H new ATOM 968 N SER A 64 -8.992 6.320 -25.020 1.00 23.21 N ATOM 969 CA SER A 64 -8.049 5.225 -24.824 1.00 3.13 C ATOM 970 C SER A 64 -6.615 5.746 -24.771 1.00 75.53 C ATOM 971 O SER A 64 -5.808 5.289 -23.963 1.00 1.11 O ATOM 972 CB SER A 64 -8.189 4.196 -25.947 1.00 22.32 C ATOM 973 OG SER A 64 -8.332 2.887 -25.424 1.00 34.43 O ATOM 0 H SER A 64 -9.601 6.212 -25.831 1.00 23.21 H new ATOM 0 HA SER A 64 -8.279 4.746 -23.872 1.00 3.13 H new ATOM 0 HB2 SER A 64 -9.054 4.441 -26.563 1.00 22.32 H new ATOM 0 HB3 SER A 64 -7.313 4.239 -26.595 1.00 22.32 H new ATOM 0 HG SER A 64 -8.421 2.248 -26.162 1.00 34.43 H new ATOM 979 N GLU A 65 -6.308 6.704 -25.640 1.00 73.21 N ATOM 980 CA GLU A 65 -4.973 7.286 -25.693 1.00 45.14 C ATOM 981 C GLU A 65 -4.639 8.002 -24.388 1.00 4.02 C ATOM 982 O GLU A 65 -3.471 8.124 -24.015 1.00 11.44 O ATOM 983 CB GLU A 65 -4.864 8.263 -26.866 1.00 15.42 C ATOM 984 CG GLU A 65 -5.131 7.624 -28.218 1.00 20.40 C ATOM 985 CD GLU A 65 -3.889 7.554 -29.085 1.00 52.24 C ATOM 986 OE1 GLU A 65 -2.780 7.436 -28.524 1.00 21.51 O ATOM 987 OE2 GLU A 65 -4.026 7.619 -30.325 1.00 32.21 O ATOM 0 H GLU A 65 -6.965 7.093 -26.316 1.00 73.21 H new ATOM 0 HA GLU A 65 -4.258 6.476 -25.836 1.00 45.14 H new ATOM 0 HB2 GLU A 65 -5.570 9.080 -26.714 1.00 15.42 H new ATOM 0 HB3 GLU A 65 -3.866 8.701 -26.871 1.00 15.42 H new ATOM 0 HG2 GLU A 65 -5.523 6.618 -28.069 1.00 20.40 H new ATOM 0 HG3 GLU A 65 -5.902 8.193 -28.739 1.00 20.40 H new ATOM 994 N LEU A 66 -5.671 8.474 -23.698 1.00 32.30 N ATOM 995 CA LEU A 66 -5.489 9.178 -22.434 1.00 0.53 C ATOM 996 C LEU A 66 -4.942 8.241 -21.362 1.00 1.32 C ATOM 997 O LEU A 66 -4.130 8.641 -20.526 1.00 54.54 O ATOM 998 CB LEU A 66 -6.814 9.784 -21.969 1.00 55.53 C ATOM 999 CG LEU A 66 -7.556 10.642 -22.995 1.00 53.20 C ATOM 1000 CD1 LEU A 66 -8.853 11.177 -22.406 1.00 65.22 C ATOM 1001 CD2 LEU A 66 -6.673 11.786 -23.472 1.00 53.11 C ATOM 0 H LEU A 66 -6.643 8.382 -23.993 1.00 32.30 H new ATOM 0 HA LEU A 66 -4.767 9.978 -22.594 1.00 0.53 H new ATOM 0 HB2 LEU A 66 -7.473 8.973 -21.659 1.00 55.53 H new ATOM 0 HB3 LEU A 66 -6.622 10.394 -21.086 1.00 55.53 H new ATOM 0 HG LEU A 66 -7.802 10.017 -23.853 1.00 53.20 H new ATOM 0 HD11 LEU A 66 -9.367 11.785 -23.150 1.00 65.22 H new ATOM 0 HD12 LEU A 66 -9.492 10.343 -22.115 1.00 65.22 H new ATOM 0 HD13 LEU A 66 -8.631 11.787 -21.530 1.00 65.22 H new ATOM 0 HD21 LEU A 66 -7.217 12.386 -24.201 1.00 53.11 H new ATOM 0 HD22 LEU A 66 -6.396 12.411 -22.623 1.00 53.11 H new ATOM 0 HD23 LEU A 66 -5.772 11.382 -23.934 1.00 53.11 H new ATOM 1013 N THR A 67 -5.390 6.990 -21.392 1.00 61.12 N ATOM 1014 CA THR A 67 -4.945 5.995 -20.425 1.00 11.14 C ATOM 1015 C THR A 67 -3.447 5.740 -20.547 1.00 11.41 C ATOM 1016 O THR A 67 -2.828 5.174 -19.647 1.00 12.41 O ATOM 1017 CB THR A 67 -5.697 4.663 -20.603 1.00 30.43 C ATOM 1018 OG1 THR A 67 -5.214 3.979 -21.765 1.00 14.22 O ATOM 1019 CG2 THR A 67 -7.194 4.899 -20.733 1.00 11.24 C ATOM 0 H THR A 67 -6.061 6.642 -22.076 1.00 61.12 H new ATOM 0 HA THR A 67 -5.163 6.397 -19.436 1.00 11.14 H new ATOM 0 HB THR A 67 -5.518 4.050 -19.720 1.00 30.43 H new ATOM 0 HG1 THR A 67 -5.382 3.018 -21.673 1.00 14.22 H new ATOM 0 HG21 THR A 67 -7.703 3.944 -20.858 1.00 11.24 H new ATOM 0 HG22 THR A 67 -7.564 5.393 -19.834 1.00 11.24 H new ATOM 0 HG23 THR A 67 -7.389 5.530 -21.600 1.00 11.24 H new ATOM 1027 N GLY A 68 -2.869 6.163 -21.667 1.00 40.23 N ATOM 1028 CA GLY A 68 -1.447 5.972 -21.886 1.00 52.11 C ATOM 1029 C GLY A 68 -0.641 7.220 -21.585 1.00 53.22 C ATOM 1030 O GLY A 68 0.585 7.168 -21.487 1.00 64.22 O ATOM 0 H GLY A 68 -3.360 6.635 -22.427 1.00 40.23 H new ATOM 0 HA2 GLY A 68 -1.093 5.154 -21.258 1.00 52.11 H new ATOM 0 HA3 GLY A 68 -1.279 5.675 -22.921 1.00 52.11 H new ATOM 1034 N LEU A 69 -1.331 8.347 -21.440 1.00 25.54 N ATOM 1035 CA LEU A 69 -0.671 9.615 -21.150 1.00 0.04 C ATOM 1036 C LEU A 69 -0.570 9.845 -19.645 1.00 72.11 C ATOM 1037 O LEU A 69 0.150 10.733 -19.189 1.00 21.00 O ATOM 1038 CB LEU A 69 -1.432 10.769 -21.804 1.00 13.44 C ATOM 1039 CG LEU A 69 -0.588 11.965 -22.246 1.00 1.00 C ATOM 1040 CD1 LEU A 69 0.467 11.531 -23.252 1.00 33.31 C ATOM 1041 CD2 LEU A 69 -1.473 13.054 -22.835 1.00 3.23 C ATOM 0 H LEU A 69 -2.346 8.408 -21.519 1.00 25.54 H new ATOM 0 HA LEU A 69 0.338 9.574 -21.561 1.00 0.04 H new ATOM 0 HB2 LEU A 69 -1.961 10.382 -22.675 1.00 13.44 H new ATOM 0 HB3 LEU A 69 -2.188 11.123 -21.103 1.00 13.44 H new ATOM 0 HG LEU A 69 -0.081 12.371 -21.371 1.00 1.00 H new ATOM 0 HD11 LEU A 69 1.058 12.395 -23.555 1.00 33.31 H new ATOM 0 HD12 LEU A 69 1.120 10.787 -22.796 1.00 33.31 H new ATOM 0 HD13 LEU A 69 -0.020 11.100 -24.127 1.00 33.31 H new ATOM 0 HD21 LEU A 69 -0.855 13.897 -23.144 1.00 3.23 H new ATOM 0 HD22 LEU A 69 -2.008 12.660 -23.699 1.00 3.23 H new ATOM 0 HD23 LEU A 69 -2.190 13.386 -22.084 1.00 3.23 H new ATOM 1053 N VAL A 70 -1.296 9.037 -18.878 1.00 42.13 N ATOM 1054 CA VAL A 70 -1.286 9.150 -17.425 1.00 22.13 C ATOM 1055 C VAL A 70 -0.280 8.185 -16.805 1.00 55.45 C ATOM 1056 O VAL A 70 0.310 8.472 -15.764 1.00 22.52 O ATOM 1057 CB VAL A 70 -2.680 8.873 -16.831 1.00 25.24 C ATOM 1058 CG1 VAL A 70 -2.560 8.377 -15.397 1.00 54.34 C ATOM 1059 CG2 VAL A 70 -3.546 10.121 -16.902 1.00 33.14 C ATOM 0 H VAL A 70 -1.898 8.297 -19.239 1.00 42.13 H new ATOM 0 HA VAL A 70 -0.996 10.174 -17.189 1.00 22.13 H new ATOM 0 HB VAL A 70 -3.160 8.092 -17.421 1.00 25.24 H new ATOM 0 HG11 VAL A 70 -3.554 8.187 -14.993 1.00 54.34 H new ATOM 0 HG12 VAL A 70 -1.978 7.455 -15.378 1.00 54.34 H new ATOM 0 HG13 VAL A 70 -2.061 9.133 -14.791 1.00 54.34 H new ATOM 0 HG21 VAL A 70 -4.527 9.908 -16.478 1.00 33.14 H new ATOM 0 HG22 VAL A 70 -3.074 10.924 -16.337 1.00 33.14 H new ATOM 0 HG23 VAL A 70 -3.659 10.427 -17.942 1.00 33.14 H new ATOM 1069 N PHE A 71 -0.090 7.041 -17.454 1.00 12.13 N ATOM 1070 CA PHE A 71 0.844 6.033 -16.967 1.00 31.34 C ATOM 1071 C PHE A 71 2.200 6.172 -17.652 1.00 22.43 C ATOM 1072 O PHE A 71 3.122 5.398 -17.391 1.00 11.02 O ATOM 1073 CB PHE A 71 0.282 4.629 -17.203 1.00 54.53 C ATOM 1074 CG PHE A 71 -0.789 4.240 -16.225 1.00 21.45 C ATOM 1075 CD1 PHE A 71 -2.110 4.595 -16.445 1.00 21.54 C ATOM 1076 CD2 PHE A 71 -0.474 3.519 -15.084 1.00 22.31 C ATOM 1077 CE1 PHE A 71 -3.098 4.237 -15.546 1.00 44.11 C ATOM 1078 CE2 PHE A 71 -1.457 3.158 -14.182 1.00 51.12 C ATOM 1079 CZ PHE A 71 -2.770 3.519 -14.413 1.00 34.32 C ATOM 0 H PHE A 71 -0.570 6.789 -18.318 1.00 12.13 H new ATOM 0 HA PHE A 71 0.980 6.187 -15.897 1.00 31.34 H new ATOM 0 HB2 PHE A 71 -0.122 4.573 -18.214 1.00 54.53 H new ATOM 0 HB3 PHE A 71 1.096 3.906 -17.145 1.00 54.53 H new ATOM 0 HD1 PHE A 71 -2.371 5.158 -17.329 1.00 21.54 H new ATOM 0 HD2 PHE A 71 0.551 3.236 -14.898 1.00 22.31 H new ATOM 0 HE1 PHE A 71 -4.124 4.518 -15.730 1.00 44.11 H new ATOM 0 HE2 PHE A 71 -1.199 2.594 -13.298 1.00 51.12 H new ATOM 0 HZ PHE A 71 -3.539 3.240 -13.708 1.00 34.32 H new ATOM 1089 N TYR A 72 2.314 7.162 -18.529 1.00 40.23 N ATOM 1090 CA TYR A 72 3.556 7.402 -19.255 1.00 31.42 C ATOM 1091 C TYR A 72 4.005 8.852 -19.102 1.00 61.32 C ATOM 1092 O TYR A 72 5.170 9.126 -18.810 1.00 32.03 O ATOM 1093 CB TYR A 72 3.379 7.064 -20.736 1.00 50.12 C ATOM 1094 CG TYR A 72 4.685 6.905 -21.481 1.00 41.32 C ATOM 1095 CD1 TYR A 72 5.599 5.923 -21.119 1.00 73.15 C ATOM 1096 CD2 TYR A 72 5.006 7.738 -22.546 1.00 1.10 C ATOM 1097 CE1 TYR A 72 6.794 5.774 -21.797 1.00 14.43 C ATOM 1098 CE2 TYR A 72 6.198 7.596 -23.230 1.00 32.11 C ATOM 1099 CZ TYR A 72 7.088 6.613 -22.851 1.00 63.15 C ATOM 1100 OH TYR A 72 8.277 6.469 -23.529 1.00 42.13 O ATOM 0 H TYR A 72 1.561 7.812 -18.755 1.00 40.23 H new ATOM 0 HA TYR A 72 4.325 6.756 -18.832 1.00 31.42 H new ATOM 0 HB2 TYR A 72 2.806 6.141 -20.823 1.00 50.12 H new ATOM 0 HB3 TYR A 72 2.792 7.850 -21.212 1.00 50.12 H new ATOM 0 HD1 TYR A 72 5.372 5.265 -20.294 1.00 73.15 H new ATOM 0 HD2 TYR A 72 4.312 8.510 -22.844 1.00 1.10 H new ATOM 0 HE1 TYR A 72 7.493 5.005 -21.503 1.00 14.43 H new ATOM 0 HE2 TYR A 72 6.431 8.251 -24.056 1.00 32.11 H new ATOM 0 HH TYR A 72 8.329 7.137 -24.244 1.00 42.13 H new ATOM 1110 N LEU A 73 3.073 9.777 -19.302 1.00 31.22 N ATOM 1111 CA LEU A 73 3.371 11.200 -19.186 1.00 55.20 C ATOM 1112 C LEU A 73 2.554 11.838 -18.067 1.00 14.11 C ATOM 1113 O LEU A 73 1.662 12.653 -18.303 1.00 52.42 O ATOM 1114 CB LEU A 73 3.085 11.911 -20.510 1.00 75.53 C ATOM 1115 CG LEU A 73 3.843 13.217 -20.749 1.00 30.42 C ATOM 1116 CD1 LEU A 73 5.181 12.942 -21.417 1.00 43.41 C ATOM 1117 CD2 LEU A 73 3.010 14.171 -21.592 1.00 14.04 C ATOM 0 H LEU A 73 2.105 9.567 -19.545 1.00 31.22 H new ATOM 0 HA LEU A 73 4.429 11.306 -18.945 1.00 55.20 H new ATOM 0 HB2 LEU A 73 3.317 11.225 -21.325 1.00 75.53 H new ATOM 0 HB3 LEU A 73 2.016 12.120 -20.564 1.00 75.53 H new ATOM 0 HG LEU A 73 4.031 13.687 -19.784 1.00 30.42 H new ATOM 0 HD11 LEU A 73 5.707 13.883 -21.579 1.00 43.41 H new ATOM 0 HD12 LEU A 73 5.782 12.297 -20.776 1.00 43.41 H new ATOM 0 HD13 LEU A 73 5.015 12.449 -22.375 1.00 43.41 H new ATOM 0 HD21 LEU A 73 3.566 15.095 -21.752 1.00 14.04 H new ATOM 0 HD22 LEU A 73 2.790 13.709 -22.554 1.00 14.04 H new ATOM 0 HD23 LEU A 73 2.077 14.394 -21.075 1.00 14.04 H new ATOM 1129 N PRO A 74 2.865 11.461 -16.818 1.00 12.11 N ATOM 1130 CA PRO A 74 2.173 11.986 -15.637 1.00 1.11 C ATOM 1131 C PRO A 74 2.498 13.454 -15.380 1.00 34.33 C ATOM 1132 O PRO A 74 3.665 13.845 -15.340 1.00 54.14 O ATOM 1133 CB PRO A 74 2.704 11.113 -14.497 1.00 45.23 C ATOM 1134 CG PRO A 74 4.036 10.641 -14.971 1.00 11.53 C ATOM 1135 CD PRO A 74 3.917 10.494 -16.462 1.00 75.33 C ATOM 0 HA PRO A 74 1.089 11.950 -15.750 1.00 1.11 H new ATOM 0 HB2 PRO A 74 2.792 11.681 -13.571 1.00 45.23 H new ATOM 0 HB3 PRO A 74 2.036 10.276 -14.295 1.00 45.23 H new ATOM 0 HG2 PRO A 74 4.818 11.354 -14.710 1.00 11.53 H new ATOM 0 HG3 PRO A 74 4.302 9.692 -14.505 1.00 11.53 H new ATOM 0 HD2 PRO A 74 4.857 10.720 -16.964 1.00 75.33 H new ATOM 0 HD3 PRO A 74 3.641 9.478 -16.745 1.00 75.33 H new ATOM 1143 N THR A 75 1.458 14.263 -15.204 1.00 53.23 N ATOM 1144 CA THR A 75 1.632 15.688 -14.951 1.00 63.23 C ATOM 1145 C THR A 75 1.306 16.033 -13.503 1.00 22.03 C ATOM 1146 O THR A 75 1.681 17.096 -13.008 1.00 41.45 O ATOM 1147 CB THR A 75 0.745 16.536 -15.881 1.00 40.55 C ATOM 1148 OG1 THR A 75 0.998 16.192 -17.248 1.00 75.41 O ATOM 1149 CG2 THR A 75 1.005 18.021 -15.671 1.00 73.43 C ATOM 0 H THR A 75 0.486 13.955 -15.232 1.00 53.23 H new ATOM 0 HA THR A 75 2.679 15.919 -15.150 1.00 63.23 H new ATOM 0 HB THR A 75 -0.298 16.328 -15.641 1.00 40.55 H new ATOM 0 HG1 THR A 75 0.429 16.735 -17.833 1.00 75.41 H new ATOM 0 HG21 THR A 75 0.367 18.600 -16.339 1.00 73.43 H new ATOM 0 HG22 THR A 75 0.784 18.286 -14.637 1.00 73.43 H new ATOM 0 HG23 THR A 75 2.051 18.241 -15.886 1.00 73.43 H new ATOM 1157 N ASP A 76 0.607 15.128 -12.827 1.00 31.01 N ATOM 1158 CA ASP A 76 0.232 15.336 -11.433 1.00 51.21 C ATOM 1159 C ASP A 76 -0.520 14.127 -10.886 1.00 71.12 C ATOM 1160 O ASP A 76 -0.594 13.084 -11.536 1.00 20.35 O ATOM 1161 CB ASP A 76 -0.630 16.593 -11.297 1.00 23.52 C ATOM 1162 CG ASP A 76 -0.342 17.356 -10.019 1.00 41.22 C ATOM 1163 OD1 ASP A 76 0.848 17.604 -9.732 1.00 14.12 O ATOM 1164 OD2 ASP A 76 -1.306 17.705 -9.306 1.00 52.11 O ATOM 0 H ASP A 76 0.288 14.243 -13.222 1.00 31.01 H new ATOM 0 HA ASP A 76 1.145 15.466 -10.852 1.00 51.21 H new ATOM 0 HB2 ASP A 76 -0.455 17.245 -12.153 1.00 23.52 H new ATOM 0 HB3 ASP A 76 -1.683 16.312 -11.320 1.00 23.52 H new ATOM 1169 N SER A 77 -1.076 14.274 -9.688 1.00 4.23 N ATOM 1170 CA SER A 77 -1.818 13.192 -9.051 1.00 3.41 C ATOM 1171 C SER A 77 -3.049 12.821 -9.872 1.00 43.11 C ATOM 1172 O SER A 77 -3.635 11.755 -9.686 1.00 45.43 O ATOM 1173 CB SER A 77 -2.237 13.597 -7.636 1.00 72.04 C ATOM 1174 OG SER A 77 -2.100 12.513 -6.734 1.00 61.01 O ATOM 0 H SER A 77 -1.027 15.132 -9.139 1.00 4.23 H new ATOM 0 HA SER A 77 -1.165 12.321 -8.994 1.00 3.41 H new ATOM 0 HB2 SER A 77 -1.627 14.435 -7.298 1.00 72.04 H new ATOM 0 HB3 SER A 77 -3.272 13.939 -7.644 1.00 72.04 H new ATOM 0 HG SER A 77 -2.372 12.798 -5.837 1.00 61.01 H new ATOM 1180 N GLY A 78 -3.436 13.710 -10.782 1.00 45.03 N ATOM 1181 CA GLY A 78 -4.594 13.459 -11.619 1.00 34.22 C ATOM 1182 C GLY A 78 -4.853 14.582 -12.603 1.00 72.14 C ATOM 1183 O GLY A 78 -6.002 14.944 -12.853 1.00 75.31 O ATOM 0 H GLY A 78 -2.968 14.600 -10.954 1.00 45.03 H new ATOM 0 HA2 GLY A 78 -4.448 12.528 -12.166 1.00 34.22 H new ATOM 0 HA3 GLY A 78 -5.472 13.324 -10.988 1.00 34.22 H new ATOM 1187 N GLU A 79 -3.782 15.136 -13.162 1.00 64.33 N ATOM 1188 CA GLU A 79 -3.899 16.226 -14.123 1.00 14.30 C ATOM 1189 C GLU A 79 -4.544 15.743 -15.419 1.00 30.42 C ATOM 1190 O GLU A 79 -5.679 16.102 -15.734 1.00 3.25 O ATOM 1191 CB GLU A 79 -2.523 16.826 -14.418 1.00 52.51 C ATOM 1192 CG GLU A 79 -2.279 18.158 -13.727 1.00 62.44 C ATOM 1193 CD GLU A 79 -3.164 19.265 -14.265 1.00 51.11 C ATOM 1194 OE1 GLU A 79 -3.473 19.244 -15.475 1.00 3.22 O ATOM 1195 OE2 GLU A 79 -3.548 20.153 -13.475 1.00 74.21 O ATOM 0 H GLU A 79 -2.823 14.848 -12.966 1.00 64.33 H new ATOM 0 HA GLU A 79 -4.536 16.994 -13.685 1.00 14.30 H new ATOM 0 HB2 GLU A 79 -1.754 16.119 -14.108 1.00 52.51 H new ATOM 0 HB3 GLU A 79 -2.418 16.960 -15.495 1.00 52.51 H new ATOM 0 HG2 GLU A 79 -2.454 18.045 -12.657 1.00 62.44 H new ATOM 0 HG3 GLU A 79 -1.234 18.441 -13.851 1.00 62.44 H new ATOM 1202 N LYS A 80 -3.812 14.925 -16.168 1.00 3.14 N ATOM 1203 CA LYS A 80 -4.310 14.390 -17.429 1.00 43.44 C ATOM 1204 C LYS A 80 -5.638 13.668 -17.228 1.00 22.33 C ATOM 1205 O LYS A 80 -6.475 13.625 -18.129 1.00 2.12 O ATOM 1206 CB LYS A 80 -3.284 13.434 -18.042 1.00 33.43 C ATOM 1207 CG LYS A 80 -2.427 14.071 -19.121 1.00 64.13 C ATOM 1208 CD LYS A 80 -3.256 14.465 -20.332 1.00 61.21 C ATOM 1209 CE LYS A 80 -2.696 15.705 -21.012 1.00 23.13 C ATOM 1210 NZ LYS A 80 -3.266 15.896 -22.374 1.00 11.31 N ATOM 0 H LYS A 80 -2.871 14.618 -15.923 1.00 3.14 H new ATOM 0 HA LYS A 80 -4.471 15.225 -18.110 1.00 43.44 H new ATOM 0 HB2 LYS A 80 -2.636 13.055 -17.252 1.00 33.43 H new ATOM 0 HB3 LYS A 80 -3.807 12.576 -18.465 1.00 33.43 H new ATOM 0 HG2 LYS A 80 -1.929 14.953 -18.718 1.00 64.13 H new ATOM 0 HG3 LYS A 80 -1.646 13.374 -19.425 1.00 64.13 H new ATOM 0 HD2 LYS A 80 -3.280 13.639 -21.042 1.00 61.21 H new ATOM 0 HD3 LYS A 80 -4.285 14.651 -20.025 1.00 61.21 H new ATOM 0 HE2 LYS A 80 -2.911 16.582 -20.402 1.00 23.13 H new ATOM 0 HE3 LYS A 80 -1.611 15.623 -21.081 1.00 23.13 H new ATOM 0 HZ1 LYS A 80 -2.588 16.419 -22.964 1.00 11.31 H new ATOM 0 HZ2 LYS A 80 -3.456 14.968 -22.804 1.00 11.31 H new ATOM 0 HZ3 LYS A 80 -4.153 16.434 -22.307 1.00 11.31 H new ATOM 1224 N MET A 81 -5.824 13.102 -16.039 1.00 52.44 N ATOM 1225 CA MET A 81 -7.052 12.384 -15.720 1.00 13.04 C ATOM 1226 C MET A 81 -8.210 13.354 -15.508 1.00 53.23 C ATOM 1227 O MET A 81 -9.208 13.313 -16.228 1.00 74.35 O ATOM 1228 CB MET A 81 -6.856 11.526 -14.468 1.00 45.31 C ATOM 1229 CG MET A 81 -5.594 10.680 -14.504 1.00 25.41 C ATOM 1230 SD MET A 81 -5.390 9.673 -13.022 1.00 1.43 S ATOM 1231 CE MET A 81 -3.693 10.049 -12.588 1.00 12.22 C ATOM 0 H MET A 81 -5.141 13.127 -15.282 1.00 52.44 H new ATOM 0 HA MET A 81 -7.293 11.736 -16.563 1.00 13.04 H new ATOM 0 HB2 MET A 81 -6.823 12.176 -13.593 1.00 45.31 H new ATOM 0 HB3 MET A 81 -7.719 10.872 -14.347 1.00 45.31 H new ATOM 0 HG2 MET A 81 -5.622 10.030 -15.379 1.00 25.41 H new ATOM 0 HG3 MET A 81 -4.728 11.332 -14.618 1.00 25.41 H new ATOM 0 HE1 MET A 81 -3.076 9.162 -12.732 1.00 12.22 H new ATOM 0 HE2 MET A 81 -3.325 10.855 -13.223 1.00 12.22 H new ATOM 0 HE3 MET A 81 -3.645 10.359 -11.544 1.00 12.22 H new ATOM 1241 N THR A 82 -8.071 14.228 -14.516 1.00 34.44 N ATOM 1242 CA THR A 82 -9.106 15.207 -14.209 1.00 32.12 C ATOM 1243 C THR A 82 -9.374 16.116 -15.403 1.00 32.02 C ATOM 1244 O THR A 82 -10.467 16.664 -15.544 1.00 22.04 O ATOM 1245 CB THR A 82 -8.718 16.073 -12.996 1.00 31.05 C ATOM 1246 OG1 THR A 82 -9.896 16.579 -12.358 1.00 32.22 O ATOM 1247 CG2 THR A 82 -7.828 17.231 -13.420 1.00 41.20 C ATOM 0 H THR A 82 -7.251 14.278 -13.911 1.00 34.44 H new ATOM 0 HA THR A 82 -10.011 14.647 -13.972 1.00 32.12 H new ATOM 0 HB THR A 82 -8.165 15.449 -12.294 1.00 31.05 H new ATOM 0 HG1 THR A 82 -9.641 17.127 -11.587 1.00 32.22 H new ATOM 0 HG21 THR A 82 -7.567 17.828 -12.546 1.00 41.20 H new ATOM 0 HG22 THR A 82 -6.919 16.842 -13.878 1.00 41.20 H new ATOM 0 HG23 THR A 82 -8.359 17.854 -14.140 1.00 41.20 H new ATOM 1255 N GLU A 83 -8.370 16.271 -16.260 1.00 70.21 N ATOM 1256 CA GLU A 83 -8.499 17.114 -17.442 1.00 51.54 C ATOM 1257 C GLU A 83 -9.216 16.371 -18.566 1.00 32.04 C ATOM 1258 O GLU A 83 -9.784 16.986 -19.468 1.00 14.22 O ATOM 1259 CB GLU A 83 -7.121 17.576 -17.920 1.00 64.20 C ATOM 1260 CG GLU A 83 -7.164 18.818 -18.794 1.00 64.34 C ATOM 1261 CD GLU A 83 -5.870 19.042 -19.553 1.00 60.02 C ATOM 1262 OE1 GLU A 83 -4.931 18.238 -19.375 1.00 33.41 O ATOM 1263 OE2 GLU A 83 -5.796 20.021 -20.324 1.00 50.15 O ATOM 0 H GLU A 83 -7.459 15.824 -16.158 1.00 70.21 H new ATOM 0 HA GLU A 83 -9.093 17.987 -17.170 1.00 51.54 H new ATOM 0 HB2 GLU A 83 -6.493 17.775 -17.052 1.00 64.20 H new ATOM 0 HB3 GLU A 83 -6.649 16.767 -18.477 1.00 64.20 H new ATOM 0 HG2 GLU A 83 -7.987 18.730 -19.504 1.00 64.34 H new ATOM 0 HG3 GLU A 83 -7.371 19.689 -18.172 1.00 64.34 H new ATOM 1270 N SER A 84 -9.184 15.044 -18.503 1.00 73.43 N ATOM 1271 CA SER A 84 -9.827 14.215 -19.517 1.00 1.22 C ATOM 1272 C SER A 84 -11.309 14.029 -19.206 1.00 71.05 C ATOM 1273 O SER A 84 -12.124 13.831 -20.108 1.00 14.44 O ATOM 1274 CB SER A 84 -9.137 12.852 -19.604 1.00 53.31 C ATOM 1275 OG SER A 84 -7.866 12.962 -20.221 1.00 55.42 O ATOM 0 H SER A 84 -8.720 14.520 -17.761 1.00 73.43 H new ATOM 0 HA SER A 84 -9.736 14.722 -20.478 1.00 1.22 H new ATOM 0 HB2 SER A 84 -9.024 12.434 -18.604 1.00 53.31 H new ATOM 0 HB3 SER A 84 -9.761 12.161 -20.170 1.00 53.31 H new ATOM 0 HG SER A 84 -7.240 13.397 -19.605 1.00 55.42 H new ATOM 1281 N LYS A 85 -11.651 14.093 -17.924 1.00 51.32 N ATOM 1282 CA LYS A 85 -13.034 13.933 -17.492 1.00 14.32 C ATOM 1283 C LYS A 85 -13.913 15.045 -18.057 1.00 30.21 C ATOM 1284 O LYS A 85 -15.134 14.908 -18.127 1.00 54.32 O ATOM 1285 CB LYS A 85 -13.116 13.932 -15.964 1.00 23.53 C ATOM 1286 CG LYS A 85 -14.467 13.491 -15.427 1.00 25.30 C ATOM 1287 CD LYS A 85 -14.672 13.947 -13.992 1.00 73.32 C ATOM 1288 CE LYS A 85 -15.644 13.039 -13.253 1.00 5.22 C ATOM 1289 NZ LYS A 85 -16.902 13.750 -12.892 1.00 64.21 N ATOM 0 H LYS A 85 -10.989 14.255 -17.165 1.00 51.32 H new ATOM 0 HA LYS A 85 -13.398 12.978 -17.870 1.00 14.32 H new ATOM 0 HB2 LYS A 85 -12.344 13.272 -15.568 1.00 23.53 H new ATOM 0 HB3 LYS A 85 -12.898 14.935 -15.596 1.00 23.53 H new ATOM 0 HG2 LYS A 85 -15.260 13.897 -16.056 1.00 25.30 H new ATOM 0 HG3 LYS A 85 -14.544 12.405 -15.479 1.00 25.30 H new ATOM 0 HD2 LYS A 85 -13.714 13.957 -13.472 1.00 73.32 H new ATOM 0 HD3 LYS A 85 -15.050 14.969 -13.984 1.00 73.32 H new ATOM 0 HE2 LYS A 85 -15.880 12.176 -13.876 1.00 5.22 H new ATOM 0 HE3 LYS A 85 -15.169 12.659 -12.348 1.00 5.22 H new ATOM 0 HZ1 LYS A 85 -17.538 13.098 -12.390 1.00 64.21 H new ATOM 0 HZ2 LYS A 85 -16.680 14.558 -12.277 1.00 64.21 H new ATOM 0 HZ3 LYS A 85 -17.368 14.091 -13.757 1.00 64.21 H new ATOM 1303 N SER A 86 -13.283 16.144 -18.460 1.00 33.13 N ATOM 1304 CA SER A 86 -14.008 17.280 -19.017 1.00 35.24 C ATOM 1305 C SER A 86 -14.349 17.040 -20.484 1.00 51.13 C ATOM 1306 O SER A 86 -15.221 17.702 -21.047 1.00 74.33 O ATOM 1307 CB SER A 86 -13.181 18.559 -18.876 1.00 31.14 C ATOM 1308 OG SER A 86 -13.059 19.227 -20.119 1.00 61.14 O ATOM 0 H SER A 86 -12.272 16.272 -18.411 1.00 33.13 H new ATOM 0 HA SER A 86 -14.938 17.394 -18.460 1.00 35.24 H new ATOM 0 HB2 SER A 86 -13.651 19.221 -18.148 1.00 31.14 H new ATOM 0 HB3 SER A 86 -12.190 18.315 -18.492 1.00 31.14 H new ATOM 0 HG SER A 86 -12.528 20.042 -20.002 1.00 61.14 H new ATOM 1314 N VAL A 87 -13.654 16.088 -21.099 1.00 2.41 N ATOM 1315 CA VAL A 87 -13.882 15.759 -22.501 1.00 1.22 C ATOM 1316 C VAL A 87 -15.100 14.856 -22.662 1.00 42.52 C ATOM 1317 O VAL A 87 -15.825 14.945 -23.654 1.00 62.31 O ATOM 1318 CB VAL A 87 -12.655 15.064 -23.121 1.00 34.21 C ATOM 1319 CG1 VAL A 87 -12.699 15.157 -24.638 1.00 40.14 C ATOM 1320 CG2 VAL A 87 -11.370 15.669 -22.578 1.00 25.40 C ATOM 0 H VAL A 87 -12.928 15.531 -20.648 1.00 2.41 H new ATOM 0 HA VAL A 87 -14.059 16.700 -23.023 1.00 1.22 H new ATOM 0 HB VAL A 87 -12.678 14.010 -22.845 1.00 34.21 H new ATOM 0 HG11 VAL A 87 -11.824 14.661 -25.058 1.00 40.14 H new ATOM 0 HG12 VAL A 87 -13.603 14.672 -25.006 1.00 40.14 H new ATOM 0 HG13 VAL A 87 -12.701 16.205 -24.938 1.00 40.14 H new ATOM 0 HG21 VAL A 87 -10.513 15.166 -23.027 1.00 25.40 H new ATOM 0 HG22 VAL A 87 -11.336 16.731 -22.822 1.00 25.40 H new ATOM 0 HG23 VAL A 87 -11.338 15.544 -21.496 1.00 25.40 H new ATOM 1330 N LEU A 88 -15.320 13.989 -21.681 1.00 30.41 N ATOM 1331 CA LEU A 88 -16.452 13.068 -21.713 1.00 4.40 C ATOM 1332 C LEU A 88 -17.767 13.816 -21.523 1.00 53.42 C ATOM 1333 O LEU A 88 -18.801 13.425 -22.067 1.00 5.42 O ATOM 1334 CB LEU A 88 -16.297 12.001 -20.628 1.00 13.31 C ATOM 1335 CG LEU A 88 -14.962 11.257 -20.604 1.00 31.51 C ATOM 1336 CD1 LEU A 88 -14.625 10.811 -19.190 1.00 21.45 C ATOM 1337 CD2 LEU A 88 -15.000 10.063 -21.547 1.00 33.44 C ATOM 0 H LEU A 88 -14.730 13.904 -20.853 1.00 30.41 H new ATOM 0 HA LEU A 88 -16.468 12.584 -22.690 1.00 4.40 H new ATOM 0 HB2 LEU A 88 -16.444 12.475 -19.657 1.00 13.31 H new ATOM 0 HB3 LEU A 88 -17.096 11.269 -20.749 1.00 13.31 H new ATOM 0 HG LEU A 88 -14.182 11.938 -20.944 1.00 31.51 H new ATOM 0 HD11 LEU A 88 -13.671 10.283 -19.193 1.00 21.45 H new ATOM 0 HD12 LEU A 88 -14.555 11.683 -18.540 1.00 21.45 H new ATOM 0 HD13 LEU A 88 -15.407 10.146 -18.822 1.00 21.45 H new ATOM 0 HD21 LEU A 88 -14.041 9.545 -21.517 1.00 33.44 H new ATOM 0 HD22 LEU A 88 -15.791 9.380 -21.238 1.00 33.44 H new ATOM 0 HD23 LEU A 88 -15.195 10.408 -22.563 1.00 33.44 H new ATOM 1349 N LYS A 89 -17.722 14.896 -20.750 1.00 21.10 N ATOM 1350 CA LYS A 89 -18.909 15.702 -20.490 1.00 43.24 C ATOM 1351 C LYS A 89 -19.233 16.593 -21.685 1.00 74.24 C ATOM 1352 O LYS A 89 -20.399 16.878 -21.961 1.00 21.51 O ATOM 1353 CB LYS A 89 -18.703 16.562 -19.241 1.00 72.11 C ATOM 1354 CG LYS A 89 -19.964 17.270 -18.776 1.00 42.32 C ATOM 1355 CD LYS A 89 -20.974 16.291 -18.203 1.00 15.21 C ATOM 1356 CE LYS A 89 -22.142 16.075 -19.153 1.00 53.32 C ATOM 1357 NZ LYS A 89 -22.705 14.701 -19.037 1.00 51.42 N ATOM 0 H LYS A 89 -16.875 15.233 -20.292 1.00 21.10 H new ATOM 0 HA LYS A 89 -19.748 15.026 -20.324 1.00 43.24 H new ATOM 0 HB2 LYS A 89 -18.331 15.932 -18.433 1.00 72.11 H new ATOM 0 HB3 LYS A 89 -17.933 17.306 -19.445 1.00 72.11 H new ATOM 0 HG2 LYS A 89 -19.708 18.013 -18.021 1.00 42.32 H new ATOM 0 HG3 LYS A 89 -20.411 17.807 -19.613 1.00 42.32 H new ATOM 0 HD2 LYS A 89 -20.485 15.338 -18.003 1.00 15.21 H new ATOM 0 HD3 LYS A 89 -21.344 16.666 -17.249 1.00 15.21 H new ATOM 0 HE2 LYS A 89 -22.922 16.806 -18.941 1.00 53.32 H new ATOM 0 HE3 LYS A 89 -21.813 16.247 -20.178 1.00 53.32 H new ATOM 0 HZ1 LYS A 89 -23.550 14.620 -19.638 1.00 51.42 H new ATOM 0 HZ2 LYS A 89 -21.994 14.007 -19.345 1.00 51.42 H new ATOM 0 HZ3 LYS A 89 -22.965 14.515 -18.047 1.00 51.42 H new ATOM 1371 N SER A 90 -18.196 17.028 -22.392 1.00 44.45 N ATOM 1372 CA SER A 90 -18.371 17.889 -23.557 1.00 21.41 C ATOM 1373 C SER A 90 -18.593 17.058 -24.817 1.00 40.13 C ATOM 1374 O SER A 90 -19.114 17.553 -25.818 1.00 0.34 O ATOM 1375 CB SER A 90 -17.151 18.793 -23.737 1.00 44.52 C ATOM 1376 OG SER A 90 -17.310 20.011 -23.030 1.00 42.33 O ATOM 0 H SER A 90 -17.225 16.799 -22.179 1.00 44.45 H new ATOM 0 HA SER A 90 -19.252 18.509 -23.391 1.00 21.41 H new ATOM 0 HB2 SER A 90 -16.258 18.278 -23.384 1.00 44.52 H new ATOM 0 HB3 SER A 90 -17.002 19.001 -24.797 1.00 44.52 H new ATOM 0 HG SER A 90 -16.516 20.571 -23.160 1.00 42.33 H new ATOM 1382 N LEU A 91 -18.194 15.792 -24.762 1.00 12.23 N ATOM 1383 CA LEU A 91 -18.349 14.891 -25.898 1.00 60.41 C ATOM 1384 C LEU A 91 -19.774 14.353 -25.977 1.00 14.24 C ATOM 1385 O LEU A 91 -20.390 14.348 -27.043 1.00 14.40 O ATOM 1386 CB LEU A 91 -17.359 13.729 -25.792 1.00 11.34 C ATOM 1387 CG LEU A 91 -17.689 12.488 -26.621 1.00 34.45 C ATOM 1388 CD1 LEU A 91 -16.461 12.011 -27.380 1.00 72.40 C ATOM 1389 CD2 LEU A 91 -18.231 11.380 -25.729 1.00 30.30 C ATOM 0 H LEU A 91 -17.761 15.366 -23.943 1.00 12.23 H new ATOM 0 HA LEU A 91 -18.142 15.455 -26.807 1.00 60.41 H new ATOM 0 HB2 LEU A 91 -16.374 14.089 -26.090 1.00 11.34 H new ATOM 0 HB3 LEU A 91 -17.287 13.434 -24.745 1.00 11.34 H new ATOM 0 HG LEU A 91 -18.458 12.753 -27.346 1.00 34.45 H new ATOM 0 HD11 LEU A 91 -16.715 11.127 -27.964 1.00 72.40 H new ATOM 0 HD12 LEU A 91 -16.117 12.801 -28.048 1.00 72.40 H new ATOM 0 HD13 LEU A 91 -15.670 11.763 -26.673 1.00 72.40 H new ATOM 0 HD21 LEU A 91 -18.461 10.504 -26.336 1.00 30.30 H new ATOM 0 HD22 LEU A 91 -17.484 11.117 -24.980 1.00 30.30 H new ATOM 0 HD23 LEU A 91 -19.137 11.724 -25.231 1.00 30.30 H new ATOM 1401 N THR A 92 -20.295 13.902 -24.839 1.00 40.44 N ATOM 1402 CA THR A 92 -21.648 13.364 -24.779 1.00 1.14 C ATOM 1403 C THR A 92 -22.658 14.348 -25.358 1.00 2.34 C ATOM 1404 O THR A 92 -23.705 13.949 -25.865 1.00 53.42 O ATOM 1405 CB THR A 92 -22.052 13.023 -23.332 1.00 73.40 C ATOM 1406 OG1 THR A 92 -23.189 12.152 -23.334 1.00 30.14 O ATOM 1407 CG2 THR A 92 -22.376 14.286 -22.548 1.00 63.41 C ATOM 0 H THR A 92 -19.800 13.899 -23.947 1.00 40.44 H new ATOM 0 HA THR A 92 -21.652 12.451 -25.375 1.00 1.14 H new ATOM 0 HB THR A 92 -21.211 12.522 -22.852 1.00 73.40 H new ATOM 0 HG1 THR A 92 -22.901 11.238 -23.128 1.00 30.14 H new ATOM 0 HG21 THR A 92 -22.658 14.020 -21.530 1.00 63.41 H new ATOM 0 HG22 THR A 92 -21.500 14.934 -22.524 1.00 63.41 H new ATOM 0 HG23 THR A 92 -23.202 14.810 -23.028 1.00 63.41 H new ATOM 1415 N GLU A 93 -22.335 15.636 -25.278 1.00 72.54 N ATOM 1416 CA GLU A 93 -23.216 16.676 -25.795 1.00 40.34 C ATOM 1417 C GLU A 93 -23.566 16.416 -27.258 1.00 33.34 C ATOM 1418 O GLU A 93 -24.654 16.763 -27.719 1.00 44.11 O ATOM 1419 CB GLU A 93 -22.557 18.050 -25.655 1.00 24.25 C ATOM 1420 CG GLU A 93 -23.347 19.019 -24.791 1.00 60.14 C ATOM 1421 CD GLU A 93 -24.380 19.797 -25.584 1.00 24.13 C ATOM 1422 OE1 GLU A 93 -23.982 20.545 -26.502 1.00 31.24 O ATOM 1423 OE2 GLU A 93 -25.584 19.658 -25.286 1.00 53.51 O ATOM 0 H GLU A 93 -21.471 15.983 -24.861 1.00 72.54 H new ATOM 0 HA GLU A 93 -24.136 16.660 -25.210 1.00 40.34 H new ATOM 0 HB2 GLU A 93 -21.562 17.924 -25.228 1.00 24.25 H new ATOM 0 HB3 GLU A 93 -22.427 18.484 -26.646 1.00 24.25 H new ATOM 0 HG2 GLU A 93 -23.846 18.467 -23.995 1.00 60.14 H new ATOM 0 HG3 GLU A 93 -22.660 19.717 -24.313 1.00 60.14 H new ATOM 1430 N LYS A 94 -22.637 15.802 -27.982 1.00 60.01 N ATOM 1431 CA LYS A 94 -22.845 15.493 -29.392 1.00 14.12 C ATOM 1432 C LYS A 94 -23.619 14.189 -29.554 1.00 61.53 C ATOM 1433 O LYS A 94 -24.267 13.963 -30.577 1.00 32.40 O ATOM 1434 CB LYS A 94 -21.502 15.396 -30.118 1.00 23.42 C ATOM 1435 CG LYS A 94 -21.616 15.518 -31.627 1.00 42.44 C ATOM 1436 CD LYS A 94 -21.229 16.908 -32.105 1.00 12.24 C ATOM 1437 CE LYS A 94 -22.194 17.964 -31.586 1.00 24.11 C ATOM 1438 NZ LYS A 94 -21.703 19.344 -31.856 1.00 31.23 N ATOM 0 H LYS A 94 -21.732 15.508 -27.615 1.00 60.01 H new ATOM 0 HA LYS A 94 -23.431 16.300 -29.833 1.00 14.12 H new ATOM 0 HB2 LYS A 94 -20.841 16.179 -29.748 1.00 23.42 H new ATOM 0 HB3 LYS A 94 -21.034 14.442 -29.873 1.00 23.42 H new ATOM 0 HG2 LYS A 94 -20.974 14.777 -32.102 1.00 42.44 H new ATOM 0 HG3 LYS A 94 -22.638 15.298 -31.935 1.00 42.44 H new ATOM 0 HD2 LYS A 94 -20.218 17.141 -31.770 1.00 12.24 H new ATOM 0 HD3 LYS A 94 -21.216 16.929 -33.195 1.00 12.24 H new ATOM 0 HE2 LYS A 94 -23.169 17.827 -32.054 1.00 24.11 H new ATOM 0 HE3 LYS A 94 -22.335 17.832 -30.513 1.00 24.11 H new ATOM 0 HZ1 LYS A 94 -22.388 20.034 -31.487 1.00 31.23 H new ATOM 0 HZ2 LYS A 94 -20.785 19.484 -31.388 1.00 31.23 H new ATOM 0 HZ3 LYS A 94 -21.593 19.479 -32.881 1.00 31.23 H new ATOM 1452 N LEU A 95 -23.548 13.334 -28.540 1.00 63.30 N ATOM 1453 CA LEU A 95 -24.243 12.052 -28.570 1.00 30.52 C ATOM 1454 C LEU A 95 -25.700 12.213 -28.150 1.00 35.42 C ATOM 1455 O LEU A 95 -26.565 11.438 -28.560 1.00 15.24 O ATOM 1456 CB LEU A 95 -23.544 11.048 -27.651 1.00 45.31 C ATOM 1457 CG LEU A 95 -24.055 9.609 -27.716 1.00 33.22 C ATOM 1458 CD1 LEU A 95 -24.094 9.120 -29.155 1.00 40.24 C ATOM 1459 CD2 LEU A 95 -23.187 8.695 -26.864 1.00 4.14 C ATOM 0 H LEU A 95 -23.016 13.505 -27.687 1.00 63.30 H new ATOM 0 HA LEU A 95 -24.218 11.677 -29.593 1.00 30.52 H new ATOM 0 HB2 LEU A 95 -22.481 11.046 -27.891 1.00 45.31 H new ATOM 0 HB3 LEU A 95 -23.638 11.400 -26.624 1.00 45.31 H new ATOM 0 HG LEU A 95 -25.070 9.587 -27.319 1.00 33.22 H new ATOM 0 HD11 LEU A 95 -24.460 8.094 -29.181 1.00 40.24 H new ATOM 0 HD12 LEU A 95 -24.759 9.757 -29.738 1.00 40.24 H new ATOM 0 HD13 LEU A 95 -23.091 9.158 -29.579 1.00 40.24 H new ATOM 0 HD21 LEU A 95 -23.566 7.675 -26.923 1.00 4.14 H new ATOM 0 HD22 LEU A 95 -22.161 8.722 -27.230 1.00 4.14 H new ATOM 0 HD23 LEU A 95 -23.211 9.032 -25.828 1.00 4.14 H new ATOM 1471 N LYS A 96 -25.966 13.225 -27.331 1.00 75.12 N ATOM 1472 CA LYS A 96 -27.319 13.491 -26.858 1.00 15.34 C ATOM 1473 C LYS A 96 -28.233 13.886 -28.014 1.00 22.03 C ATOM 1474 O LYS A 96 -29.435 13.619 -27.988 1.00 44.43 O ATOM 1475 CB LYS A 96 -27.304 14.601 -25.804 1.00 41.32 C ATOM 1476 CG LYS A 96 -26.901 14.121 -24.421 1.00 3.33 C ATOM 1477 CD LYS A 96 -26.407 15.268 -23.555 1.00 23.04 C ATOM 1478 CE LYS A 96 -26.429 14.901 -22.079 1.00 14.54 C ATOM 1479 NZ LYS A 96 -27.815 14.884 -21.533 1.00 22.32 N ATOM 0 H LYS A 96 -25.262 13.875 -26.981 1.00 75.12 H new ATOM 0 HA LYS A 96 -27.706 12.576 -26.409 1.00 15.34 H new ATOM 0 HB2 LYS A 96 -26.616 15.384 -26.123 1.00 41.32 H new ATOM 0 HB3 LYS A 96 -28.295 15.051 -25.749 1.00 41.32 H new ATOM 0 HG2 LYS A 96 -27.752 13.641 -23.939 1.00 3.33 H new ATOM 0 HG3 LYS A 96 -26.118 13.368 -24.510 1.00 3.33 H new ATOM 0 HD2 LYS A 96 -25.392 15.537 -23.849 1.00 23.04 H new ATOM 0 HD3 LYS A 96 -27.031 16.146 -23.722 1.00 23.04 H new ATOM 0 HE2 LYS A 96 -25.972 13.921 -21.941 1.00 14.54 H new ATOM 0 HE3 LYS A 96 -25.826 15.615 -21.518 1.00 14.54 H new ATOM 0 HZ1 LYS A 96 -27.779 14.832 -20.495 1.00 22.32 H new ATOM 0 HZ2 LYS A 96 -28.312 15.752 -21.819 1.00 22.32 H new ATOM 0 HZ3 LYS A 96 -28.324 14.056 -21.903 1.00 22.32 H new ATOM 1493 N LYS A 97 -27.655 14.521 -29.028 1.00 13.43 N ATOM 1494 CA LYS A 97 -28.416 14.951 -30.195 1.00 61.42 C ATOM 1495 C LYS A 97 -28.898 13.749 -31.002 1.00 41.42 C ATOM 1496 O LYS A 97 -29.746 13.883 -31.885 1.00 41.11 O ATOM 1497 CB LYS A 97 -27.562 15.863 -31.079 1.00 22.51 C ATOM 1498 CG LYS A 97 -28.114 17.271 -31.212 1.00 40.23 C ATOM 1499 CD LYS A 97 -29.064 17.388 -32.392 1.00 41.35 C ATOM 1500 CE LYS A 97 -30.490 17.036 -31.997 1.00 42.22 C ATOM 1501 NZ LYS A 97 -31.019 17.956 -30.953 1.00 12.31 N ATOM 0 H LYS A 97 -26.662 14.749 -29.065 1.00 13.43 H new ATOM 0 HA LYS A 97 -29.287 15.506 -29.846 1.00 61.42 H new ATOM 0 HB2 LYS A 97 -26.554 15.914 -30.667 1.00 22.51 H new ATOM 0 HB3 LYS A 97 -27.479 15.419 -32.071 1.00 22.51 H new ATOM 0 HG2 LYS A 97 -28.635 17.547 -30.295 1.00 40.23 H new ATOM 0 HG3 LYS A 97 -27.291 17.975 -31.335 1.00 40.23 H new ATOM 0 HD2 LYS A 97 -29.035 18.404 -32.785 1.00 41.35 H new ATOM 0 HD3 LYS A 97 -28.734 16.727 -33.193 1.00 41.35 H new ATOM 0 HE2 LYS A 97 -31.132 17.078 -32.877 1.00 42.22 H new ATOM 0 HE3 LYS A 97 -30.522 16.011 -31.628 1.00 42.22 H new ATOM 0 HZ1 LYS A 97 -32.053 18.020 -31.039 1.00 12.31 H new ATOM 0 HZ2 LYS A 97 -30.772 17.591 -30.011 1.00 12.31 H new ATOM 0 HZ3 LYS A 97 -30.602 18.900 -31.079 1.00 12.31 H new ATOM 1515 N ILE A 98 -28.354 12.577 -30.693 1.00 5.52 N ATOM 1516 CA ILE A 98 -28.731 11.353 -31.388 1.00 3.11 C ATOM 1517 C ILE A 98 -30.244 11.166 -31.390 1.00 51.22 C ATOM 1518 O ILE A 98 -30.796 10.495 -32.262 1.00 34.11 O ATOM 1519 CB ILE A 98 -28.073 10.117 -30.747 1.00 70.43 C ATOM 1520 CG1 ILE A 98 -28.118 8.930 -31.712 1.00 55.24 C ATOM 1521 CG2 ILE A 98 -28.764 9.768 -29.438 1.00 32.24 C ATOM 1522 CD1 ILE A 98 -26.798 8.659 -32.399 1.00 53.02 C ATOM 0 H ILE A 98 -27.650 12.449 -29.966 1.00 5.52 H new ATOM 0 HA ILE A 98 -28.378 11.451 -32.415 1.00 3.11 H new ATOM 0 HB ILE A 98 -27.029 10.349 -30.534 1.00 70.43 H new ATOM 0 HG12 ILE A 98 -28.423 8.038 -31.164 1.00 55.24 H new ATOM 0 HG13 ILE A 98 -28.881 9.116 -32.468 1.00 55.24 H new ATOM 0 HG21 ILE A 98 -28.288 8.892 -28.997 1.00 32.24 H new ATOM 0 HG22 ILE A 98 -28.685 10.609 -28.749 1.00 32.24 H new ATOM 0 HG23 ILE A 98 -29.815 9.552 -29.628 1.00 32.24 H new ATOM 0 HD11 ILE A 98 -26.904 7.805 -33.068 1.00 53.02 H new ATOM 0 HD12 ILE A 98 -26.501 9.536 -32.975 1.00 53.02 H new ATOM 0 HD13 ILE A 98 -26.036 8.441 -31.650 1.00 53.02 H new ATOM 1534 N VAL A 99 -30.911 11.766 -30.409 1.00 5.31 N ATOM 1535 CA VAL A 99 -32.361 11.669 -30.299 1.00 31.23 C ATOM 1536 C VAL A 99 -33.044 12.196 -31.555 1.00 53.33 C ATOM 1537 O VAL A 99 -34.200 11.872 -31.828 1.00 24.14 O ATOM 1538 CB VAL A 99 -32.885 12.448 -29.077 1.00 62.35 C ATOM 1539 CG1 VAL A 99 -34.374 12.204 -28.887 1.00 30.53 C ATOM 1540 CG2 VAL A 99 -32.109 12.062 -27.827 1.00 44.23 C ATOM 0 H VAL A 99 -30.469 12.325 -29.679 1.00 5.31 H new ATOM 0 HA VAL A 99 -32.599 10.612 -30.176 1.00 31.23 H new ATOM 0 HB VAL A 99 -32.736 13.513 -29.255 1.00 62.35 H new ATOM 0 HG11 VAL A 99 -34.726 12.762 -28.020 1.00 30.53 H new ATOM 0 HG12 VAL A 99 -34.913 12.535 -29.775 1.00 30.53 H new ATOM 0 HG13 VAL A 99 -34.551 11.140 -28.730 1.00 30.53 H new ATOM 0 HG21 VAL A 99 -32.492 12.622 -26.974 1.00 44.23 H new ATOM 0 HG22 VAL A 99 -32.225 10.994 -27.642 1.00 44.23 H new ATOM 0 HG23 VAL A 99 -31.053 12.293 -27.968 1.00 44.23 H new ATOM 1550 N GLU A 100 -32.322 13.011 -32.318 1.00 24.03 N ATOM 1551 CA GLU A 100 -32.859 13.584 -33.546 1.00 73.32 C ATOM 1552 C GLU A 100 -32.626 12.649 -34.730 1.00 2.41 C ATOM 1553 O GLU A 100 -33.229 12.811 -35.792 1.00 31.15 O ATOM 1554 CB GLU A 100 -32.219 14.945 -33.823 1.00 41.52 C ATOM 1555 CG GLU A 100 -32.736 15.616 -35.085 1.00 64.31 C ATOM 1556 CD GLU A 100 -31.687 15.688 -36.178 1.00 54.14 C ATOM 1557 OE1 GLU A 100 -31.349 14.630 -36.748 1.00 73.31 O ATOM 1558 OE2 GLU A 100 -31.205 16.804 -36.464 1.00 53.32 O ATOM 0 H GLU A 100 -31.364 13.289 -32.107 1.00 24.03 H new ATOM 0 HA GLU A 100 -33.933 13.716 -33.415 1.00 73.32 H new ATOM 0 HB2 GLU A 100 -32.400 15.602 -32.972 1.00 41.52 H new ATOM 0 HB3 GLU A 100 -31.139 14.819 -33.905 1.00 41.52 H new ATOM 0 HG2 GLU A 100 -33.603 15.068 -35.454 1.00 64.31 H new ATOM 0 HG3 GLU A 100 -33.074 16.624 -34.844 1.00 64.31 H new ATOM 1565 N LEU A 101 -31.746 11.672 -34.540 1.00 10.31 N ATOM 1566 CA LEU A 101 -31.431 10.711 -35.591 1.00 52.12 C ATOM 1567 C LEU A 101 -32.213 9.416 -35.397 1.00 31.12 C ATOM 1568 O LEU A 101 -33.112 9.099 -36.177 1.00 1.15 O ATOM 1569 CB LEU A 101 -29.930 10.417 -35.608 1.00 33.35 C ATOM 1570 CG LEU A 101 -29.178 10.835 -36.871 1.00 61.23 C ATOM 1571 CD1 LEU A 101 -29.792 10.181 -38.099 1.00 71.22 C ATOM 1572 CD2 LEU A 101 -29.178 12.350 -37.015 1.00 60.34 C ATOM 0 H LEU A 101 -31.238 11.525 -33.668 1.00 10.31 H new ATOM 0 HA LEU A 101 -31.720 11.148 -36.547 1.00 52.12 H new ATOM 0 HB2 LEU A 101 -29.473 10.918 -34.755 1.00 33.35 H new ATOM 0 HB3 LEU A 101 -29.788 9.346 -35.463 1.00 33.35 H new ATOM 0 HG LEU A 101 -28.145 10.498 -36.784 1.00 61.23 H new ATOM 0 HD11 LEU A 101 -29.243 10.490 -38.989 1.00 71.22 H new ATOM 0 HD12 LEU A 101 -29.739 9.097 -37.999 1.00 71.22 H new ATOM 0 HD13 LEU A 101 -30.834 10.486 -38.191 1.00 71.22 H new ATOM 0 HD21 LEU A 101 -28.638 12.629 -37.920 1.00 60.34 H new ATOM 0 HD22 LEU A 101 -30.205 12.709 -37.080 1.00 60.34 H new ATOM 0 HD23 LEU A 101 -28.691 12.798 -36.149 1.00 60.34 H new ATOM 1584 N ILE A 102 -31.866 8.673 -34.351 1.00 71.23 N ATOM 1585 CA ILE A 102 -32.538 7.414 -34.053 1.00 2.11 C ATOM 1586 C ILE A 102 -32.909 7.326 -32.577 1.00 35.04 C ATOM 1587 O ILE A 102 -32.296 6.594 -31.799 1.00 52.41 O ATOM 1588 CB ILE A 102 -31.658 6.205 -34.422 1.00 51.23 C ATOM 1589 CG1 ILE A 102 -31.126 6.351 -35.849 1.00 42.23 C ATOM 1590 CG2 ILE A 102 -32.446 4.912 -34.275 1.00 10.12 C ATOM 1591 CD1 ILE A 102 -29.677 6.783 -35.913 1.00 34.23 C ATOM 0 H ILE A 102 -31.124 8.921 -33.696 1.00 71.23 H new ATOM 0 HA ILE A 102 -33.446 7.390 -34.656 1.00 2.11 H new ATOM 0 HB ILE A 102 -30.809 6.170 -33.739 1.00 51.23 H new ATOM 0 HG12 ILE A 102 -31.236 5.399 -36.368 1.00 42.23 H new ATOM 0 HG13 ILE A 102 -31.737 7.078 -36.383 1.00 42.23 H new ATOM 0 HG21 ILE A 102 -31.811 4.067 -34.539 1.00 10.12 H new ATOM 0 HG22 ILE A 102 -32.781 4.805 -33.243 1.00 10.12 H new ATOM 0 HG23 ILE A 102 -33.312 4.936 -34.937 1.00 10.12 H new ATOM 0 HD11 ILE A 102 -29.368 6.866 -36.955 1.00 34.23 H new ATOM 0 HD12 ILE A 102 -29.564 7.750 -35.423 1.00 34.23 H new ATOM 0 HD13 ILE A 102 -29.055 6.045 -35.407 1.00 34.23 H new ATOM 1603 N PRO A 103 -33.940 8.088 -32.179 1.00 63.53 N ATOM 1604 CA PRO A 103 -34.419 8.111 -30.794 1.00 44.30 C ATOM 1605 C PRO A 103 -35.101 6.808 -30.394 1.00 70.41 C ATOM 1606 O PRO A 103 -36.266 6.580 -30.720 1.00 40.33 O ATOM 1607 CB PRO A 103 -35.424 9.266 -30.786 1.00 61.50 C ATOM 1608 CG PRO A 103 -35.891 9.371 -32.197 1.00 33.54 C ATOM 1609 CD PRO A 103 -34.717 8.984 -33.052 1.00 23.30 C ATOM 0 HA PRO A 103 -33.602 8.233 -30.082 1.00 44.30 H new ATOM 0 HB2 PRO A 103 -36.254 9.064 -30.108 1.00 61.50 H new ATOM 0 HB3 PRO A 103 -34.959 10.194 -30.453 1.00 61.50 H new ATOM 0 HG2 PRO A 103 -36.739 8.711 -32.377 1.00 33.54 H new ATOM 0 HG3 PRO A 103 -36.222 10.384 -32.424 1.00 33.54 H new ATOM 0 HD2 PRO A 103 -35.034 8.480 -33.965 1.00 23.30 H new ATOM 0 HD3 PRO A 103 -34.135 9.855 -33.354 1.00 23.30 H new ATOM 1617 N SER A 104 -34.368 5.955 -29.686 1.00 33.54 N ATOM 1618 CA SER A 104 -34.902 4.672 -29.244 1.00 74.50 C ATOM 1619 C SER A 104 -36.229 4.858 -28.513 1.00 62.34 C ATOM 1620 O SER A 104 -37.296 4.559 -29.051 1.00 44.14 O ATOM 1621 CB SER A 104 -33.899 3.964 -28.331 1.00 10.41 C ATOM 1622 OG SER A 104 -33.052 4.898 -27.684 1.00 42.33 O ATOM 0 H SER A 104 -33.403 6.129 -29.406 1.00 33.54 H new ATOM 0 HA SER A 104 -35.076 4.056 -30.127 1.00 74.50 H new ATOM 0 HB2 SER A 104 -34.433 3.375 -27.585 1.00 10.41 H new ATOM 0 HB3 SER A 104 -33.298 3.268 -28.916 1.00 10.41 H new ATOM 0 HG SER A 104 -32.421 4.421 -27.105 1.00 42.33 H new ATOM 1628 N THR A 105 -36.154 5.354 -27.282 1.00 75.22 N ATOM 1629 CA THR A 105 -37.347 5.579 -26.476 1.00 13.33 C ATOM 1630 C THR A 105 -37.200 6.828 -25.613 1.00 70.52 C ATOM 1631 O THR A 105 -36.177 7.510 -25.662 1.00 2.11 O ATOM 1632 CB THR A 105 -37.647 4.373 -25.566 1.00 24.10 C ATOM 1633 OG1 THR A 105 -36.694 4.316 -24.498 1.00 51.13 O ATOM 1634 CG2 THR A 105 -37.606 3.075 -26.358 1.00 33.31 C ATOM 0 H THR A 105 -35.280 5.607 -26.822 1.00 75.22 H new ATOM 0 HA THR A 105 -38.176 5.715 -27.171 1.00 13.33 H new ATOM 0 HB THR A 105 -38.648 4.497 -25.153 1.00 24.10 H new ATOM 0 HG1 THR A 105 -36.957 3.618 -23.862 1.00 51.13 H new ATOM 0 HG21 THR A 105 -37.821 2.237 -25.695 1.00 33.31 H new ATOM 0 HG22 THR A 105 -38.352 3.110 -27.152 1.00 33.31 H new ATOM 0 HG23 THR A 105 -36.616 2.947 -26.795 1.00 33.31 H new ATOM 1642 N SER A 106 -38.228 7.120 -24.824 1.00 14.35 N ATOM 1643 CA SER A 106 -38.214 8.289 -23.952 1.00 12.13 C ATOM 1644 C SER A 106 -38.023 7.878 -22.495 1.00 20.00 C ATOM 1645 O SER A 106 -37.925 8.725 -21.607 1.00 64.02 O ATOM 1646 CB SER A 106 -39.514 9.081 -24.104 1.00 35.34 C ATOM 1647 OG SER A 106 -39.442 9.975 -25.200 1.00 42.32 O ATOM 0 H SER A 106 -39.081 6.564 -24.770 1.00 14.35 H new ATOM 0 HA SER A 106 -37.376 8.921 -24.246 1.00 12.13 H new ATOM 0 HB2 SER A 106 -40.348 8.393 -24.246 1.00 35.34 H new ATOM 0 HB3 SER A 106 -39.713 9.638 -23.189 1.00 35.34 H new ATOM 0 HG SER A 106 -40.286 10.468 -25.276 1.00 42.32 H new ATOM 1653 N SER A 107 -37.971 6.571 -22.257 1.00 55.24 N ATOM 1654 CA SER A 107 -37.796 6.046 -20.908 1.00 72.14 C ATOM 1655 C SER A 107 -36.375 5.528 -20.707 1.00 51.34 C ATOM 1656 O SER A 107 -35.827 5.600 -19.608 1.00 64.51 O ATOM 1657 CB SER A 107 -38.802 4.925 -20.640 1.00 71.22 C ATOM 1658 OG SER A 107 -40.063 5.450 -20.263 1.00 2.44 O ATOM 0 H SER A 107 -38.048 5.857 -22.981 1.00 55.24 H new ATOM 0 HA SER A 107 -37.971 6.858 -20.203 1.00 72.14 H new ATOM 0 HB2 SER A 107 -38.913 4.311 -21.533 1.00 71.22 H new ATOM 0 HB3 SER A 107 -38.425 4.275 -19.851 1.00 71.22 H new ATOM 0 HG SER A 107 -40.688 4.713 -20.099 1.00 2.44 H new ATOM 1664 N ALA A 108 -35.785 5.007 -21.778 1.00 40.21 N ATOM 1665 CA ALA A 108 -34.428 4.479 -21.721 1.00 45.21 C ATOM 1666 C ALA A 108 -33.398 5.601 -21.812 1.00 31.52 C ATOM 1667 O ALA A 108 -32.230 5.413 -21.472 1.00 43.22 O ATOM 1668 CB ALA A 108 -34.208 3.467 -22.836 1.00 22.14 C ATOM 0 H ALA A 108 -36.226 4.939 -22.695 1.00 40.21 H new ATOM 0 HA ALA A 108 -34.299 3.979 -20.761 1.00 45.21 H new ATOM 0 HB1 ALA A 108 -33.190 3.081 -22.781 1.00 22.14 H new ATOM 0 HB2 ALA A 108 -34.915 2.644 -22.725 1.00 22.14 H new ATOM 0 HB3 ALA A 108 -34.361 3.950 -23.801 1.00 22.14 H new ATOM 1674 N VAL A 109 -33.839 6.767 -22.273 1.00 31.33 N ATOM 1675 CA VAL A 109 -32.956 7.919 -22.408 1.00 22.22 C ATOM 1676 C VAL A 109 -32.208 8.193 -21.108 1.00 3.10 C ATOM 1677 O VAL A 109 -30.978 8.213 -21.063 1.00 25.20 O ATOM 1678 CB VAL A 109 -33.739 9.182 -22.813 1.00 64.20 C ATOM 1679 CG1 VAL A 109 -33.088 10.425 -22.225 1.00 74.12 C ATOM 1680 CG2 VAL A 109 -33.834 9.286 -24.328 1.00 33.33 C ATOM 0 H VAL A 109 -34.803 6.939 -22.559 1.00 31.33 H new ATOM 0 HA VAL A 109 -32.239 7.678 -23.193 1.00 22.22 H new ATOM 0 HB VAL A 109 -34.750 9.106 -22.412 1.00 64.20 H new ATOM 0 HG11 VAL A 109 -33.655 11.308 -22.522 1.00 74.12 H new ATOM 0 HG12 VAL A 109 -33.076 10.350 -21.138 1.00 74.12 H new ATOM 0 HG13 VAL A 109 -32.066 10.509 -22.594 1.00 74.12 H new ATOM 0 HG21 VAL A 109 -34.390 10.184 -24.597 1.00 33.33 H new ATOM 0 HG22 VAL A 109 -32.832 9.339 -24.753 1.00 33.33 H new ATOM 0 HG23 VAL A 109 -34.348 8.409 -24.721 1.00 33.33 H new ATOM 1690 N PRO A 110 -32.966 8.410 -20.023 1.00 73.32 N ATOM 1691 CA PRO A 110 -32.396 8.686 -18.701 1.00 74.41 C ATOM 1692 C PRO A 110 -31.711 7.464 -18.099 1.00 32.14 C ATOM 1693 O PRO A 110 -30.865 7.588 -17.212 1.00 43.04 O ATOM 1694 CB PRO A 110 -33.616 9.081 -17.865 1.00 1.42 C ATOM 1695 CG PRO A 110 -34.768 8.417 -18.536 1.00 63.25 C ATOM 1696 CD PRO A 110 -34.439 8.401 -20.004 1.00 3.23 C ATOM 0 HA PRO A 110 -31.623 9.454 -18.742 1.00 74.41 H new ATOM 0 HB2 PRO A 110 -33.513 8.747 -16.833 1.00 1.42 H new ATOM 0 HB3 PRO A 110 -33.744 10.163 -17.838 1.00 1.42 H new ATOM 0 HG2 PRO A 110 -34.910 7.405 -18.157 1.00 63.25 H new ATOM 0 HG3 PRO A 110 -35.694 8.960 -18.350 1.00 63.25 H new ATOM 0 HD2 PRO A 110 -34.842 7.516 -20.497 1.00 3.23 H new ATOM 0 HD3 PRO A 110 -34.853 9.268 -20.518 1.00 3.23 H new ATOM 1704 N LEU A 111 -32.081 6.284 -18.585 1.00 12.34 N ATOM 1705 CA LEU A 111 -31.501 5.039 -18.094 1.00 34.30 C ATOM 1706 C LEU A 111 -30.093 4.840 -18.644 1.00 4.11 C ATOM 1707 O LEU A 111 -29.129 4.730 -17.885 1.00 34.52 O ATOM 1708 CB LEU A 111 -32.386 3.853 -18.485 1.00 5.15 C ATOM 1709 CG LEU A 111 -32.454 2.706 -17.476 1.00 65.41 C ATOM 1710 CD1 LEU A 111 -33.670 1.833 -17.742 1.00 15.14 C ATOM 1711 CD2 LEU A 111 -31.179 1.876 -17.526 1.00 21.23 C ATOM 0 H LEU A 111 -32.780 6.163 -19.318 1.00 12.34 H new ATOM 0 HA LEU A 111 -31.441 5.098 -17.007 1.00 34.30 H new ATOM 0 HB2 LEU A 111 -33.398 4.221 -18.656 1.00 5.15 H new ATOM 0 HB3 LEU A 111 -32.027 3.455 -19.434 1.00 5.15 H new ATOM 0 HG LEU A 111 -32.549 3.131 -16.477 1.00 65.41 H new ATOM 0 HD11 LEU A 111 -33.702 1.022 -17.014 1.00 15.14 H new ATOM 0 HD12 LEU A 111 -34.575 2.434 -17.656 1.00 15.14 H new ATOM 0 HD13 LEU A 111 -33.606 1.416 -18.747 1.00 15.14 H new ATOM 0 HD21 LEU A 111 -31.245 1.064 -16.802 1.00 21.23 H new ATOM 0 HD22 LEU A 111 -31.054 1.461 -18.526 1.00 21.23 H new ATOM 0 HD23 LEU A 111 -30.324 2.508 -17.286 1.00 21.23 H new ATOM 1723 N ILE A 112 -29.980 4.798 -19.967 1.00 72.22 N ATOM 1724 CA ILE A 112 -28.689 4.616 -20.618 1.00 43.22 C ATOM 1725 C ILE A 112 -27.711 5.715 -20.215 1.00 63.42 C ATOM 1726 O ILE A 112 -26.497 5.515 -20.229 1.00 42.33 O ATOM 1727 CB ILE A 112 -28.828 4.606 -22.152 1.00 21.31 C ATOM 1728 CG1 ILE A 112 -27.593 3.970 -22.794 1.00 2.34 C ATOM 1729 CG2 ILE A 112 -29.035 6.019 -22.675 1.00 11.43 C ATOM 1730 CD1 ILE A 112 -27.823 3.501 -24.213 1.00 51.22 C ATOM 0 H ILE A 112 -30.767 4.888 -20.609 1.00 72.22 H new ATOM 0 HA ILE A 112 -28.304 3.651 -20.290 1.00 43.22 H new ATOM 0 HB ILE A 112 -29.701 4.010 -22.419 1.00 21.31 H new ATOM 0 HG12 ILE A 112 -26.777 4.693 -22.787 1.00 2.34 H new ATOM 0 HG13 ILE A 112 -27.274 3.123 -22.187 1.00 2.34 H new ATOM 0 HG21 ILE A 112 -29.131 5.995 -23.760 1.00 11.43 H new ATOM 0 HG22 ILE A 112 -29.942 6.439 -22.239 1.00 11.43 H new ATOM 0 HG23 ILE A 112 -28.180 6.637 -22.400 1.00 11.43 H new ATOM 0 HD11 ILE A 112 -26.905 3.061 -24.604 1.00 51.22 H new ATOM 0 HD12 ILE A 112 -28.617 2.754 -24.225 1.00 51.22 H new ATOM 0 HD13 ILE A 112 -28.112 4.349 -24.834 1.00 51.22 H new ATOM 1742 N GLY A 113 -28.249 6.876 -19.854 1.00 61.31 N ATOM 1743 CA GLY A 113 -27.410 7.989 -19.450 1.00 63.42 C ATOM 1744 C GLY A 113 -26.454 7.618 -18.334 1.00 3.44 C ATOM 1745 O GLY A 113 -25.347 8.152 -18.251 1.00 32.04 O ATOM 0 H GLY A 113 -29.251 7.066 -19.834 1.00 61.31 H new ATOM 0 HA2 GLY A 113 -26.841 8.342 -20.310 1.00 63.42 H new ATOM 0 HA3 GLY A 113 -28.041 8.816 -19.124 1.00 63.42 H new ATOM 1749 N LYS A 114 -26.881 6.703 -17.471 1.00 24.24 N ATOM 1750 CA LYS A 114 -26.056 6.261 -16.352 1.00 43.14 C ATOM 1751 C LYS A 114 -25.001 5.262 -16.816 1.00 25.00 C ATOM 1752 O LYS A 114 -23.859 5.291 -16.355 1.00 51.43 O ATOM 1753 CB LYS A 114 -26.929 5.629 -15.266 1.00 10.41 C ATOM 1754 CG LYS A 114 -26.148 5.175 -14.045 1.00 44.03 C ATOM 1755 CD LYS A 114 -26.730 3.903 -13.452 1.00 13.32 C ATOM 1756 CE LYS A 114 -26.321 2.676 -14.252 1.00 54.44 C ATOM 1757 NZ LYS A 114 -25.898 1.554 -13.370 1.00 42.10 N ATOM 0 H LYS A 114 -27.794 6.252 -17.525 1.00 24.24 H new ATOM 0 HA LYS A 114 -25.549 7.134 -15.940 1.00 43.14 H new ATOM 0 HB2 LYS A 114 -27.686 6.349 -14.955 1.00 10.41 H new ATOM 0 HB3 LYS A 114 -27.457 4.774 -15.688 1.00 10.41 H new ATOM 0 HG2 LYS A 114 -25.107 5.006 -14.320 1.00 44.03 H new ATOM 0 HG3 LYS A 114 -26.155 5.964 -13.293 1.00 44.03 H new ATOM 0 HD2 LYS A 114 -26.394 3.795 -12.421 1.00 13.32 H new ATOM 0 HD3 LYS A 114 -27.817 3.976 -13.427 1.00 13.32 H new ATOM 0 HE2 LYS A 114 -27.156 2.354 -14.874 1.00 54.44 H new ATOM 0 HE3 LYS A 114 -25.504 2.937 -14.925 1.00 54.44 H new ATOM 0 HZ1 LYS A 114 -25.627 0.737 -13.954 1.00 42.10 H new ATOM 0 HZ2 LYS A 114 -25.085 1.853 -12.794 1.00 42.10 H new ATOM 0 HZ3 LYS A 114 -26.686 1.287 -12.745 1.00 42.10 H new ATOM 1771 N TYR A 115 -25.389 4.380 -17.730 1.00 42.12 N ATOM 1772 CA TYR A 115 -24.476 3.372 -18.255 1.00 71.54 C ATOM 1773 C TYR A 115 -23.376 4.016 -19.093 1.00 24.12 C ATOM 1774 O TYR A 115 -22.189 3.807 -18.845 1.00 24.53 O ATOM 1775 CB TYR A 115 -25.242 2.350 -19.098 1.00 43.11 C ATOM 1776 CG TYR A 115 -25.622 1.100 -18.337 1.00 0.32 C ATOM 1777 CD1 TYR A 115 -24.662 0.161 -17.980 1.00 73.15 C ATOM 1778 CD2 TYR A 115 -26.941 0.859 -17.973 1.00 12.41 C ATOM 1779 CE1 TYR A 115 -25.006 -0.983 -17.286 1.00 4.43 C ATOM 1780 CE2 TYR A 115 -27.293 -0.281 -17.277 1.00 14.34 C ATOM 1781 CZ TYR A 115 -26.322 -1.199 -16.936 1.00 11.22 C ATOM 1782 OH TYR A 115 -26.668 -2.336 -16.242 1.00 61.04 O ATOM 0 H TYR A 115 -26.330 4.343 -18.123 1.00 42.12 H new ATOM 0 HA TYR A 115 -24.013 2.863 -17.410 1.00 71.54 H new ATOM 0 HB2 TYR A 115 -26.147 2.817 -19.487 1.00 43.11 H new ATOM 0 HB3 TYR A 115 -24.633 2.071 -19.958 1.00 43.11 H new ATOM 0 HD1 TYR A 115 -23.630 0.328 -18.250 1.00 73.15 H new ATOM 0 HD2 TYR A 115 -27.704 1.575 -18.239 1.00 12.41 H new ATOM 0 HE1 TYR A 115 -24.248 -1.704 -17.019 1.00 4.43 H new ATOM 0 HE2 TYR A 115 -28.323 -0.453 -17.001 1.00 14.34 H new ATOM 0 HH TYR A 115 -27.633 -2.335 -16.073 1.00 61.04 H new ATOM 1792 N MET A 116 -23.780 4.801 -20.086 1.00 1.32 N ATOM 1793 CA MET A 116 -22.829 5.478 -20.960 1.00 2.43 C ATOM 1794 C MET A 116 -21.819 6.281 -20.146 1.00 24.22 C ATOM 1795 O MET A 116 -20.644 6.368 -20.507 1.00 32.11 O ATOM 1796 CB MET A 116 -23.565 6.401 -21.933 1.00 12.12 C ATOM 1797 CG MET A 116 -24.458 7.422 -21.245 1.00 63.42 C ATOM 1798 SD MET A 116 -23.809 9.100 -21.359 1.00 52.12 S ATOM 1799 CE MET A 116 -25.199 9.950 -22.103 1.00 13.31 C ATOM 0 H MET A 116 -24.759 4.984 -20.306 1.00 1.32 H new ATOM 0 HA MET A 116 -22.291 4.718 -21.527 1.00 2.43 H new ATOM 0 HB2 MET A 116 -22.833 6.926 -22.547 1.00 12.12 H new ATOM 0 HB3 MET A 116 -24.171 5.796 -22.607 1.00 12.12 H new ATOM 0 HG2 MET A 116 -25.452 7.390 -21.692 1.00 63.42 H new ATOM 0 HG3 MET A 116 -24.572 7.151 -20.195 1.00 63.42 H new ATOM 0 HE1 MET A 116 -24.919 10.306 -23.094 1.00 13.31 H new ATOM 0 HE2 MET A 116 -26.042 9.264 -22.188 1.00 13.31 H new ATOM 0 HE3 MET A 116 -25.483 10.798 -21.480 1.00 13.31 H new ATOM 1809 N LEU A 117 -22.282 6.866 -19.047 1.00 30.53 N ATOM 1810 CA LEU A 117 -21.418 7.662 -18.181 1.00 75.44 C ATOM 1811 C LEU A 117 -20.582 6.765 -17.273 1.00 53.45 C ATOM 1812 O LEU A 117 -19.483 7.135 -16.860 1.00 50.23 O ATOM 1813 CB LEU A 117 -22.256 8.623 -17.337 1.00 35.24 C ATOM 1814 CG LEU A 117 -21.501 9.403 -16.260 1.00 13.10 C ATOM 1815 CD1 LEU A 117 -21.910 10.868 -16.277 1.00 32.24 C ATOM 1816 CD2 LEU A 117 -21.749 8.794 -14.888 1.00 24.14 C ATOM 0 H LEU A 117 -23.251 6.804 -18.734 1.00 30.53 H new ATOM 0 HA LEU A 117 -20.742 8.238 -18.813 1.00 75.44 H new ATOM 0 HB2 LEU A 117 -22.736 9.338 -18.005 1.00 35.24 H new ATOM 0 HB3 LEU A 117 -23.051 8.053 -16.855 1.00 35.24 H new ATOM 0 HG LEU A 117 -20.434 9.342 -16.475 1.00 13.10 H new ATOM 0 HD11 LEU A 117 -21.363 11.408 -15.504 1.00 32.24 H new ATOM 0 HD12 LEU A 117 -21.681 11.299 -17.252 1.00 32.24 H new ATOM 0 HD13 LEU A 117 -22.980 10.949 -16.087 1.00 32.24 H new ATOM 0 HD21 LEU A 117 -21.204 9.362 -14.134 1.00 24.14 H new ATOM 0 HD22 LEU A 117 -22.815 8.824 -14.664 1.00 24.14 H new ATOM 0 HD23 LEU A 117 -21.406 7.760 -14.882 1.00 24.14 H new ATOM 1828 N PHE A 118 -21.109 5.584 -16.968 1.00 55.42 N ATOM 1829 CA PHE A 118 -20.411 4.634 -16.110 1.00 53.22 C ATOM 1830 C PHE A 118 -18.992 4.389 -16.613 1.00 23.40 C ATOM 1831 O PHE A 118 -18.040 4.355 -15.832 1.00 13.23 O ATOM 1832 CB PHE A 118 -21.178 3.312 -16.048 1.00 33.32 C ATOM 1833 CG PHE A 118 -20.696 2.390 -14.964 1.00 73.25 C ATOM 1834 CD1 PHE A 118 -19.653 1.509 -15.199 1.00 45.42 C ATOM 1835 CD2 PHE A 118 -21.288 2.403 -13.711 1.00 44.24 C ATOM 1836 CE1 PHE A 118 -19.206 0.660 -14.204 1.00 73.13 C ATOM 1837 CE2 PHE A 118 -20.845 1.556 -12.713 1.00 14.44 C ATOM 1838 CZ PHE A 118 -19.804 0.683 -12.960 1.00 34.23 C ATOM 0 H PHE A 118 -22.017 5.262 -17.302 1.00 55.42 H new ATOM 0 HA PHE A 118 -20.354 5.060 -15.108 1.00 53.22 H new ATOM 0 HB2 PHE A 118 -22.236 3.522 -15.892 1.00 33.32 H new ATOM 0 HB3 PHE A 118 -21.092 2.806 -17.009 1.00 33.32 H new ATOM 0 HD1 PHE A 118 -19.184 1.485 -16.171 1.00 45.42 H new ATOM 0 HD2 PHE A 118 -22.104 3.082 -13.512 1.00 44.24 H new ATOM 0 HE1 PHE A 118 -18.390 -0.020 -14.399 1.00 73.13 H new ATOM 0 HE2 PHE A 118 -21.313 1.577 -11.740 1.00 14.44 H new ATOM 0 HZ PHE A 118 -19.458 0.019 -12.181 1.00 34.23 H new ATOM 1848 N THR A 119 -18.856 4.216 -17.924 1.00 51.43 N ATOM 1849 CA THR A 119 -17.554 3.972 -18.533 1.00 35.05 C ATOM 1850 C THR A 119 -16.694 5.230 -18.515 1.00 54.40 C ATOM 1851 O THR A 119 -15.470 5.157 -18.412 1.00 23.20 O ATOM 1852 CB THR A 119 -17.697 3.481 -19.986 1.00 3.23 C ATOM 1853 OG1 THR A 119 -18.690 2.453 -20.061 1.00 34.05 O ATOM 1854 CG2 THR A 119 -16.371 2.951 -20.510 1.00 43.10 C ATOM 0 H THR A 119 -19.632 4.240 -18.585 1.00 51.43 H new ATOM 0 HA THR A 119 -17.069 3.196 -17.941 1.00 35.05 H new ATOM 0 HB THR A 119 -18.003 4.326 -20.603 1.00 3.23 H new ATOM 0 HG1 THR A 119 -18.776 2.148 -20.988 1.00 34.05 H new ATOM 0 HG21 THR A 119 -16.496 2.610 -21.538 1.00 43.10 H new ATOM 0 HG22 THR A 119 -15.624 3.745 -20.479 1.00 43.10 H new ATOM 0 HG23 THR A 119 -16.041 2.118 -19.889 1.00 43.10 H new ATOM 1862 N LYS A 120 -17.343 6.386 -18.616 1.00 23.13 N ATOM 1863 CA LYS A 120 -16.638 7.662 -18.609 1.00 42.25 C ATOM 1864 C LYS A 120 -16.126 7.994 -17.211 1.00 50.45 C ATOM 1865 O LYS A 120 -15.116 8.680 -17.058 1.00 23.32 O ATOM 1866 CB LYS A 120 -17.559 8.779 -19.106 1.00 2.23 C ATOM 1867 CG LYS A 120 -18.157 8.511 -20.476 1.00 31.33 C ATOM 1868 CD LYS A 120 -19.176 9.572 -20.857 1.00 65.12 C ATOM 1869 CE LYS A 120 -19.131 9.878 -22.346 1.00 64.34 C ATOM 1870 NZ LYS A 120 -20.143 9.092 -23.105 1.00 22.32 N ATOM 0 H LYS A 120 -18.356 6.465 -18.704 1.00 23.13 H new ATOM 0 HA LYS A 120 -15.782 7.580 -19.279 1.00 42.25 H new ATOM 0 HB2 LYS A 120 -18.367 8.919 -18.388 1.00 2.23 H new ATOM 0 HB3 LYS A 120 -16.998 9.713 -19.140 1.00 2.23 H new ATOM 0 HG2 LYS A 120 -17.363 8.484 -21.222 1.00 31.33 H new ATOM 0 HG3 LYS A 120 -18.632 7.530 -20.481 1.00 31.33 H new ATOM 0 HD2 LYS A 120 -20.175 9.233 -20.584 1.00 65.12 H new ATOM 0 HD3 LYS A 120 -18.983 10.483 -20.291 1.00 65.12 H new ATOM 0 HE2 LYS A 120 -19.305 10.942 -22.503 1.00 64.34 H new ATOM 0 HE3 LYS A 120 -18.136 9.658 -22.732 1.00 64.34 H new ATOM 0 HZ1 LYS A 120 -20.080 9.329 -24.116 1.00 22.32 H new ATOM 0 HZ2 LYS A 120 -19.962 8.076 -22.976 1.00 22.32 H new ATOM 0 HZ3 LYS A 120 -21.095 9.321 -22.754 1.00 22.32 H new ATOM 1884 N GLU A 121 -16.829 7.503 -16.196 1.00 74.32 N ATOM 1885 CA GLU A 121 -16.444 7.748 -14.811 1.00 74.23 C ATOM 1886 C GLU A 121 -15.422 6.718 -14.340 1.00 61.44 C ATOM 1887 O GLU A 121 -14.647 6.972 -13.418 1.00 12.11 O ATOM 1888 CB GLU A 121 -17.675 7.713 -13.903 1.00 10.42 C ATOM 1889 CG GLU A 121 -17.621 8.721 -12.766 1.00 71.44 C ATOM 1890 CD GLU A 121 -18.543 8.355 -11.619 1.00 5.41 C ATOM 1891 OE1 GLU A 121 -19.738 8.104 -11.875 1.00 35.25 O ATOM 1892 OE2 GLU A 121 -18.067 8.321 -10.465 1.00 4.14 O ATOM 0 H GLU A 121 -17.668 6.933 -16.306 1.00 74.32 H new ATOM 0 HA GLU A 121 -15.989 8.737 -14.757 1.00 74.23 H new ATOM 0 HB2 GLU A 121 -18.565 7.902 -14.504 1.00 10.42 H new ATOM 0 HB3 GLU A 121 -17.780 6.712 -13.485 1.00 10.42 H new ATOM 0 HG2 GLU A 121 -16.598 8.792 -12.397 1.00 71.44 H new ATOM 0 HG3 GLU A 121 -17.892 9.706 -13.145 1.00 71.44 H new ATOM 1899 N PHE A 122 -15.426 5.553 -14.980 1.00 73.04 N ATOM 1900 CA PHE A 122 -14.501 4.483 -14.627 1.00 20.21 C ATOM 1901 C PHE A 122 -13.063 4.992 -14.606 1.00 43.22 C ATOM 1902 O PHE A 122 -12.233 4.512 -13.833 1.00 53.43 O ATOM 1903 CB PHE A 122 -14.629 3.322 -15.616 1.00 4.14 C ATOM 1904 CG PHE A 122 -14.518 1.970 -14.971 1.00 3.24 C ATOM 1905 CD1 PHE A 122 -13.279 1.445 -14.640 1.00 43.14 C ATOM 1906 CD2 PHE A 122 -15.652 1.225 -14.694 1.00 34.22 C ATOM 1907 CE1 PHE A 122 -13.174 0.201 -14.047 1.00 40.15 C ATOM 1908 CE2 PHE A 122 -15.554 -0.020 -14.101 1.00 1.24 C ATOM 1909 CZ PHE A 122 -14.313 -0.532 -13.776 1.00 41.31 C ATOM 0 H PHE A 122 -16.060 5.326 -15.746 1.00 73.04 H new ATOM 0 HA PHE A 122 -14.757 4.130 -13.628 1.00 20.21 H new ATOM 0 HB2 PHE A 122 -15.589 3.394 -16.127 1.00 4.14 H new ATOM 0 HB3 PHE A 122 -13.855 3.417 -16.378 1.00 4.14 H new ATOM 0 HD1 PHE A 122 -12.385 2.014 -14.848 1.00 43.14 H new ATOM 0 HD2 PHE A 122 -16.625 1.621 -14.944 1.00 34.22 H new ATOM 0 HE1 PHE A 122 -12.202 -0.198 -13.796 1.00 40.15 H new ATOM 0 HE2 PHE A 122 -16.446 -0.591 -13.892 1.00 1.24 H new ATOM 0 HZ PHE A 122 -14.233 -1.503 -13.311 1.00 41.31 H new ATOM 1919 N VAL A 123 -12.774 5.968 -15.462 1.00 33.40 N ATOM 1920 CA VAL A 123 -11.437 6.543 -15.543 1.00 13.44 C ATOM 1921 C VAL A 123 -10.946 6.986 -14.169 1.00 2.10 C ATOM 1922 O VAL A 123 -9.746 6.983 -13.898 1.00 64.41 O ATOM 1923 CB VAL A 123 -11.402 7.748 -16.501 1.00 40.52 C ATOM 1924 CG1 VAL A 123 -12.382 8.820 -16.049 1.00 32.14 C ATOM 1925 CG2 VAL A 123 -9.992 8.311 -16.598 1.00 22.14 C ATOM 0 H VAL A 123 -13.449 6.377 -16.109 1.00 33.40 H new ATOM 0 HA VAL A 123 -10.779 5.763 -15.927 1.00 13.44 H new ATOM 0 HB VAL A 123 -11.703 7.409 -17.492 1.00 40.52 H new ATOM 0 HG11 VAL A 123 -12.343 9.663 -16.739 1.00 32.14 H new ATOM 0 HG12 VAL A 123 -13.391 8.408 -16.036 1.00 32.14 H new ATOM 0 HG13 VAL A 123 -12.115 9.158 -15.047 1.00 32.14 H new ATOM 0 HG21 VAL A 123 -9.986 9.162 -17.279 1.00 22.14 H new ATOM 0 HG22 VAL A 123 -9.660 8.634 -15.611 1.00 22.14 H new ATOM 0 HG23 VAL A 123 -9.318 7.541 -16.973 1.00 22.14 H new ATOM 1935 N GLU A 124 -11.882 7.366 -13.306 1.00 15.34 N ATOM 1936 CA GLU A 124 -11.544 7.812 -11.959 1.00 44.12 C ATOM 1937 C GLU A 124 -10.747 6.743 -11.216 1.00 52.25 C ATOM 1938 O GLU A 124 -9.959 7.051 -10.323 1.00 24.43 O ATOM 1939 CB GLU A 124 -12.813 8.154 -11.176 1.00 73.35 C ATOM 1940 CG GLU A 124 -12.556 8.494 -9.718 1.00 51.11 C ATOM 1941 CD GLU A 124 -13.837 8.706 -8.934 1.00 24.20 C ATOM 1942 OE1 GLU A 124 -14.743 9.391 -9.453 1.00 70.41 O ATOM 1943 OE2 GLU A 124 -13.932 8.188 -7.802 1.00 74.40 O ATOM 0 H GLU A 124 -12.880 7.374 -13.515 1.00 15.34 H new ATOM 0 HA GLU A 124 -10.928 8.707 -12.045 1.00 44.12 H new ATOM 0 HB2 GLU A 124 -13.309 8.998 -11.655 1.00 73.35 H new ATOM 0 HB3 GLU A 124 -13.500 7.310 -11.228 1.00 73.35 H new ATOM 0 HG2 GLU A 124 -11.981 7.691 -9.257 1.00 51.11 H new ATOM 0 HG3 GLU A 124 -11.946 9.396 -9.661 1.00 51.11 H new ATOM 1950 N SER A 125 -10.960 5.486 -11.593 1.00 51.41 N ATOM 1951 CA SER A 125 -10.266 4.371 -10.961 1.00 30.24 C ATOM 1952 C SER A 125 -8.755 4.511 -11.118 1.00 51.44 C ATOM 1953 O SER A 125 -7.983 3.932 -10.354 1.00 14.52 O ATOM 1954 CB SER A 125 -10.732 3.044 -11.564 1.00 51.51 C ATOM 1955 OG SER A 125 -12.147 2.972 -11.606 1.00 3.40 O ATOM 0 H SER A 125 -11.608 5.215 -12.333 1.00 51.41 H new ATOM 0 HA SER A 125 -10.506 4.383 -9.898 1.00 30.24 H new ATOM 0 HB2 SER A 125 -10.329 2.937 -12.571 1.00 51.51 H new ATOM 0 HB3 SER A 125 -10.340 2.215 -10.974 1.00 51.51 H new ATOM 0 HG SER A 125 -12.475 3.443 -12.400 1.00 3.40 H new ATOM 1961 N SER A 126 -8.340 5.285 -12.117 1.00 31.24 N ATOM 1962 CA SER A 126 -6.922 5.499 -12.379 1.00 2.44 C ATOM 1963 C SER A 126 -6.278 6.306 -11.255 1.00 41.43 C ATOM 1964 O SER A 126 -5.060 6.278 -11.075 1.00 50.05 O ATOM 1965 CB SER A 126 -6.732 6.221 -13.714 1.00 43.21 C ATOM 1966 OG SER A 126 -5.372 6.564 -13.919 1.00 52.43 O ATOM 0 H SER A 126 -8.966 5.774 -12.757 1.00 31.24 H new ATOM 0 HA SER A 126 -6.435 4.525 -12.428 1.00 2.44 H new ATOM 0 HB2 SER A 126 -7.076 5.583 -14.528 1.00 43.21 H new ATOM 0 HB3 SER A 126 -7.345 7.122 -13.734 1.00 43.21 H new ATOM 0 HG SER A 126 -5.232 7.504 -13.681 1.00 52.43 H new ATOM 1972 N ILE A 127 -7.104 7.025 -10.503 1.00 33.12 N ATOM 1973 CA ILE A 127 -6.617 7.839 -9.397 1.00 24.05 C ATOM 1974 C ILE A 127 -6.352 6.986 -8.161 1.00 32.52 C ATOM 1975 O ILE A 127 -5.262 7.020 -7.590 1.00 63.23 O ATOM 1976 CB ILE A 127 -7.617 8.952 -9.033 1.00 43.42 C ATOM 1977 CG1 ILE A 127 -8.128 9.642 -10.300 1.00 32.32 C ATOM 1978 CG2 ILE A 127 -6.968 9.963 -8.099 1.00 31.21 C ATOM 1979 CD1 ILE A 127 -9.086 10.780 -10.024 1.00 22.32 C ATOM 0 H ILE A 127 -8.114 7.060 -10.640 1.00 33.12 H new ATOM 0 HA ILE A 127 -5.684 8.294 -9.729 1.00 24.05 H new ATOM 0 HB ILE A 127 -8.466 8.503 -8.518 1.00 43.42 H new ATOM 0 HG12 ILE A 127 -7.277 10.023 -10.865 1.00 32.32 H new ATOM 0 HG13 ILE A 127 -8.625 8.904 -10.930 1.00 32.32 H new ATOM 0 HG21 ILE A 127 -7.687 10.743 -7.851 1.00 31.21 H new ATOM 0 HG22 ILE A 127 -6.647 9.461 -7.186 1.00 31.21 H new ATOM 0 HG23 ILE A 127 -6.103 10.409 -8.590 1.00 31.21 H new ATOM 0 HD11 ILE A 127 -9.407 11.222 -10.967 1.00 22.32 H new ATOM 0 HD12 ILE A 127 -9.955 10.402 -9.486 1.00 22.32 H new ATOM 0 HD13 ILE A 127 -8.587 11.537 -9.420 1.00 22.32 H new ATOM 1991 N LYS A 128 -7.357 6.218 -7.752 1.00 52.24 N ATOM 1992 CA LYS A 128 -7.234 5.352 -6.586 1.00 51.00 C ATOM 1993 C LYS A 128 -6.009 4.451 -6.704 1.00 73.35 C ATOM 1994 O LYS A 128 -5.331 4.176 -5.714 1.00 13.01 O ATOM 1995 CB LYS A 128 -8.494 4.499 -6.423 1.00 53.23 C ATOM 1996 CG LYS A 128 -9.758 5.315 -6.214 1.00 11.23 C ATOM 1997 CD LYS A 128 -9.822 5.894 -4.810 1.00 44.33 C ATOM 1998 CE LYS A 128 -10.979 5.307 -4.017 1.00 1.31 C ATOM 1999 NZ LYS A 128 -10.584 4.983 -2.618 1.00 55.10 N ATOM 0 H LYS A 128 -8.267 6.178 -8.212 1.00 52.24 H new ATOM 0 HA LYS A 128 -7.115 5.984 -5.706 1.00 51.00 H new ATOM 0 HB2 LYS A 128 -8.617 3.875 -7.308 1.00 53.23 H new ATOM 0 HB3 LYS A 128 -8.361 3.827 -5.575 1.00 53.23 H new ATOM 0 HG2 LYS A 128 -9.795 6.124 -6.944 1.00 11.23 H new ATOM 0 HG3 LYS A 128 -10.631 4.687 -6.390 1.00 11.23 H new ATOM 0 HD2 LYS A 128 -8.885 5.695 -4.290 1.00 44.33 H new ATOM 0 HD3 LYS A 128 -9.931 6.977 -4.867 1.00 44.33 H new ATOM 0 HE2 LYS A 128 -11.808 6.015 -4.006 1.00 1.31 H new ATOM 0 HE3 LYS A 128 -11.337 4.404 -4.512 1.00 1.31 H new ATOM 0 HZ1 LYS A 128 -11.400 4.585 -2.110 1.00 55.10 H new ATOM 0 HZ2 LYS A 128 -9.810 4.288 -2.628 1.00 55.10 H new ATOM 0 HZ3 LYS A 128 -10.266 5.849 -2.138 1.00 55.10 H new ATOM 2013 N ILE A 129 -5.731 3.995 -7.921 1.00 51.02 N ATOM 2014 CA ILE A 129 -4.586 3.127 -8.168 1.00 54.12 C ATOM 2015 C ILE A 129 -3.275 3.859 -7.904 1.00 62.31 C ATOM 2016 O ILE A 129 -2.314 3.273 -7.404 1.00 3.53 O ATOM 2017 CB ILE A 129 -4.583 2.597 -9.614 1.00 54.12 C ATOM 2018 CG1 ILE A 129 -5.586 1.450 -9.762 1.00 45.43 C ATOM 2019 CG2 ILE A 129 -3.186 2.141 -10.008 1.00 55.13 C ATOM 2020 CD1 ILE A 129 -5.955 1.152 -11.199 1.00 10.45 C ATOM 0 H ILE A 129 -6.283 4.212 -8.751 1.00 51.02 H new ATOM 0 HA ILE A 129 -4.674 2.285 -7.481 1.00 54.12 H new ATOM 0 HB ILE A 129 -4.882 3.405 -10.282 1.00 54.12 H new ATOM 0 HG12 ILE A 129 -5.168 0.551 -9.309 1.00 45.43 H new ATOM 0 HG13 ILE A 129 -6.491 1.695 -9.206 1.00 45.43 H new ATOM 0 HG21 ILE A 129 -3.200 1.769 -11.032 1.00 55.13 H new ATOM 0 HG22 ILE A 129 -2.495 2.981 -9.936 1.00 55.13 H new ATOM 0 HG23 ILE A 129 -2.860 1.346 -9.338 1.00 55.13 H new ATOM 0 HD11 ILE A 129 -6.669 0.329 -11.228 1.00 10.45 H new ATOM 0 HD12 ILE A 129 -6.403 2.037 -11.651 1.00 10.45 H new ATOM 0 HD13 ILE A 129 -5.059 0.875 -11.755 1.00 10.45 H new ATOM 2032 N THR A 130 -3.242 5.144 -8.242 1.00 42.14 N ATOM 2033 CA THR A 130 -2.049 5.957 -8.042 1.00 21.15 C ATOM 2034 C THR A 130 -1.857 6.297 -6.568 1.00 52.30 C ATOM 2035 O THR A 130 -0.748 6.600 -6.131 1.00 45.55 O ATOM 2036 CB THR A 130 -2.116 7.264 -8.854 1.00 72.30 C ATOM 2037 OG1 THR A 130 -3.432 7.439 -9.392 1.00 24.00 O ATOM 2038 CG2 THR A 130 -1.098 7.251 -9.984 1.00 51.23 C ATOM 0 H THR A 130 -4.029 5.644 -8.656 1.00 42.14 H new ATOM 0 HA THR A 130 -1.202 5.366 -8.390 1.00 21.15 H new ATOM 0 HB THR A 130 -1.884 8.094 -8.186 1.00 72.30 H new ATOM 0 HG1 THR A 130 -3.578 6.795 -10.116 1.00 24.00 H new ATOM 0 HG21 THR A 130 -1.164 8.184 -10.544 1.00 51.23 H new ATOM 0 HG22 THR A 130 -0.095 7.146 -9.569 1.00 51.23 H new ATOM 0 HG23 THR A 130 -1.304 6.413 -10.650 1.00 51.23 H new ATOM 2046 N GLU A 131 -2.946 6.244 -5.807 1.00 3.24 N ATOM 2047 CA GLU A 131 -2.896 6.548 -4.381 1.00 64.33 C ATOM 2048 C GLU A 131 -1.951 5.594 -3.655 1.00 12.21 C ATOM 2049 O GLU A 131 -1.508 5.873 -2.541 1.00 61.23 O ATOM 2050 CB GLU A 131 -4.295 6.461 -3.769 1.00 53.22 C ATOM 2051 CG GLU A 131 -4.439 7.232 -2.468 1.00 13.31 C ATOM 2052 CD GLU A 131 -5.852 7.189 -1.918 1.00 4.44 C ATOM 2053 OE1 GLU A 131 -6.772 6.811 -2.672 1.00 42.52 O ATOM 2054 OE2 GLU A 131 -6.036 7.534 -0.731 1.00 71.23 O ATOM 0 H GLU A 131 -3.872 5.994 -6.153 1.00 3.24 H new ATOM 0 HA GLU A 131 -2.519 7.564 -4.265 1.00 64.33 H new ATOM 0 HB2 GLU A 131 -5.021 6.840 -4.488 1.00 53.22 H new ATOM 0 HB3 GLU A 131 -4.540 5.414 -3.590 1.00 53.22 H new ATOM 0 HG2 GLU A 131 -3.752 6.821 -1.728 1.00 13.31 H new ATOM 0 HG3 GLU A 131 -4.148 8.270 -2.631 1.00 13.31 H new ATOM 2061 N GLU A 132 -1.649 4.469 -4.294 1.00 60.43 N ATOM 2062 CA GLU A 132 -0.759 3.473 -3.708 1.00 43.44 C ATOM 2063 C GLU A 132 0.701 3.819 -3.986 1.00 65.13 C ATOM 2064 O GLU A 132 1.606 3.340 -3.301 1.00 54.43 O ATOM 2065 CB GLU A 132 -1.079 2.083 -4.260 1.00 21.51 C ATOM 2066 CG GLU A 132 -1.049 0.988 -3.206 1.00 43.22 C ATOM 2067 CD GLU A 132 -2.186 1.106 -2.210 1.00 70.33 C ATOM 2068 OE1 GLU A 132 -3.141 1.862 -2.487 1.00 63.25 O ATOM 2069 OE2 GLU A 132 -2.122 0.443 -1.154 1.00 64.53 O ATOM 0 H GLU A 132 -2.007 4.224 -5.217 1.00 60.43 H new ATOM 0 HA GLU A 132 -0.916 3.472 -2.629 1.00 43.44 H new ATOM 0 HB2 GLU A 132 -2.066 2.103 -4.723 1.00 21.51 H new ATOM 0 HB3 GLU A 132 -0.363 1.840 -5.045 1.00 21.51 H new ATOM 0 HG2 GLU A 132 -1.100 0.016 -3.696 1.00 43.22 H new ATOM 0 HG3 GLU A 132 -0.099 1.027 -2.673 1.00 43.22 H new ATOM 2076 N VAL A 133 0.924 4.653 -4.997 1.00 41.10 N ATOM 2077 CA VAL A 133 2.273 5.064 -5.366 1.00 65.13 C ATOM 2078 C VAL A 133 2.721 6.274 -4.554 1.00 63.21 C ATOM 2079 O VAL A 133 3.917 6.491 -4.353 1.00 15.00 O ATOM 2080 CB VAL A 133 2.366 5.403 -6.866 1.00 3.12 C ATOM 2081 CG1 VAL A 133 2.232 6.903 -7.084 1.00 22.54 C ATOM 2082 CG2 VAL A 133 3.673 4.886 -7.449 1.00 12.13 C ATOM 0 H VAL A 133 0.187 5.057 -5.575 1.00 41.10 H new ATOM 0 HA VAL A 133 2.930 4.222 -5.150 1.00 65.13 H new ATOM 0 HB VAL A 133 1.543 4.910 -7.384 1.00 3.12 H new ATOM 0 HG11 VAL A 133 2.300 7.123 -8.149 1.00 22.54 H new ATOM 0 HG12 VAL A 133 1.268 7.241 -6.704 1.00 22.54 H new ATOM 0 HG13 VAL A 133 3.032 7.421 -6.555 1.00 22.54 H new ATOM 0 HG21 VAL A 133 3.722 5.134 -8.509 1.00 12.13 H new ATOM 0 HG22 VAL A 133 4.512 5.349 -6.929 1.00 12.13 H new ATOM 0 HG23 VAL A 133 3.723 3.804 -7.327 1.00 12.13 H new ATOM 2092 N ILE A 134 1.755 7.058 -4.089 1.00 54.03 N ATOM 2093 CA ILE A 134 2.050 8.245 -3.297 1.00 54.51 C ATOM 2094 C ILE A 134 2.397 7.875 -1.859 1.00 72.22 C ATOM 2095 O ILE A 134 3.063 8.633 -1.156 1.00 65.30 O ATOM 2096 CB ILE A 134 0.863 9.227 -3.290 1.00 75.31 C ATOM 2097 CG1 ILE A 134 1.181 10.440 -2.415 1.00 1.53 C ATOM 2098 CG2 ILE A 134 -0.398 8.530 -2.800 1.00 61.32 C ATOM 2099 CD1 ILE A 134 2.491 11.111 -2.765 1.00 52.33 C ATOM 0 H ILE A 134 0.761 6.893 -4.247 1.00 54.03 H new ATOM 0 HA ILE A 134 2.909 8.729 -3.763 1.00 54.51 H new ATOM 0 HB ILE A 134 0.691 9.573 -4.309 1.00 75.31 H new ATOM 0 HG12 ILE A 134 0.374 11.167 -2.508 1.00 1.53 H new ATOM 0 HG13 ILE A 134 1.210 10.127 -1.371 1.00 1.53 H new ATOM 0 HG21 ILE A 134 -1.228 9.237 -2.801 1.00 61.32 H new ATOM 0 HG22 ILE A 134 -0.632 7.695 -3.460 1.00 61.32 H new ATOM 0 HG23 ILE A 134 -0.238 8.159 -1.788 1.00 61.32 H new ATOM 0 HD11 ILE A 134 2.651 11.963 -2.104 1.00 52.33 H new ATOM 0 HD12 ILE A 134 3.308 10.399 -2.644 1.00 52.33 H new ATOM 0 HD13 ILE A 134 2.459 11.455 -3.799 1.00 52.33 H new ATOM 2111 N ASN A 135 1.941 6.703 -1.430 1.00 31.44 N ATOM 2112 CA ASN A 135 2.204 6.230 -0.075 1.00 43.12 C ATOM 2113 C ASN A 135 3.578 5.573 0.014 1.00 21.50 C ATOM 2114 O ASN A 135 4.184 5.516 1.085 1.00 72.32 O ATOM 2115 CB ASN A 135 1.123 5.239 0.361 1.00 50.32 C ATOM 2116 CG ASN A 135 1.688 4.084 1.165 1.00 74.14 C ATOM 2117 OD1 ASN A 135 1.761 4.144 2.392 1.00 42.40 O ATOM 2118 ND2 ASN A 135 2.090 3.024 0.474 1.00 61.33 N ATOM 0 H ASN A 135 1.388 6.063 -2.000 1.00 31.44 H new ATOM 0 HA ASN A 135 2.188 7.091 0.593 1.00 43.12 H new ATOM 0 HB2 ASN A 135 0.374 5.761 0.957 1.00 50.32 H new ATOM 0 HB3 ASN A 135 0.614 4.850 -0.521 1.00 50.32 H new ATOM 0 HD21 ASN A 135 2.478 2.216 0.960 1.00 61.33 H new ATOM 0 HD22 ASN A 135 2.011 3.018 -0.543 1.00 61.33 H new ATOM 2125 N THR A 136 4.066 5.077 -1.119 1.00 74.41 N ATOM 2126 CA THR A 136 5.367 4.423 -1.170 1.00 20.43 C ATOM 2127 C THR A 136 6.454 5.394 -1.616 1.00 14.21 C ATOM 2128 O THR A 136 7.543 5.430 -1.042 1.00 34.21 O ATOM 2129 CB THR A 136 5.352 3.214 -2.124 1.00 74.22 C ATOM 2130 OG1 THR A 136 4.186 3.261 -2.955 1.00 65.33 O ATOM 2131 CG2 THR A 136 5.372 1.908 -1.344 1.00 70.01 C ATOM 0 H THR A 136 3.579 5.116 -2.014 1.00 74.41 H new ATOM 0 HA THR A 136 5.585 4.076 -0.160 1.00 20.43 H new ATOM 0 HB THR A 136 6.245 3.260 -2.747 1.00 74.22 H new ATOM 0 HG1 THR A 136 3.392 3.065 -2.415 1.00 65.33 H new ATOM 0 HG21 THR A 136 5.361 1.069 -2.039 1.00 70.01 H new ATOM 0 HG22 THR A 136 6.274 1.862 -0.734 1.00 70.01 H new ATOM 0 HG23 THR A 136 4.495 1.856 -0.699 1.00 70.01 H new ATOM 2139 N HIS A 137 6.151 6.182 -2.643 1.00 2.21 N ATOM 2140 CA HIS A 137 7.103 7.156 -3.165 1.00 51.24 C ATOM 2141 C HIS A 137 7.469 8.184 -2.099 1.00 24.21 C ATOM 2142 O HIS A 137 8.573 8.731 -2.102 1.00 73.14 O ATOM 2143 CB HIS A 137 6.522 7.861 -4.391 1.00 51.44 C ATOM 2144 CG HIS A 137 7.431 8.901 -4.971 1.00 71.01 C ATOM 2145 ND1 HIS A 137 8.791 8.720 -5.107 1.00 41.03 N ATOM 2146 CD2 HIS A 137 7.167 10.138 -5.453 1.00 4.11 C ATOM 2147 CE1 HIS A 137 9.325 9.801 -5.646 1.00 42.51 C ATOM 2148 NE2 HIS A 137 8.361 10.677 -5.866 1.00 50.00 N ATOM 0 H HIS A 137 5.255 6.165 -3.130 1.00 2.21 H new ATOM 0 HA HIS A 137 8.008 6.623 -3.456 1.00 51.24 H new ATOM 0 HB2 HIS A 137 6.300 7.117 -5.156 1.00 51.44 H new ATOM 0 HB3 HIS A 137 5.576 8.329 -4.117 1.00 51.44 H new ATOM 0 HD2 HIS A 137 6.198 10.613 -5.503 1.00 4.11 H new ATOM 0 HE1 HIS A 137 10.372 9.944 -5.869 1.00 42.51 H new ATOM 0 HE2 HIS A 137 8.483 11.603 -6.276 1.00 50.00 H new ATOM 2156 N HIS A 138 6.537 8.442 -1.187 1.00 51.14 N ATOM 2157 CA HIS A 138 6.762 9.404 -0.115 1.00 1.33 C ATOM 2158 C HIS A 138 7.638 8.802 0.980 1.00 15.23 C ATOM 2159 O HIS A 138 8.643 9.391 1.378 1.00 30.43 O ATOM 2160 CB HIS A 138 5.429 9.862 0.477 1.00 55.34 C ATOM 2161 CG HIS A 138 5.563 10.984 1.459 1.00 11.44 C ATOM 2162 ND1 HIS A 138 5.434 10.811 2.821 1.00 10.44 N ATOM 2163 CD2 HIS A 138 5.818 12.300 1.271 1.00 1.33 C ATOM 2164 CE1 HIS A 138 5.602 11.973 3.428 1.00 24.43 C ATOM 2165 NE2 HIS A 138 5.837 12.892 2.510 1.00 3.51 N ATOM 0 H HIS A 138 5.619 7.998 -1.169 1.00 51.14 H new ATOM 0 HA HIS A 138 7.279 10.266 -0.537 1.00 1.33 H new ATOM 0 HB2 HIS A 138 4.770 10.176 -0.333 1.00 55.34 H new ATOM 0 HB3 HIS A 138 4.949 9.016 0.968 1.00 55.34 H new ATOM 0 HD2 HIS A 138 5.977 12.793 0.323 1.00 1.33 H new ATOM 0 HE1 HIS A 138 5.555 12.142 4.494 1.00 24.43 H new ATOM 0 HE2 HIS A 138 6.005 13.881 2.692 1.00 3.51 H new ATOM 2173 N ARG A 139 7.248 7.627 1.463 1.00 31.04 N ATOM 2174 CA ARG A 139 7.996 6.947 2.514 1.00 61.45 C ATOM 2175 C ARG A 139 9.471 6.827 2.140 1.00 12.12 C ATOM 2176 O ARG A 139 10.317 7.542 2.677 1.00 41.14 O ATOM 2177 CB ARG A 139 7.409 5.557 2.769 1.00 64.03 C ATOM 2178 CG ARG A 139 6.347 5.535 3.856 1.00 62.44 C ATOM 2179 CD ARG A 139 5.277 4.493 3.568 1.00 42.15 C ATOM 2180 NE ARG A 139 5.275 3.421 4.560 1.00 42.53 N ATOM 2181 CZ ARG A 139 4.639 2.267 4.394 1.00 53.43 C ATOM 2182 NH1 ARG A 139 3.957 2.037 3.280 1.00 30.32 N ATOM 2183 NH2 ARG A 139 4.684 1.341 5.343 1.00 71.04 N ATOM 0 H ARG A 139 6.419 7.126 1.144 1.00 31.04 H new ATOM 0 HA ARG A 139 7.916 7.540 3.425 1.00 61.45 H new ATOM 0 HB2 ARG A 139 6.977 5.179 1.843 1.00 64.03 H new ATOM 0 HB3 ARG A 139 8.214 4.877 3.046 1.00 64.03 H new ATOM 0 HG2 ARG A 139 6.814 5.323 4.818 1.00 62.44 H new ATOM 0 HG3 ARG A 139 5.886 6.519 3.936 1.00 62.44 H new ATOM 0 HD2 ARG A 139 4.299 4.973 3.551 1.00 42.15 H new ATOM 0 HD3 ARG A 139 5.441 4.069 2.577 1.00 42.15 H new ATOM 0 HE ARG A 139 5.790 3.567 5.428 1.00 42.53 H new ATOM 0 HH11 ARG A 139 3.920 2.747 2.549 1.00 30.32 H new ATOM 0 HH12 ARG A 139 3.469 1.150 3.155 1.00 30.32 H new ATOM 0 HH21 ARG A 139 5.207 1.515 6.201 1.00 71.04 H new ATOM 0 HH22 ARG A 139 4.195 0.455 5.215 1.00 71.04 H new ATOM 2197 N SER A 140 9.771 5.918 1.218 1.00 53.32 N ATOM 2198 CA SER A 140 11.143 5.702 0.776 1.00 63.12 C ATOM 2199 C SER A 140 11.728 6.977 0.176 1.00 62.12 C ATOM 2200 O SER A 140 11.064 7.678 -0.586 1.00 34.24 O ATOM 2201 CB SER A 140 11.198 4.570 -0.252 1.00 21.55 C ATOM 2202 OG SER A 140 11.683 3.373 0.333 1.00 3.43 O ATOM 0 H SER A 140 9.082 5.319 0.763 1.00 53.32 H new ATOM 0 HA SER A 140 11.739 5.424 1.645 1.00 63.12 H new ATOM 0 HB2 SER A 140 10.203 4.400 -0.664 1.00 21.55 H new ATOM 0 HB3 SER A 140 11.842 4.860 -1.082 1.00 21.55 H new ATOM 0 HG SER A 140 11.707 2.665 -0.344 1.00 3.43 H new TER 2208 SER A 140