USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 996 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 308 HIS : no HD1:sc= -0.0094 X(o=1.2,f=1.2) USER MOD Set 1.2: B 312 SER OG : rot 65:sc= 1.22 USER MOD Set 2.1: A 72 GLN : amide:sc= -2.39! C(o=-2.4!,f=-7!) USER MOD Set 2.2: B 305 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 48 TYR OH : rot 30:sc= 1.72 USER MOD Set 3.2: A 56 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 36 LYS NZ :NH3+ -117:sc= 0.00419 (180deg=0) USER MOD Set 4.2: A 60 TYR OH : rot -145:sc= 1.31 USER MOD Single : A 3 ASN : amide:sc= -0.0282 X(o=-0.028,f=-0.028) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= 0.213 X(o=0.21,f=0) USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot -59:sc= 0.905 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0.00589 USER MOD Single : A 15 THR OG1 : rot 116:sc= 0.493 USER MOD Single : A 16 THR OG1 : rot 32:sc= 0.0177 USER MOD Single : A 17 SER OG : rot 109:sc= 1.12 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -0.0704 X(o=-0.07,f=-0.43) USER MOD Single : A 26 THR OG1 : rot -24:sc= 0.223 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 168:sc= 1.12 (180deg=0.564) USER MOD Single : A 40 SER OG : rot -88:sc= 0.928 USER MOD Single : A 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot -120:sc= -3.02! USER MOD Single : A 50 MET CE :methyl -163:sc= -1.18 (180deg=-2.18) USER MOD Single : A 51 LYS NZ :NH3+ 170:sc= 2.05 (180deg=1.65) USER MOD Single : A 59 GLN : amide:sc= 0.452 K(o=0.45,f=-0.12) USER MOD Single : A 62 MET CE :methyl 163:sc= -0.168 (180deg=-0.58) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -133:sc= 1.26 (180deg=0.861) USER MOD Single : A 71 GLN : amide:sc= -0.393 K(o=-0.39,f=-4.2!) USER MOD Single : A 73 HIS : no HD1:sc=-0.00361 X(o=-0.0036,f=0) USER MOD Single : A 76 TYR OH : rot -166:sc= 1.22 USER MOD Single : A 77 CYS SG : rot 19:sc= -4.73! USER MOD Single : A 78 SER OG : rot -57:sc= 1.22 USER MOD Single : A 79 ASN : amide:sc= -0.022 X(o=-0.022,f=-0.022) USER MOD Single : A 90 SER OG : rot -14:sc= 0.245 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -121:sc= 0.717 (180deg=-0.0286) USER MOD Single : A 96 HIS : no HD1:sc= -0.141 X(o=-0.14,f=-0.17) USER MOD Single : A 98 LYS NZ :NH3+ 177:sc= 1.3 (180deg=1.16) USER MOD Single : A 100 TYR OH : rot 57:sc= 1.31 USER MOD Single : A 101 THR OG1 : rot -162:sc= -2.16! USER MOD Single : A 102 MET CE :methyl 153:sc= -1.31 (180deg=-2.92) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= -0.195 K(o=-0.19,f=-5.5!) USER MOD Single : B 304 THR OG1 : rot 44:sc= 0.257 USER MOD Single : B 311 SER OG : rot 106:sc= 1.26 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 3 31.081 -26.482 3.960 1.00 1.00 N ATOM 2 CA ASN A 3 31.882 -27.152 2.943 1.00 64.21 C ATOM 3 C ASN A 3 33.320 -26.707 3.091 1.00 1.42 C ATOM 4 O ASN A 3 33.561 -25.591 3.540 1.00 73.22 O ATOM 5 CB ASN A 3 31.353 -26.822 1.541 1.00 71.21 C ATOM 6 CG ASN A 3 32.094 -27.551 0.438 1.00 24.41 C ATOM 7 OD1 ASN A 3 33.075 -27.050 -0.108 1.00 11.41 O ATOM 8 ND2 ASN A 3 31.650 -28.737 0.115 1.00 41.45 N ATOM 0 HA ASN A 3 31.819 -28.232 3.075 1.00 64.21 H new ATOM 0 HB2 ASN A 3 30.295 -27.077 1.489 1.00 71.21 H new ATOM 0 HB3 ASN A 3 31.430 -25.748 1.374 1.00 71.21 H new ATOM 0 HD21 ASN A 3 32.121 -29.277 -0.611 1.00 41.45 H new ATOM 0 HD22 ASN A 3 30.833 -29.122 0.589 1.00 41.45 H new ATOM 17 N THR A 4 34.262 -27.580 2.747 1.00 21.23 N ATOM 18 CA THR A 4 35.677 -27.307 2.871 1.00 20.42 C ATOM 19 C THR A 4 36.112 -26.077 2.054 1.00 62.42 C ATOM 20 O THR A 4 36.243 -26.134 0.822 1.00 2.41 O ATOM 21 CB THR A 4 36.498 -28.536 2.432 1.00 43.05 C ATOM 22 OG1 THR A 4 36.002 -29.704 3.117 1.00 52.05 O ATOM 23 CG2 THR A 4 37.984 -28.357 2.756 1.00 0.45 C ATOM 0 H THR A 4 34.055 -28.505 2.371 1.00 21.23 H new ATOM 0 HA THR A 4 35.867 -27.089 3.922 1.00 20.42 H new ATOM 0 HB THR A 4 36.394 -28.652 1.353 1.00 43.05 H new ATOM 0 HG1 THR A 4 36.519 -30.489 2.841 1.00 52.05 H new ATOM 0 HG21 THR A 4 38.536 -29.240 2.434 1.00 0.45 H new ATOM 0 HG22 THR A 4 38.367 -27.480 2.234 1.00 0.45 H new ATOM 0 HG23 THR A 4 38.109 -28.223 3.831 1.00 0.45 H new ATOM 31 N ASN A 5 36.267 -24.981 2.749 1.00 20.55 N ATOM 32 CA ASN A 5 36.786 -23.752 2.198 1.00 31.42 C ATOM 33 C ASN A 5 37.800 -23.234 3.157 1.00 64.24 C ATOM 34 O ASN A 5 37.677 -23.447 4.376 1.00 43.23 O ATOM 35 CB ASN A 5 35.696 -22.677 2.001 1.00 31.43 C ATOM 36 CG ASN A 5 34.700 -22.985 0.904 1.00 2.30 C ATOM 37 OD1 ASN A 5 34.911 -22.626 -0.266 1.00 54.43 O ATOM 38 ND2 ASN A 5 33.612 -23.617 1.254 1.00 40.12 N ATOM 0 H ASN A 5 36.031 -24.914 3.739 1.00 20.55 H new ATOM 0 HA ASN A 5 37.207 -23.963 1.215 1.00 31.42 H new ATOM 0 HB2 ASN A 5 35.156 -22.550 2.939 1.00 31.43 H new ATOM 0 HB3 ASN A 5 36.179 -21.725 1.779 1.00 31.43 H new ATOM 0 HD21 ASN A 5 32.900 -23.832 0.556 1.00 40.12 H new ATOM 0 HD22 ASN A 5 33.474 -23.896 2.225 1.00 40.12 H new ATOM 45 N MET A 6 38.804 -22.611 2.656 1.00 50.32 N ATOM 46 CA MET A 6 39.804 -22.034 3.508 1.00 55.35 C ATOM 47 C MET A 6 39.412 -20.603 3.773 1.00 55.10 C ATOM 48 O MET A 6 39.680 -20.047 4.839 1.00 33.22 O ATOM 49 CB MET A 6 41.184 -22.150 2.877 1.00 43.32 C ATOM 50 CG MET A 6 41.563 -23.588 2.537 1.00 31.30 C ATOM 51 SD MET A 6 41.592 -24.680 3.984 1.00 50.44 S ATOM 52 CE MET A 6 42.067 -26.234 3.225 1.00 54.43 C ATOM 0 H MET A 6 38.964 -22.482 1.657 1.00 50.32 H new ATOM 0 HA MET A 6 39.861 -22.570 4.455 1.00 55.35 H new ATOM 0 HB2 MET A 6 41.215 -21.547 1.969 1.00 43.32 H new ATOM 0 HB3 MET A 6 41.926 -21.736 3.560 1.00 43.32 H new ATOM 0 HG2 MET A 6 40.855 -23.981 1.808 1.00 31.30 H new ATOM 0 HG3 MET A 6 42.545 -23.596 2.064 1.00 31.30 H new ATOM 0 HE1 MET A 6 42.128 -27.009 3.989 1.00 54.43 H new ATOM 0 HE2 MET A 6 41.324 -26.517 2.480 1.00 54.43 H new ATOM 0 HE3 MET A 6 43.039 -26.122 2.744 1.00 54.43 H new ATOM 62 N SER A 7 38.708 -20.031 2.818 1.00 73.11 N ATOM 63 CA SER A 7 38.163 -18.721 2.964 1.00 53.24 C ATOM 64 C SER A 7 36.810 -18.819 3.675 1.00 5.33 C ATOM 65 O SER A 7 35.743 -18.878 3.043 1.00 12.05 O ATOM 66 CB SER A 7 38.057 -18.007 1.597 1.00 51.30 C ATOM 67 OG SER A 7 37.363 -18.808 0.627 1.00 14.32 O ATOM 0 H SER A 7 38.504 -20.472 1.921 1.00 73.11 H new ATOM 0 HA SER A 7 38.829 -18.112 3.575 1.00 53.24 H new ATOM 0 HB2 SER A 7 37.537 -17.057 1.723 1.00 51.30 H new ATOM 0 HB3 SER A 7 39.057 -17.777 1.229 1.00 51.30 H new ATOM 0 HG SER A 7 37.833 -19.660 0.510 1.00 14.32 H new ATOM 73 N VAL A 8 36.869 -18.947 4.982 1.00 21.31 N ATOM 74 CA VAL A 8 35.670 -19.058 5.770 1.00 5.42 C ATOM 75 C VAL A 8 34.947 -17.726 5.820 1.00 40.44 C ATOM 76 O VAL A 8 35.589 -16.663 5.851 1.00 42.14 O ATOM 77 CB VAL A 8 35.922 -19.603 7.207 1.00 10.22 C ATOM 78 CG1 VAL A 8 36.476 -21.018 7.152 1.00 74.14 C ATOM 79 CG2 VAL A 8 36.844 -18.689 8.010 1.00 45.33 C ATOM 0 H VAL A 8 37.736 -18.976 5.518 1.00 21.31 H new ATOM 0 HA VAL A 8 35.039 -19.795 5.273 1.00 5.42 H new ATOM 0 HB VAL A 8 34.962 -19.625 7.722 1.00 10.22 H new ATOM 0 HG11 VAL A 8 36.646 -21.382 8.165 1.00 74.14 H new ATOM 0 HG12 VAL A 8 35.762 -21.669 6.647 1.00 74.14 H new ATOM 0 HG13 VAL A 8 37.418 -21.019 6.604 1.00 74.14 H new ATOM 0 HG21 VAL A 8 36.993 -19.107 9.006 1.00 45.33 H new ATOM 0 HG22 VAL A 8 37.806 -18.606 7.503 1.00 45.33 H new ATOM 0 HG23 VAL A 8 36.393 -17.701 8.095 1.00 45.33 H new ATOM 89 N PRO A 9 33.620 -17.749 5.795 1.00 74.40 N ATOM 90 CA PRO A 9 32.836 -16.544 5.805 1.00 52.31 C ATOM 91 C PRO A 9 32.856 -15.843 7.164 1.00 2.24 C ATOM 92 O PRO A 9 32.110 -16.202 8.088 1.00 32.11 O ATOM 93 CB PRO A 9 31.420 -16.999 5.427 1.00 13.22 C ATOM 94 CG PRO A 9 31.364 -18.453 5.771 1.00 22.03 C ATOM 95 CD PRO A 9 32.782 -18.969 5.745 1.00 41.32 C ATOM 0 HA PRO A 9 33.234 -15.805 5.110 1.00 52.31 H new ATOM 0 HB2 PRO A 9 30.666 -16.436 5.978 1.00 13.22 H new ATOM 0 HB3 PRO A 9 31.226 -16.839 4.366 1.00 13.22 H new ATOM 0 HG2 PRO A 9 30.919 -18.599 6.755 1.00 22.03 H new ATOM 0 HG3 PRO A 9 30.744 -18.994 5.057 1.00 22.03 H new ATOM 0 HD2 PRO A 9 32.982 -19.623 6.593 1.00 41.32 H new ATOM 0 HD3 PRO A 9 32.977 -19.548 4.843 1.00 41.32 H new ATOM 103 N THR A 10 33.778 -14.915 7.317 1.00 55.24 N ATOM 104 CA THR A 10 33.818 -14.079 8.488 1.00 33.05 C ATOM 105 C THR A 10 32.668 -13.094 8.370 1.00 33.12 C ATOM 106 O THR A 10 31.994 -12.749 9.343 1.00 40.24 O ATOM 107 CB THR A 10 35.177 -13.361 8.599 1.00 53.43 C ATOM 108 OG1 THR A 10 35.500 -12.734 7.350 1.00 13.43 O ATOM 109 CG2 THR A 10 36.279 -14.345 8.970 1.00 1.43 C ATOM 0 H THR A 10 34.513 -14.724 6.636 1.00 55.24 H new ATOM 0 HA THR A 10 33.710 -14.671 9.397 1.00 33.05 H new ATOM 0 HB THR A 10 35.102 -12.606 9.381 1.00 53.43 H new ATOM 0 HG1 THR A 10 36.364 -12.278 7.427 1.00 13.43 H new ATOM 0 HG21 THR A 10 37.229 -13.816 9.043 1.00 1.43 H new ATOM 0 HG22 THR A 10 36.046 -14.807 9.929 1.00 1.43 H new ATOM 0 HG23 THR A 10 36.351 -15.117 8.204 1.00 1.43 H new ATOM 117 N ASP A 11 32.448 -12.679 7.146 1.00 22.24 N ATOM 118 CA ASP A 11 31.283 -11.945 6.767 1.00 52.52 C ATOM 119 C ASP A 11 30.417 -12.951 6.113 1.00 21.43 C ATOM 120 O ASP A 11 30.790 -13.512 5.073 1.00 1.43 O ATOM 121 CB ASP A 11 31.612 -10.888 5.758 1.00 60.33 C ATOM 122 CG ASP A 11 30.426 -10.019 5.421 1.00 32.54 C ATOM 123 OD1 ASP A 11 30.048 -9.182 6.256 1.00 11.52 O ATOM 124 OD2 ASP A 11 29.862 -10.143 4.302 1.00 72.40 O ATOM 0 H ASP A 11 33.093 -12.850 6.375 1.00 22.24 H new ATOM 0 HA ASP A 11 30.828 -11.452 7.626 1.00 52.52 H new ATOM 0 HB2 ASP A 11 32.418 -10.263 6.142 1.00 60.33 H new ATOM 0 HB3 ASP A 11 31.981 -11.362 4.848 1.00 60.33 H new ATOM 129 N GLY A 12 29.339 -13.236 6.701 1.00 24.21 N ATOM 130 CA GLY A 12 28.537 -14.276 6.205 1.00 13.41 C ATOM 131 C GLY A 12 27.355 -13.794 5.451 1.00 44.33 C ATOM 132 O GLY A 12 27.072 -12.582 5.397 1.00 44.55 O ATOM 0 H GLY A 12 28.982 -12.765 7.533 1.00 24.21 H new ATOM 0 HA2 GLY A 12 29.139 -14.912 5.556 1.00 13.41 H new ATOM 0 HA3 GLY A 12 28.201 -14.895 7.037 1.00 13.41 H new ATOM 136 N ALA A 13 26.656 -14.717 4.861 1.00 25.35 N ATOM 137 CA ALA A 13 25.495 -14.409 4.105 1.00 53.32 C ATOM 138 C ALA A 13 24.305 -14.242 5.017 1.00 12.11 C ATOM 139 O ALA A 13 23.590 -15.198 5.306 1.00 52.51 O ATOM 140 CB ALA A 13 25.227 -15.475 3.055 1.00 34.21 C ATOM 0 H ALA A 13 26.883 -15.711 4.895 1.00 25.35 H new ATOM 0 HA ALA A 13 25.667 -13.467 3.584 1.00 53.32 H new ATOM 0 HB1 ALA A 13 24.332 -15.213 2.491 1.00 34.21 H new ATOM 0 HB2 ALA A 13 26.078 -15.539 2.376 1.00 34.21 H new ATOM 0 HB3 ALA A 13 25.079 -16.438 3.544 1.00 34.21 H new ATOM 146 N VAL A 14 24.150 -13.041 5.548 1.00 54.25 N ATOM 147 CA VAL A 14 22.989 -12.723 6.360 1.00 44.45 C ATOM 148 C VAL A 14 21.759 -12.689 5.452 1.00 64.41 C ATOM 149 O VAL A 14 20.641 -13.005 5.859 1.00 53.45 O ATOM 150 CB VAL A 14 23.162 -11.397 7.170 1.00 44.03 C ATOM 151 CG1 VAL A 14 24.312 -11.532 8.157 1.00 13.21 C ATOM 152 CG2 VAL A 14 23.402 -10.204 6.262 1.00 42.41 C ATOM 0 H VAL A 14 24.811 -12.273 5.432 1.00 54.25 H new ATOM 0 HA VAL A 14 22.863 -13.498 7.116 1.00 44.45 H new ATOM 0 HB VAL A 14 22.232 -11.222 7.711 1.00 44.03 H new ATOM 0 HG11 VAL A 14 24.423 -10.603 8.715 1.00 13.21 H new ATOM 0 HG12 VAL A 14 24.104 -12.348 8.849 1.00 13.21 H new ATOM 0 HG13 VAL A 14 25.234 -11.742 7.615 1.00 13.21 H new ATOM 0 HG21 VAL A 14 23.517 -9.304 6.866 1.00 42.41 H new ATOM 0 HG22 VAL A 14 24.308 -10.367 5.679 1.00 42.41 H new ATOM 0 HG23 VAL A 14 22.554 -10.083 5.588 1.00 42.41 H new ATOM 162 N THR A 15 22.004 -12.302 4.227 1.00 62.35 N ATOM 163 CA THR A 15 21.075 -12.405 3.150 1.00 70.21 C ATOM 164 C THR A 15 21.827 -13.110 2.027 1.00 24.34 C ATOM 165 O THR A 15 21.612 -14.284 1.757 1.00 4.22 O ATOM 166 CB THR A 15 20.569 -11.012 2.704 1.00 71.00 C ATOM 167 OG1 THR A 15 21.691 -10.108 2.565 1.00 53.52 O ATOM 168 CG2 THR A 15 19.575 -10.447 3.707 1.00 33.25 C ATOM 0 H THR A 15 22.895 -11.891 3.949 1.00 62.35 H new ATOM 0 HA THR A 15 20.184 -12.960 3.444 1.00 70.21 H new ATOM 0 HB THR A 15 20.064 -11.120 1.744 1.00 71.00 H new ATOM 0 HG1 THR A 15 21.775 -9.833 1.628 1.00 53.52 H new ATOM 0 HG21 THR A 15 19.235 -9.468 3.370 1.00 33.25 H new ATOM 0 HG22 THR A 15 18.721 -11.119 3.791 1.00 33.25 H new ATOM 0 HG23 THR A 15 20.056 -10.349 4.680 1.00 33.25 H new ATOM 176 N THR A 16 22.758 -12.390 1.446 1.00 34.01 N ATOM 177 CA THR A 16 23.704 -12.902 0.485 1.00 62.33 C ATOM 178 C THR A 16 25.008 -12.118 0.667 1.00 62.33 C ATOM 179 O THR A 16 24.969 -10.887 0.805 1.00 4.14 O ATOM 180 CB THR A 16 23.201 -12.749 -0.994 1.00 32.31 C ATOM 181 OG1 THR A 16 22.759 -11.403 -1.250 1.00 45.44 O ATOM 182 CG2 THR A 16 22.088 -13.733 -1.338 1.00 52.43 C ATOM 0 H THR A 16 22.881 -11.396 1.637 1.00 34.01 H new ATOM 0 HA THR A 16 23.843 -13.969 0.659 1.00 62.33 H new ATOM 0 HB THR A 16 24.053 -12.977 -1.635 1.00 32.31 H new ATOM 0 HG1 THR A 16 23.283 -10.778 -0.707 1.00 45.44 H new ATOM 0 HG21 THR A 16 21.777 -13.584 -2.372 1.00 52.43 H new ATOM 0 HG22 THR A 16 22.452 -14.753 -1.212 1.00 52.43 H new ATOM 0 HG23 THR A 16 21.238 -13.567 -0.676 1.00 52.43 H new ATOM 190 N SER A 17 26.127 -12.794 0.757 1.00 53.04 N ATOM 191 CA SER A 17 27.384 -12.100 0.856 1.00 52.10 C ATOM 192 C SER A 17 28.068 -12.231 -0.482 1.00 61.15 C ATOM 193 O SER A 17 28.596 -13.298 -0.838 1.00 12.35 O ATOM 194 CB SER A 17 28.266 -12.629 2.011 1.00 13.42 C ATOM 195 OG SER A 17 29.444 -11.831 2.179 1.00 72.44 O ATOM 0 H SER A 17 26.192 -13.812 0.764 1.00 53.04 H new ATOM 0 HA SER A 17 27.211 -11.051 1.097 1.00 52.10 H new ATOM 0 HB2 SER A 17 27.692 -12.631 2.937 1.00 13.42 H new ATOM 0 HB3 SER A 17 28.550 -13.662 1.810 1.00 13.42 H new ATOM 0 HG SER A 17 29.370 -11.309 3.005 1.00 72.44 H new ATOM 201 N GLN A 18 27.997 -11.176 -1.234 1.00 32.21 N ATOM 202 CA GLN A 18 28.488 -11.142 -2.578 1.00 74.22 C ATOM 203 C GLN A 18 29.974 -10.905 -2.572 1.00 44.22 C ATOM 204 O GLN A 18 30.479 -10.096 -1.784 1.00 45.43 O ATOM 205 CB GLN A 18 27.800 -10.018 -3.335 1.00 3.15 C ATOM 206 CG GLN A 18 26.286 -10.097 -3.315 1.00 61.15 C ATOM 207 CD GLN A 18 25.652 -8.895 -3.964 1.00 34.22 C ATOM 208 OE1 GLN A 18 25.387 -7.890 -3.306 1.00 45.24 O ATOM 209 NE2 GLN A 18 25.399 -8.976 -5.232 1.00 0.13 N ATOM 0 H GLN A 18 27.587 -10.295 -0.924 1.00 32.21 H new ATOM 0 HA GLN A 18 28.279 -12.095 -3.064 1.00 74.22 H new ATOM 0 HB2 GLN A 18 28.109 -9.064 -2.908 1.00 3.15 H new ATOM 0 HB3 GLN A 18 28.140 -10.030 -4.370 1.00 3.15 H new ATOM 0 HG2 GLN A 18 25.963 -11.001 -3.831 1.00 61.15 H new ATOM 0 HG3 GLN A 18 25.940 -10.178 -2.284 1.00 61.15 H new ATOM 0 HE21 GLN A 18 25.633 -9.826 -5.745 1.00 0.13 H new ATOM 0 HE22 GLN A 18 24.966 -8.190 -5.717 1.00 0.13 H new ATOM 218 N ILE A 19 30.671 -11.622 -3.394 1.00 44.01 N ATOM 219 CA ILE A 19 32.083 -11.439 -3.529 1.00 23.43 C ATOM 220 C ILE A 19 32.362 -11.123 -4.993 1.00 41.50 C ATOM 221 O ILE A 19 31.897 -11.847 -5.876 1.00 14.42 O ATOM 222 CB ILE A 19 32.895 -12.696 -3.078 1.00 12.45 C ATOM 223 CG1 ILE A 19 32.544 -13.089 -1.629 1.00 22.44 C ATOM 224 CG2 ILE A 19 34.386 -12.422 -3.181 1.00 51.15 C ATOM 225 CD1 ILE A 19 33.331 -14.273 -1.095 1.00 62.31 C ATOM 0 H ILE A 19 30.279 -12.351 -3.991 1.00 44.01 H new ATOM 0 HA ILE A 19 32.403 -10.624 -2.879 1.00 23.43 H new ATOM 0 HB ILE A 19 32.630 -13.522 -3.738 1.00 12.45 H new ATOM 0 HG12 ILE A 19 32.717 -12.230 -0.980 1.00 22.44 H new ATOM 0 HG13 ILE A 19 31.480 -13.321 -1.575 1.00 22.44 H new ATOM 0 HG21 ILE A 19 34.941 -13.305 -2.864 1.00 51.15 H new ATOM 0 HG22 ILE A 19 34.642 -12.184 -4.213 1.00 51.15 H new ATOM 0 HG23 ILE A 19 34.646 -11.580 -2.539 1.00 51.15 H new ATOM 0 HD11 ILE A 19 33.023 -14.483 -0.071 1.00 62.31 H new ATOM 0 HD12 ILE A 19 33.140 -15.147 -1.717 1.00 62.31 H new ATOM 0 HD13 ILE A 19 34.396 -14.040 -1.113 1.00 62.31 H new ATOM 237 N PRO A 20 33.120 -10.034 -5.278 1.00 42.12 N ATOM 238 CA PRO A 20 33.388 -9.555 -6.659 1.00 24.14 C ATOM 239 C PRO A 20 34.150 -10.545 -7.514 1.00 41.43 C ATOM 240 O PRO A 20 34.173 -10.463 -8.736 1.00 54.35 O ATOM 241 CB PRO A 20 34.194 -8.275 -6.450 1.00 53.30 C ATOM 242 CG PRO A 20 34.762 -8.391 -5.076 1.00 1.42 C ATOM 243 CD PRO A 20 33.751 -9.153 -4.273 1.00 14.14 C ATOM 0 HA PRO A 20 32.458 -9.404 -7.207 1.00 24.14 H new ATOM 0 HB2 PRO A 20 34.983 -8.180 -7.196 1.00 53.30 H new ATOM 0 HB3 PRO A 20 33.562 -7.392 -6.541 1.00 53.30 H new ATOM 0 HG2 PRO A 20 35.720 -8.911 -5.092 1.00 1.42 H new ATOM 0 HG3 PRO A 20 34.942 -7.407 -4.644 1.00 1.42 H new ATOM 0 HD2 PRO A 20 34.220 -9.726 -3.473 1.00 14.14 H new ATOM 0 HD3 PRO A 20 33.024 -8.489 -3.806 1.00 14.14 H new ATOM 251 N ALA A 21 34.732 -11.448 -6.856 1.00 65.43 N ATOM 252 CA ALA A 21 35.485 -12.527 -7.452 1.00 14.44 C ATOM 253 C ALA A 21 35.298 -13.764 -6.608 1.00 3.11 C ATOM 254 O ALA A 21 35.831 -13.846 -5.509 1.00 3.25 O ATOM 255 CB ALA A 21 36.962 -12.161 -7.553 1.00 30.13 C ATOM 0 H ALA A 21 34.714 -11.485 -5.837 1.00 65.43 H new ATOM 0 HA ALA A 21 35.124 -12.714 -8.463 1.00 14.44 H new ATOM 0 HB1 ALA A 21 37.511 -12.987 -8.005 1.00 30.13 H new ATOM 0 HB2 ALA A 21 37.075 -11.270 -8.170 1.00 30.13 H new ATOM 0 HB3 ALA A 21 37.357 -11.964 -6.556 1.00 30.13 H new ATOM 261 N SER A 22 34.528 -14.705 -7.104 1.00 30.10 N ATOM 262 CA SER A 22 34.180 -15.914 -6.367 1.00 45.52 C ATOM 263 C SER A 22 35.405 -16.761 -5.972 1.00 75.41 C ATOM 264 O SER A 22 35.356 -17.519 -4.999 1.00 42.35 O ATOM 265 CB SER A 22 33.162 -16.738 -7.154 1.00 50.13 C ATOM 266 OG SER A 22 31.969 -15.983 -7.380 1.00 10.35 O ATOM 0 H SER A 22 34.119 -14.659 -8.037 1.00 30.10 H new ATOM 0 HA SER A 22 33.728 -15.595 -5.428 1.00 45.52 H new ATOM 0 HB2 SER A 22 33.592 -17.042 -8.108 1.00 50.13 H new ATOM 0 HB3 SER A 22 32.923 -17.650 -6.607 1.00 50.13 H new ATOM 0 HG SER A 22 31.329 -16.526 -7.887 1.00 10.35 H new ATOM 272 N GLU A 23 36.490 -16.635 -6.706 1.00 72.13 N ATOM 273 CA GLU A 23 37.693 -17.343 -6.358 1.00 51.30 C ATOM 274 C GLU A 23 38.563 -16.490 -5.452 1.00 35.14 C ATOM 275 O GLU A 23 39.464 -15.784 -5.925 1.00 1.53 O ATOM 276 CB GLU A 23 38.506 -17.759 -7.586 1.00 40.41 C ATOM 277 CG GLU A 23 37.800 -18.688 -8.551 1.00 65.24 C ATOM 278 CD GLU A 23 38.653 -18.979 -9.761 1.00 41.23 C ATOM 279 OE1 GLU A 23 38.616 -18.191 -10.731 1.00 12.14 O ATOM 280 OE2 GLU A 23 39.384 -19.995 -9.766 1.00 64.50 O ATOM 0 H GLU A 23 36.559 -16.052 -7.540 1.00 72.13 H new ATOM 0 HA GLU A 23 37.382 -18.250 -5.839 1.00 51.30 H new ATOM 0 HB2 GLU A 23 38.802 -16.860 -8.126 1.00 40.41 H new ATOM 0 HB3 GLU A 23 39.422 -18.243 -7.247 1.00 40.41 H new ATOM 0 HG2 GLU A 23 37.554 -19.621 -8.045 1.00 65.24 H new ATOM 0 HG3 GLU A 23 36.859 -18.239 -8.867 1.00 65.24 H new ATOM 287 N GLN A 24 38.264 -16.496 -4.172 1.00 53.33 N ATOM 288 CA GLN A 24 39.109 -15.807 -3.206 1.00 25.11 C ATOM 289 C GLN A 24 40.311 -16.661 -2.960 1.00 21.45 C ATOM 290 O GLN A 24 41.441 -16.179 -2.840 1.00 14.43 O ATOM 291 CB GLN A 24 38.365 -15.506 -1.907 1.00 75.42 C ATOM 292 CG GLN A 24 37.304 -14.433 -2.056 1.00 1.02 C ATOM 293 CD GLN A 24 37.894 -13.115 -2.540 1.00 43.30 C ATOM 294 OE1 GLN A 24 38.317 -12.278 -1.743 1.00 22.24 O ATOM 295 NE2 GLN A 24 37.886 -12.899 -3.825 1.00 2.23 N ATOM 0 H GLN A 24 37.451 -16.964 -3.772 1.00 53.33 H new ATOM 0 HA GLN A 24 39.410 -14.840 -3.608 1.00 25.11 H new ATOM 0 HB2 GLN A 24 37.897 -16.421 -1.544 1.00 75.42 H new ATOM 0 HB3 GLN A 24 39.084 -15.193 -1.149 1.00 75.42 H new ATOM 0 HG2 GLN A 24 36.543 -14.770 -2.760 1.00 1.02 H new ATOM 0 HG3 GLN A 24 36.807 -14.278 -1.098 1.00 1.02 H new ATOM 0 HE21 GLN A 24 37.529 -13.613 -4.460 1.00 2.23 H new ATOM 0 HE22 GLN A 24 38.237 -12.016 -4.196 1.00 2.23 H new ATOM 304 N GLU A 25 40.061 -17.935 -2.923 1.00 20.02 N ATOM 305 CA GLU A 25 41.083 -18.912 -2.877 1.00 11.33 C ATOM 306 C GLU A 25 41.493 -19.196 -4.302 1.00 22.14 C ATOM 307 O GLU A 25 40.949 -20.090 -4.952 1.00 34.32 O ATOM 308 CB GLU A 25 40.583 -20.189 -2.210 1.00 63.05 C ATOM 309 CG GLU A 25 40.280 -20.038 -0.741 1.00 74.12 C ATOM 310 CD GLU A 25 39.609 -21.251 -0.172 1.00 42.43 C ATOM 311 OE1 GLU A 25 40.190 -22.324 -0.167 1.00 53.42 O ATOM 312 OE2 GLU A 25 38.455 -21.151 0.274 1.00 41.50 O ATOM 0 H GLU A 25 39.118 -18.323 -2.924 1.00 20.02 H new ATOM 0 HA GLU A 25 41.928 -18.549 -2.292 1.00 11.33 H new ATOM 0 HB2 GLU A 25 39.682 -20.525 -2.723 1.00 63.05 H new ATOM 0 HB3 GLU A 25 41.333 -20.970 -2.337 1.00 63.05 H new ATOM 0 HG2 GLU A 25 41.206 -19.850 -0.199 1.00 74.12 H new ATOM 0 HG3 GLU A 25 39.641 -19.168 -0.592 1.00 74.12 H new ATOM 319 N THR A 26 42.355 -18.379 -4.824 1.00 51.52 N ATOM 320 CA THR A 26 42.806 -18.559 -6.161 1.00 53.31 C ATOM 321 C THR A 26 43.967 -19.536 -6.161 1.00 53.35 C ATOM 322 O THR A 26 45.032 -19.245 -5.609 1.00 30.52 O ATOM 323 CB THR A 26 43.222 -17.218 -6.779 1.00 42.31 C ATOM 324 OG1 THR A 26 42.159 -16.261 -6.565 1.00 20.15 O ATOM 325 CG2 THR A 26 43.452 -17.379 -8.278 1.00 70.41 C ATOM 0 H THR A 26 42.760 -17.578 -4.338 1.00 51.52 H new ATOM 0 HA THR A 26 41.994 -18.962 -6.767 1.00 53.31 H new ATOM 0 HB THR A 26 44.145 -16.875 -6.313 1.00 42.31 H new ATOM 0 HG1 THR A 26 41.310 -16.736 -6.450 1.00 20.15 H new ATOM 0 HG21 THR A 26 43.747 -16.421 -8.706 1.00 70.41 H new ATOM 0 HG22 THR A 26 44.242 -18.111 -8.448 1.00 70.41 H new ATOM 0 HG23 THR A 26 42.532 -17.721 -8.753 1.00 70.41 H new ATOM 333 N LEU A 27 43.737 -20.698 -6.719 1.00 5.11 N ATOM 334 CA LEU A 27 44.746 -21.724 -6.782 1.00 60.50 C ATOM 335 C LEU A 27 45.672 -21.431 -7.913 1.00 75.55 C ATOM 336 O LEU A 27 45.237 -21.146 -9.030 1.00 13.21 O ATOM 337 CB LEU A 27 44.133 -23.113 -6.958 1.00 70.13 C ATOM 338 CG LEU A 27 43.245 -23.610 -5.822 1.00 24.53 C ATOM 339 CD1 LEU A 27 42.655 -24.957 -6.172 1.00 0.21 C ATOM 340 CD2 LEU A 27 44.025 -23.715 -4.528 1.00 40.21 C ATOM 0 H LEU A 27 42.846 -20.959 -7.142 1.00 5.11 H new ATOM 0 HA LEU A 27 45.292 -21.724 -5.839 1.00 60.50 H new ATOM 0 HB2 LEU A 27 43.546 -23.114 -7.876 1.00 70.13 H new ATOM 0 HB3 LEU A 27 44.943 -23.829 -7.097 1.00 70.13 H new ATOM 0 HG LEU A 27 42.440 -22.888 -5.683 1.00 24.53 H new ATOM 0 HD11 LEU A 27 42.023 -25.301 -5.353 1.00 0.21 H new ATOM 0 HD12 LEU A 27 42.057 -24.868 -7.079 1.00 0.21 H new ATOM 0 HD13 LEU A 27 43.459 -25.675 -6.336 1.00 0.21 H new ATOM 0 HD21 LEU A 27 43.368 -24.072 -3.735 1.00 40.21 H new ATOM 0 HD22 LEU A 27 44.851 -24.415 -4.657 1.00 40.21 H new ATOM 0 HD23 LEU A 27 44.418 -22.735 -4.260 1.00 40.21 H new ATOM 352 N VAL A 28 46.923 -21.482 -7.638 1.00 40.25 N ATOM 353 CA VAL A 28 47.917 -21.190 -8.618 1.00 11.42 C ATOM 354 C VAL A 28 48.475 -22.489 -9.172 1.00 51.22 C ATOM 355 O VAL A 28 48.340 -23.552 -8.540 1.00 23.41 O ATOM 356 CB VAL A 28 49.072 -20.334 -8.010 1.00 72.31 C ATOM 357 CG1 VAL A 28 48.513 -19.086 -7.340 1.00 1.12 C ATOM 358 CG2 VAL A 28 49.921 -21.134 -7.016 1.00 61.10 C ATOM 0 H VAL A 28 47.295 -21.729 -6.721 1.00 40.25 H new ATOM 0 HA VAL A 28 47.455 -20.614 -9.420 1.00 11.42 H new ATOM 0 HB VAL A 28 49.723 -20.039 -8.833 1.00 72.31 H new ATOM 0 HG11 VAL A 28 49.331 -18.500 -6.921 1.00 1.12 H new ATOM 0 HG12 VAL A 28 47.977 -18.487 -8.076 1.00 1.12 H new ATOM 0 HG13 VAL A 28 47.829 -19.377 -6.542 1.00 1.12 H new ATOM 0 HG21 VAL A 28 50.712 -20.498 -6.619 1.00 61.10 H new ATOM 0 HG22 VAL A 28 49.291 -21.483 -6.198 1.00 61.10 H new ATOM 0 HG23 VAL A 28 50.365 -21.991 -7.523 1.00 61.10 H new ATOM 368 N ARG A 29 49.046 -22.424 -10.346 1.00 35.24 N ATOM 369 CA ARG A 29 49.690 -23.571 -10.953 1.00 74.24 C ATOM 370 C ARG A 29 51.193 -23.472 -10.749 1.00 40.32 C ATOM 371 O ARG A 29 51.866 -22.728 -11.467 1.00 20.51 O ATOM 372 CB ARG A 29 49.378 -23.640 -12.448 1.00 11.01 C ATOM 373 CG ARG A 29 47.903 -23.769 -12.773 1.00 63.52 C ATOM 374 CD ARG A 29 47.310 -25.031 -12.216 1.00 40.33 C ATOM 375 NE ARG A 29 47.969 -26.226 -12.759 1.00 65.21 N ATOM 376 CZ ARG A 29 47.757 -27.480 -12.350 1.00 15.23 C ATOM 377 NH1 ARG A 29 46.844 -27.739 -11.425 1.00 52.24 N ATOM 378 NH2 ARG A 29 48.442 -28.480 -12.889 1.00 32.15 N ATOM 0 H ARG A 29 49.081 -21.577 -10.913 1.00 35.24 H new ATOM 0 HA ARG A 29 49.311 -24.476 -10.479 1.00 74.24 H new ATOM 0 HB2 ARG A 29 49.767 -22.743 -12.930 1.00 11.01 H new ATOM 0 HB3 ARG A 29 49.908 -24.489 -12.879 1.00 11.01 H new ATOM 0 HG2 ARG A 29 47.367 -22.909 -12.371 1.00 63.52 H new ATOM 0 HG3 ARG A 29 47.768 -23.752 -13.854 1.00 63.52 H new ATOM 0 HD2 ARG A 29 47.401 -25.027 -11.130 1.00 40.33 H new ATOM 0 HD3 ARG A 29 46.245 -25.066 -12.447 1.00 40.33 H new ATOM 0 HE ARG A 29 48.644 -26.087 -13.511 1.00 65.21 H new ATOM 0 HH11 ARG A 29 46.298 -26.978 -11.021 1.00 52.24 H new ATOM 0 HH12 ARG A 29 46.688 -28.699 -11.118 1.00 52.24 H new ATOM 0 HH21 ARG A 29 49.132 -28.292 -13.617 1.00 32.15 H new ATOM 0 HH22 ARG A 29 48.279 -29.437 -12.576 1.00 32.15 H new ATOM 392 N PRO A 30 51.741 -24.168 -9.749 1.00 1.41 N ATOM 393 CA PRO A 30 53.159 -24.127 -9.462 1.00 43.14 C ATOM 394 C PRO A 30 53.959 -24.996 -10.426 1.00 24.23 C ATOM 395 O PRO A 30 53.611 -26.154 -10.663 1.00 23.12 O ATOM 396 CB PRO A 30 53.267 -24.686 -8.028 1.00 54.02 C ATOM 397 CG PRO A 30 51.861 -24.917 -7.572 1.00 53.23 C ATOM 398 CD PRO A 30 51.039 -25.050 -8.811 1.00 55.33 C ATOM 0 HA PRO A 30 53.563 -23.120 -9.566 1.00 43.14 H new ATOM 0 HB2 PRO A 30 53.840 -25.613 -8.012 1.00 54.02 H new ATOM 0 HB3 PRO A 30 53.780 -23.983 -7.372 1.00 54.02 H new ATOM 0 HG2 PRO A 30 51.793 -25.817 -6.961 1.00 53.23 H new ATOM 0 HG3 PRO A 30 51.509 -24.088 -6.958 1.00 53.23 H new ATOM 0 HD2 PRO A 30 51.006 -26.079 -9.168 1.00 55.33 H new ATOM 0 HD3 PRO A 30 50.008 -24.735 -8.651 1.00 55.33 H new ATOM 406 N LYS A 31 55.004 -24.423 -10.992 1.00 71.41 N ATOM 407 CA LYS A 31 55.909 -25.150 -11.876 1.00 13.12 C ATOM 408 C LYS A 31 56.724 -26.178 -11.053 1.00 60.43 C ATOM 409 O LYS A 31 56.720 -26.099 -9.817 1.00 12.54 O ATOM 410 CB LYS A 31 56.844 -24.158 -12.585 1.00 45.42 C ATOM 411 CG LYS A 31 56.168 -23.209 -13.546 1.00 33.03 C ATOM 412 CD LYS A 31 57.201 -22.391 -14.306 1.00 44.22 C ATOM 413 CE LYS A 31 56.546 -21.424 -15.271 1.00 72.11 C ATOM 414 NZ LYS A 31 57.543 -20.711 -16.101 1.00 53.45 N ATOM 0 H LYS A 31 55.253 -23.443 -10.856 1.00 71.41 H new ATOM 0 HA LYS A 31 55.334 -25.686 -12.631 1.00 13.12 H new ATOM 0 HB2 LYS A 31 57.366 -23.572 -11.829 1.00 45.42 H new ATOM 0 HB3 LYS A 31 57.601 -24.723 -13.130 1.00 45.42 H new ATOM 0 HG2 LYS A 31 55.553 -23.771 -14.249 1.00 33.03 H new ATOM 0 HG3 LYS A 31 55.500 -22.544 -12.999 1.00 33.03 H new ATOM 0 HD2 LYS A 31 57.820 -21.838 -13.599 1.00 44.22 H new ATOM 0 HD3 LYS A 31 57.864 -23.060 -14.854 1.00 44.22 H new ATOM 0 HE2 LYS A 31 55.857 -21.967 -15.918 1.00 72.11 H new ATOM 0 HE3 LYS A 31 55.954 -20.699 -14.712 1.00 72.11 H new ATOM 0 HZ1 LYS A 31 57.054 -20.059 -16.748 1.00 53.45 H new ATOM 0 HZ2 LYS A 31 58.185 -20.172 -15.486 1.00 53.45 H new ATOM 0 HZ3 LYS A 31 58.091 -21.400 -16.654 1.00 53.45 H new ATOM 428 N PRO A 32 57.448 -27.144 -11.704 1.00 4.31 N ATOM 429 CA PRO A 32 58.242 -28.188 -11.008 1.00 5.12 C ATOM 430 C PRO A 32 59.168 -27.633 -9.926 1.00 74.20 C ATOM 431 O PRO A 32 59.284 -28.213 -8.854 1.00 50.13 O ATOM 432 CB PRO A 32 59.083 -28.809 -12.145 1.00 54.05 C ATOM 433 CG PRO A 32 58.977 -27.823 -13.244 1.00 52.24 C ATOM 434 CD PRO A 32 57.568 -27.336 -13.158 1.00 71.25 C ATOM 0 HA PRO A 32 57.592 -28.889 -10.484 1.00 5.12 H new ATOM 0 HB2 PRO A 32 60.119 -28.958 -11.840 1.00 54.05 H new ATOM 0 HB3 PRO A 32 58.695 -29.783 -12.443 1.00 54.05 H new ATOM 0 HG2 PRO A 32 59.689 -27.008 -13.119 1.00 52.24 H new ATOM 0 HG3 PRO A 32 59.183 -28.280 -14.212 1.00 52.24 H new ATOM 0 HD2 PRO A 32 57.413 -26.411 -13.714 1.00 71.25 H new ATOM 0 HD3 PRO A 32 56.852 -28.063 -13.542 1.00 71.25 H new ATOM 442 N LEU A 33 59.789 -26.490 -10.185 1.00 43.22 N ATOM 443 CA LEU A 33 60.716 -25.922 -9.224 1.00 61.34 C ATOM 444 C LEU A 33 59.986 -25.353 -8.009 1.00 33.42 C ATOM 445 O LEU A 33 60.522 -25.315 -6.895 1.00 21.42 O ATOM 446 CB LEU A 33 61.633 -24.893 -9.873 1.00 61.22 C ATOM 447 CG LEU A 33 62.503 -25.435 -11.014 1.00 51.04 C ATOM 448 CD1 LEU A 33 63.325 -24.331 -11.635 1.00 51.51 C ATOM 449 CD2 LEU A 33 63.412 -26.552 -10.524 1.00 21.44 C ATOM 0 H LEU A 33 59.669 -25.947 -11.040 1.00 43.22 H new ATOM 0 HA LEU A 33 61.351 -26.731 -8.863 1.00 61.34 H new ATOM 0 HB2 LEU A 33 61.024 -24.075 -10.257 1.00 61.22 H new ATOM 0 HB3 LEU A 33 62.284 -24.473 -9.107 1.00 61.22 H new ATOM 0 HG LEU A 33 61.836 -25.842 -11.774 1.00 51.04 H new ATOM 0 HD11 LEU A 33 63.934 -24.740 -12.442 1.00 51.51 H new ATOM 0 HD12 LEU A 33 62.661 -23.564 -12.034 1.00 51.51 H new ATOM 0 HD13 LEU A 33 63.974 -23.891 -10.878 1.00 51.51 H new ATOM 0 HD21 LEU A 33 64.018 -26.918 -11.353 1.00 21.44 H new ATOM 0 HD22 LEU A 33 64.064 -26.172 -9.738 1.00 21.44 H new ATOM 0 HD23 LEU A 33 62.806 -27.368 -10.130 1.00 21.44 H new ATOM 461 N LEU A 34 58.747 -24.950 -8.213 1.00 3.45 N ATOM 462 CA LEU A 34 57.930 -24.488 -7.117 1.00 64.14 C ATOM 463 C LEU A 34 57.480 -25.683 -6.321 1.00 22.24 C ATOM 464 O LEU A 34 57.561 -25.677 -5.110 1.00 75.12 O ATOM 465 CB LEU A 34 56.719 -23.631 -7.553 1.00 35.35 C ATOM 466 CG LEU A 34 56.998 -22.183 -8.009 1.00 62.21 C ATOM 467 CD1 LEU A 34 57.779 -22.133 -9.307 1.00 72.03 C ATOM 468 CD2 LEU A 34 55.699 -21.403 -8.142 1.00 52.54 C ATOM 0 H LEU A 34 58.289 -24.934 -9.124 1.00 3.45 H new ATOM 0 HA LEU A 34 58.543 -23.823 -6.508 1.00 64.14 H new ATOM 0 HB2 LEU A 34 56.216 -24.150 -8.369 1.00 35.35 H new ATOM 0 HB3 LEU A 34 56.017 -23.592 -6.720 1.00 35.35 H new ATOM 0 HG LEU A 34 57.614 -21.718 -7.240 1.00 62.21 H new ATOM 0 HD11 LEU A 34 57.951 -21.094 -9.588 1.00 72.03 H new ATOM 0 HD12 LEU A 34 58.736 -22.637 -9.175 1.00 72.03 H new ATOM 0 HD13 LEU A 34 57.212 -22.632 -10.093 1.00 72.03 H new ATOM 0 HD21 LEU A 34 55.917 -20.385 -8.464 1.00 52.54 H new ATOM 0 HD22 LEU A 34 55.058 -21.887 -8.878 1.00 52.54 H new ATOM 0 HD23 LEU A 34 55.190 -21.377 -7.179 1.00 52.54 H new ATOM 480 N LEU A 35 57.057 -26.737 -7.026 1.00 65.12 N ATOM 481 CA LEU A 35 56.668 -28.001 -6.390 1.00 5.32 C ATOM 482 C LEU A 35 57.799 -28.533 -5.545 1.00 54.41 C ATOM 483 O LEU A 35 57.578 -29.045 -4.441 1.00 53.44 O ATOM 484 CB LEU A 35 56.290 -29.034 -7.424 1.00 2.42 C ATOM 485 CG LEU A 35 55.037 -28.747 -8.230 1.00 12.12 C ATOM 486 CD1 LEU A 35 54.831 -29.855 -9.216 1.00 24.24 C ATOM 487 CD2 LEU A 35 53.828 -28.627 -7.311 1.00 71.40 C ATOM 0 H LEU A 35 56.975 -26.740 -8.043 1.00 65.12 H new ATOM 0 HA LEU A 35 55.803 -27.802 -5.758 1.00 5.32 H new ATOM 0 HB2 LEU A 35 57.124 -29.147 -8.116 1.00 2.42 H new ATOM 0 HB3 LEU A 35 56.162 -29.992 -6.920 1.00 2.42 H new ATOM 0 HG LEU A 35 55.154 -27.801 -8.759 1.00 12.12 H new ATOM 0 HD11 LEU A 35 53.933 -29.659 -9.801 1.00 24.24 H new ATOM 0 HD12 LEU A 35 55.692 -29.914 -9.882 1.00 24.24 H new ATOM 0 HD13 LEU A 35 54.718 -30.799 -8.684 1.00 24.24 H new ATOM 0 HD21 LEU A 35 52.938 -28.421 -7.906 1.00 71.40 H new ATOM 0 HD22 LEU A 35 53.692 -29.561 -6.765 1.00 71.40 H new ATOM 0 HD23 LEU A 35 53.988 -27.813 -6.604 1.00 71.40 H new ATOM 499 N LYS A 36 59.008 -28.388 -6.075 1.00 42.34 N ATOM 500 CA LYS A 36 60.225 -28.733 -5.382 1.00 34.14 C ATOM 501 C LYS A 36 60.259 -28.078 -4.007 1.00 62.12 C ATOM 502 O LYS A 36 60.358 -28.762 -2.985 1.00 31.42 O ATOM 503 CB LYS A 36 61.463 -28.257 -6.171 1.00 22.41 C ATOM 504 CG LYS A 36 62.748 -28.247 -5.334 1.00 43.13 C ATOM 505 CD LYS A 36 63.876 -27.483 -6.004 1.00 75.31 C ATOM 506 CE LYS A 36 65.042 -27.300 -5.035 1.00 21.21 C ATOM 507 NZ LYS A 36 66.147 -26.509 -5.608 1.00 23.02 N ATOM 0 H LYS A 36 59.163 -28.021 -7.014 1.00 42.34 H new ATOM 0 HA LYS A 36 60.246 -29.818 -5.283 1.00 34.14 H new ATOM 0 HB2 LYS A 36 61.606 -28.905 -7.036 1.00 22.41 H new ATOM 0 HB3 LYS A 36 61.278 -27.253 -6.553 1.00 22.41 H new ATOM 0 HG2 LYS A 36 62.540 -27.801 -4.361 1.00 43.13 H new ATOM 0 HG3 LYS A 36 63.067 -29.273 -5.153 1.00 43.13 H new ATOM 0 HD2 LYS A 36 64.212 -28.021 -6.890 1.00 75.31 H new ATOM 0 HD3 LYS A 36 63.517 -26.510 -6.339 1.00 75.31 H new ATOM 0 HE2 LYS A 36 64.682 -26.810 -4.130 1.00 21.21 H new ATOM 0 HE3 LYS A 36 65.419 -28.279 -4.739 1.00 21.21 H new ATOM 0 HZ1 LYS A 36 67.002 -27.098 -5.666 1.00 23.02 H new ATOM 0 HZ2 LYS A 36 65.884 -26.185 -6.561 1.00 23.02 H new ATOM 0 HZ3 LYS A 36 66.335 -25.685 -5.002 1.00 23.02 H new ATOM 521 N LEU A 37 60.097 -26.766 -3.982 1.00 21.34 N ATOM 522 CA LEU A 37 60.271 -26.032 -2.754 1.00 4.13 C ATOM 523 C LEU A 37 59.072 -26.216 -1.841 1.00 55.22 C ATOM 524 O LEU A 37 59.221 -26.359 -0.643 1.00 44.31 O ATOM 525 CB LEU A 37 60.627 -24.539 -3.020 1.00 20.40 C ATOM 526 CG LEU A 37 59.589 -23.627 -3.703 1.00 70.33 C ATOM 527 CD1 LEU A 37 58.526 -23.133 -2.717 1.00 0.31 C ATOM 528 CD2 LEU A 37 60.275 -22.454 -4.388 1.00 24.22 C ATOM 0 H LEU A 37 59.848 -26.198 -4.792 1.00 21.34 H new ATOM 0 HA LEU A 37 61.129 -26.445 -2.224 1.00 4.13 H new ATOM 0 HB2 LEU A 37 60.880 -24.087 -2.061 1.00 20.40 H new ATOM 0 HB3 LEU A 37 61.530 -24.521 -3.629 1.00 20.40 H new ATOM 0 HG LEU A 37 59.078 -24.223 -4.459 1.00 70.33 H new ATOM 0 HD11 LEU A 37 57.814 -22.494 -3.239 1.00 0.31 H new ATOM 0 HD12 LEU A 37 58.001 -23.987 -2.290 1.00 0.31 H new ATOM 0 HD13 LEU A 37 59.005 -22.566 -1.919 1.00 0.31 H new ATOM 0 HD21 LEU A 37 59.526 -21.822 -4.864 1.00 24.22 H new ATOM 0 HD22 LEU A 37 60.824 -21.871 -3.648 1.00 24.22 H new ATOM 0 HD23 LEU A 37 60.967 -22.827 -5.143 1.00 24.22 H new ATOM 540 N LEU A 38 57.896 -26.280 -2.437 1.00 2.01 N ATOM 541 CA LEU A 38 56.666 -26.438 -1.701 1.00 62.52 C ATOM 542 C LEU A 38 56.639 -27.776 -0.986 1.00 61.11 C ATOM 543 O LEU A 38 56.534 -27.838 0.237 1.00 21.21 O ATOM 544 CB LEU A 38 55.444 -26.322 -2.637 1.00 42.14 C ATOM 545 CG LEU A 38 55.235 -24.979 -3.358 1.00 23.53 C ATOM 546 CD1 LEU A 38 54.113 -25.090 -4.372 1.00 63.33 C ATOM 547 CD2 LEU A 38 54.932 -23.863 -2.374 1.00 34.23 C ATOM 0 H LEU A 38 57.772 -26.223 -3.448 1.00 2.01 H new ATOM 0 HA LEU A 38 56.616 -25.639 -0.961 1.00 62.52 H new ATOM 0 HB2 LEU A 38 55.523 -27.103 -3.394 1.00 42.14 H new ATOM 0 HB3 LEU A 38 54.549 -26.534 -2.052 1.00 42.14 H new ATOM 0 HG LEU A 38 56.163 -24.735 -3.875 1.00 23.53 H new ATOM 0 HD11 LEU A 38 53.979 -24.131 -4.873 1.00 63.33 H new ATOM 0 HD12 LEU A 38 54.363 -25.853 -5.110 1.00 63.33 H new ATOM 0 HD13 LEU A 38 53.189 -25.366 -3.864 1.00 63.33 H new ATOM 0 HD21 LEU A 38 54.790 -22.928 -2.916 1.00 34.23 H new ATOM 0 HD22 LEU A 38 54.024 -24.103 -1.820 1.00 34.23 H new ATOM 0 HD23 LEU A 38 55.764 -23.756 -1.678 1.00 34.23 H new ATOM 559 N LYS A 39 56.808 -28.849 -1.721 1.00 4.41 N ATOM 560 CA LYS A 39 56.639 -30.157 -1.145 1.00 72.50 C ATOM 561 C LYS A 39 57.824 -30.601 -0.327 1.00 71.11 C ATOM 562 O LYS A 39 57.740 -31.591 0.387 1.00 23.23 O ATOM 563 CB LYS A 39 56.223 -31.214 -2.169 1.00 34.33 C ATOM 564 CG LYS A 39 54.837 -30.987 -2.755 1.00 51.34 C ATOM 565 CD LYS A 39 54.381 -32.183 -3.571 1.00 50.31 C ATOM 566 CE LYS A 39 52.955 -32.007 -4.078 1.00 14.03 C ATOM 567 NZ LYS A 39 52.451 -33.226 -4.750 1.00 31.25 N ATOM 0 H LYS A 39 57.060 -28.841 -2.709 1.00 4.41 H new ATOM 0 HA LYS A 39 55.806 -30.055 -0.450 1.00 72.50 H new ATOM 0 HB2 LYS A 39 56.952 -31.229 -2.979 1.00 34.33 H new ATOM 0 HB3 LYS A 39 56.251 -32.196 -1.696 1.00 34.33 H new ATOM 0 HG2 LYS A 39 54.126 -30.800 -1.950 1.00 51.34 H new ATOM 0 HG3 LYS A 39 54.847 -30.097 -3.384 1.00 51.34 H new ATOM 0 HD2 LYS A 39 55.053 -32.324 -4.417 1.00 50.31 H new ATOM 0 HD3 LYS A 39 54.442 -33.084 -2.961 1.00 50.31 H new ATOM 0 HE2 LYS A 39 52.301 -31.757 -3.242 1.00 14.03 H new ATOM 0 HE3 LYS A 39 52.918 -31.168 -4.773 1.00 14.03 H new ATOM 0 HZ1 LYS A 39 51.425 -33.142 -4.898 1.00 31.25 H new ATOM 0 HZ2 LYS A 39 52.925 -33.337 -5.669 1.00 31.25 H new ATOM 0 HZ3 LYS A 39 52.648 -34.057 -4.156 1.00 31.25 H new ATOM 581 N SER A 40 58.922 -29.886 -0.405 1.00 51.14 N ATOM 582 CA SER A 40 60.050 -30.247 0.406 1.00 42.10 C ATOM 583 C SER A 40 59.908 -29.647 1.803 1.00 14.45 C ATOM 584 O SER A 40 60.397 -30.213 2.789 1.00 42.43 O ATOM 585 CB SER A 40 61.359 -29.841 -0.263 1.00 12.23 C ATOM 586 OG SER A 40 61.407 -28.445 -0.509 1.00 61.15 O ATOM 0 H SER A 40 59.053 -29.073 -1.006 1.00 51.14 H new ATOM 0 HA SER A 40 60.074 -31.332 0.512 1.00 42.10 H new ATOM 0 HB2 SER A 40 62.197 -30.129 0.372 1.00 12.23 H new ATOM 0 HB3 SER A 40 61.471 -30.381 -1.203 1.00 12.23 H new ATOM 0 HG SER A 40 61.002 -28.252 -1.380 1.00 61.15 H new ATOM 592 N VAL A 41 59.186 -28.526 1.897 1.00 11.22 N ATOM 593 CA VAL A 41 58.979 -27.865 3.176 1.00 71.41 C ATOM 594 C VAL A 41 57.691 -28.317 3.843 1.00 64.32 C ATOM 595 O VAL A 41 57.312 -27.812 4.900 1.00 51.12 O ATOM 596 CB VAL A 41 59.046 -26.320 3.088 1.00 30.34 C ATOM 597 CG1 VAL A 41 60.413 -25.883 2.603 1.00 44.32 C ATOM 598 CG2 VAL A 41 57.958 -25.774 2.184 1.00 74.11 C ATOM 0 H VAL A 41 58.740 -28.065 1.104 1.00 11.22 H new ATOM 0 HA VAL A 41 59.815 -28.175 3.803 1.00 71.41 H new ATOM 0 HB VAL A 41 58.882 -25.915 4.086 1.00 30.34 H new ATOM 0 HG11 VAL A 41 60.448 -24.795 2.545 1.00 44.32 H new ATOM 0 HG12 VAL A 41 61.175 -26.234 3.299 1.00 44.32 H new ATOM 0 HG13 VAL A 41 60.601 -26.305 1.616 1.00 44.32 H new ATOM 0 HG21 VAL A 41 58.031 -24.687 2.142 1.00 74.11 H new ATOM 0 HG22 VAL A 41 58.078 -26.184 1.181 1.00 74.11 H new ATOM 0 HG23 VAL A 41 56.982 -26.057 2.578 1.00 74.11 H new ATOM 608 N GLY A 42 57.038 -29.276 3.240 1.00 13.41 N ATOM 609 CA GLY A 42 55.878 -29.847 3.854 1.00 34.34 C ATOM 610 C GLY A 42 54.567 -29.518 3.184 1.00 74.23 C ATOM 611 O GLY A 42 53.520 -29.572 3.827 1.00 22.34 O ATOM 0 H GLY A 42 57.289 -29.672 2.334 1.00 13.41 H new ATOM 0 HA2 GLY A 42 55.994 -30.931 3.875 1.00 34.34 H new ATOM 0 HA3 GLY A 42 55.832 -29.511 4.890 1.00 34.34 H new ATOM 615 N ALA A 43 54.589 -29.176 1.911 1.00 52.43 N ATOM 616 CA ALA A 43 53.333 -28.979 1.207 1.00 31.35 C ATOM 617 C ALA A 43 52.812 -30.328 0.788 1.00 13.11 C ATOM 618 O ALA A 43 53.587 -31.207 0.406 1.00 2.23 O ATOM 619 CB ALA A 43 53.478 -28.068 0.011 1.00 2.41 C ATOM 0 H ALA A 43 55.432 -29.032 1.355 1.00 52.43 H new ATOM 0 HA ALA A 43 52.629 -28.488 1.879 1.00 31.35 H new ATOM 0 HB1 ALA A 43 52.511 -27.954 -0.479 1.00 2.41 H new ATOM 0 HB2 ALA A 43 53.836 -27.092 0.338 1.00 2.41 H new ATOM 0 HB3 ALA A 43 54.192 -28.500 -0.691 1.00 2.41 H new ATOM 625 N GLN A 44 51.539 -30.495 0.861 1.00 11.11 N ATOM 626 CA GLN A 44 50.921 -31.774 0.632 1.00 14.10 C ATOM 627 C GLN A 44 50.201 -31.802 -0.704 1.00 41.31 C ATOM 628 O GLN A 44 50.210 -32.816 -1.406 1.00 14.35 O ATOM 629 CB GLN A 44 49.934 -32.045 1.759 1.00 34.11 C ATOM 630 CG GLN A 44 50.566 -31.981 3.139 1.00 12.52 C ATOM 631 CD GLN A 44 49.545 -32.018 4.247 1.00 43.54 C ATOM 632 OE1 GLN A 44 49.053 -30.980 4.677 1.00 52.22 O ATOM 633 NE2 GLN A 44 49.223 -33.188 4.723 1.00 5.12 N ATOM 0 H GLN A 44 50.882 -29.747 1.083 1.00 11.11 H new ATOM 0 HA GLN A 44 51.692 -32.544 0.611 1.00 14.10 H new ATOM 0 HB2 GLN A 44 49.123 -31.319 1.704 1.00 34.11 H new ATOM 0 HB3 GLN A 44 49.491 -33.030 1.615 1.00 34.11 H new ATOM 0 HG2 GLN A 44 51.256 -32.817 3.258 1.00 12.52 H new ATOM 0 HG3 GLN A 44 51.155 -31.067 3.223 1.00 12.52 H new ATOM 0 HE21 GLN A 44 49.653 -34.030 4.340 1.00 5.12 H new ATOM 0 HE22 GLN A 44 48.541 -33.261 5.478 1.00 5.12 H new ATOM 642 N LYS A 45 49.609 -30.692 -1.064 1.00 34.22 N ATOM 643 CA LYS A 45 48.793 -30.625 -2.258 1.00 1.22 C ATOM 644 C LYS A 45 49.607 -30.159 -3.451 1.00 34.45 C ATOM 645 O LYS A 45 50.740 -29.698 -3.304 1.00 73.42 O ATOM 646 CB LYS A 45 47.597 -29.694 -2.038 1.00 41.14 C ATOM 647 CG LYS A 45 46.704 -30.104 -0.874 1.00 41.43 C ATOM 648 CD LYS A 45 45.499 -29.181 -0.712 1.00 52.41 C ATOM 649 CE LYS A 45 44.572 -29.244 -1.924 1.00 2.42 C ATOM 650 NZ LYS A 45 43.363 -28.405 -1.755 1.00 21.35 N ATOM 0 H LYS A 45 49.675 -29.815 -0.547 1.00 34.22 H new ATOM 0 HA LYS A 45 48.424 -31.629 -2.469 1.00 1.22 H new ATOM 0 HB2 LYS A 45 47.963 -28.682 -1.864 1.00 41.14 H new ATOM 0 HB3 LYS A 45 46.999 -29.664 -2.949 1.00 41.14 H new ATOM 0 HG2 LYS A 45 46.357 -31.126 -1.028 1.00 41.43 H new ATOM 0 HG3 LYS A 45 47.287 -30.101 0.047 1.00 41.43 H new ATOM 0 HD2 LYS A 45 44.945 -29.460 0.185 1.00 52.41 H new ATOM 0 HD3 LYS A 45 45.842 -28.156 -0.569 1.00 52.41 H new ATOM 0 HE2 LYS A 45 45.116 -28.919 -2.811 1.00 2.42 H new ATOM 0 HE3 LYS A 45 44.272 -30.278 -2.095 1.00 2.42 H new ATOM 0 HZ1 LYS A 45 42.766 -28.481 -2.603 1.00 21.35 H new ATOM 0 HZ2 LYS A 45 42.828 -28.730 -0.925 1.00 21.35 H new ATOM 0 HZ3 LYS A 45 43.645 -27.413 -1.618 1.00 21.35 H new ATOM 664 N ASP A 46 49.032 -30.287 -4.621 1.00 71.23 N ATOM 665 CA ASP A 46 49.682 -29.860 -5.856 1.00 33.11 C ATOM 666 C ASP A 46 49.220 -28.485 -6.277 1.00 43.41 C ATOM 667 O ASP A 46 49.798 -27.867 -7.177 1.00 45.42 O ATOM 668 CB ASP A 46 49.466 -30.869 -6.984 1.00 22.43 C ATOM 669 CG ASP A 46 50.351 -32.079 -6.862 1.00 54.13 C ATOM 670 OD1 ASP A 46 50.075 -32.976 -6.029 1.00 72.22 O ATOM 671 OD2 ASP A 46 51.354 -32.162 -7.589 1.00 45.24 O ATOM 0 H ASP A 46 48.103 -30.688 -4.754 1.00 71.23 H new ATOM 0 HA ASP A 46 50.752 -29.809 -5.652 1.00 33.11 H new ATOM 0 HB2 ASP A 46 48.423 -31.186 -6.987 1.00 22.43 H new ATOM 0 HB3 ASP A 46 49.654 -30.382 -7.941 1.00 22.43 H new ATOM 676 N THR A 47 48.181 -28.015 -5.645 1.00 73.34 N ATOM 677 CA THR A 47 47.668 -26.701 -5.889 1.00 64.41 C ATOM 678 C THR A 47 47.507 -25.958 -4.594 1.00 71.43 C ATOM 679 O THR A 47 47.155 -26.548 -3.563 1.00 40.44 O ATOM 680 CB THR A 47 46.342 -26.717 -6.654 1.00 20.33 C ATOM 681 OG1 THR A 47 45.531 -27.831 -6.230 1.00 44.41 O ATOM 682 CG2 THR A 47 46.561 -26.748 -8.156 1.00 54.35 C ATOM 0 H THR A 47 47.664 -28.540 -4.940 1.00 73.34 H new ATOM 0 HA THR A 47 48.395 -26.189 -6.519 1.00 64.41 H new ATOM 0 HB THR A 47 45.813 -25.792 -6.423 1.00 20.33 H new ATOM 0 HG1 THR A 47 44.686 -27.828 -6.726 1.00 44.41 H new ATOM 0 HG21 THR A 47 45.597 -26.759 -8.664 1.00 54.35 H new ATOM 0 HG22 THR A 47 47.122 -25.864 -8.460 1.00 54.35 H new ATOM 0 HG23 THR A 47 47.122 -27.643 -8.423 1.00 54.35 H new ATOM 690 N TYR A 48 47.786 -24.692 -4.629 1.00 21.32 N ATOM 691 CA TYR A 48 47.742 -23.851 -3.469 1.00 72.11 C ATOM 692 C TYR A 48 47.327 -22.475 -3.863 1.00 63.32 C ATOM 693 O TYR A 48 47.421 -22.125 -5.033 1.00 44.22 O ATOM 694 CB TYR A 48 49.108 -23.817 -2.796 1.00 30.34 C ATOM 695 CG TYR A 48 49.377 -25.013 -1.928 1.00 40.51 C ATOM 696 CD1 TYR A 48 48.777 -25.114 -0.691 1.00 21.34 C ATOM 697 CD2 TYR A 48 50.198 -26.046 -2.344 1.00 63.43 C ATOM 698 CE1 TYR A 48 48.982 -26.193 0.114 1.00 2.02 C ATOM 699 CE2 TYR A 48 50.406 -27.139 -1.536 1.00 12.51 C ATOM 700 CZ TYR A 48 49.789 -27.202 -0.305 1.00 2.34 C ATOM 701 OH TYR A 48 49.995 -28.280 0.517 1.00 72.12 O ATOM 0 H TYR A 48 48.057 -24.202 -5.482 1.00 21.32 H new ATOM 0 HA TYR A 48 47.016 -24.253 -2.762 1.00 72.11 H new ATOM 0 HB2 TYR A 48 49.880 -23.753 -3.562 1.00 30.34 H new ATOM 0 HB3 TYR A 48 49.184 -22.914 -2.190 1.00 30.34 H new ATOM 0 HD1 TYR A 48 48.129 -24.319 -0.352 1.00 21.34 H new ATOM 0 HD2 TYR A 48 50.679 -25.994 -3.310 1.00 63.43 H new ATOM 0 HE1 TYR A 48 48.505 -26.246 1.081 1.00 2.02 H new ATOM 0 HE2 TYR A 48 51.049 -27.943 -1.864 1.00 12.51 H new ATOM 0 HH TYR A 48 49.203 -28.421 1.077 1.00 72.12 H new ATOM 711 N THR A 49 46.847 -21.710 -2.919 1.00 4.35 N ATOM 712 CA THR A 49 46.448 -20.363 -3.179 1.00 1.34 C ATOM 713 C THR A 49 47.661 -19.475 -3.014 1.00 15.00 C ATOM 714 O THR A 49 48.694 -19.949 -2.518 1.00 52.25 O ATOM 715 CB THR A 49 45.337 -19.923 -2.195 1.00 51.02 C ATOM 716 OG1 THR A 49 45.814 -20.027 -0.853 1.00 64.22 O ATOM 717 CG2 THR A 49 44.116 -20.801 -2.339 1.00 61.52 C ATOM 0 H THR A 49 46.724 -22.008 -1.951 1.00 4.35 H new ATOM 0 HA THR A 49 46.051 -20.285 -4.191 1.00 1.34 H new ATOM 0 HB THR A 49 45.069 -18.892 -2.424 1.00 51.02 H new ATOM 0 HG1 THR A 49 45.249 -20.652 -0.352 1.00 64.22 H new ATOM 0 HG21 THR A 49 43.348 -20.474 -1.638 1.00 61.52 H new ATOM 0 HG22 THR A 49 43.733 -20.728 -3.357 1.00 61.52 H new ATOM 0 HG23 THR A 49 44.385 -21.836 -2.126 1.00 61.52 H new ATOM 725 N MET A 50 47.555 -18.213 -3.419 1.00 21.14 N ATOM 726 CA MET A 50 48.644 -17.242 -3.266 1.00 1.43 C ATOM 727 C MET A 50 49.155 -17.224 -1.838 1.00 72.53 C ATOM 728 O MET A 50 50.343 -17.370 -1.593 1.00 74.21 O ATOM 729 CB MET A 50 48.167 -15.840 -3.642 1.00 22.31 C ATOM 730 CG MET A 50 48.006 -15.587 -5.131 1.00 4.50 C ATOM 731 SD MET A 50 49.574 -15.698 -6.027 1.00 33.11 S ATOM 732 CE MET A 50 50.588 -14.582 -5.057 1.00 73.31 C ATOM 0 H MET A 50 46.718 -17.832 -3.861 1.00 21.14 H new ATOM 0 HA MET A 50 49.453 -17.543 -3.932 1.00 1.43 H new ATOM 0 HB2 MET A 50 47.210 -15.656 -3.153 1.00 22.31 H new ATOM 0 HB3 MET A 50 48.874 -15.114 -3.241 1.00 22.31 H new ATOM 0 HG2 MET A 50 47.303 -16.310 -5.545 1.00 4.50 H new ATOM 0 HG3 MET A 50 47.573 -14.598 -5.283 1.00 4.50 H new ATOM 0 HE1 MET A 50 51.472 -14.302 -5.630 1.00 73.31 H new ATOM 0 HE2 MET A 50 50.015 -13.687 -4.815 1.00 73.31 H new ATOM 0 HE3 MET A 50 50.895 -15.077 -4.136 1.00 73.31 H new ATOM 742 N LYS A 51 48.224 -17.109 -0.923 1.00 14.32 N ATOM 743 CA LYS A 51 48.462 -17.055 0.521 1.00 64.44 C ATOM 744 C LYS A 51 49.221 -18.301 1.002 1.00 30.11 C ATOM 745 O LYS A 51 50.104 -18.208 1.851 1.00 14.04 O ATOM 746 CB LYS A 51 47.086 -16.990 1.181 1.00 41.10 C ATOM 747 CG LYS A 51 47.045 -16.939 2.687 1.00 73.21 C ATOM 748 CD LYS A 51 45.605 -17.102 3.158 1.00 42.42 C ATOM 749 CE LYS A 51 45.473 -16.961 4.655 1.00 70.32 C ATOM 750 NZ LYS A 51 45.776 -15.595 5.095 1.00 25.31 N ATOM 0 H LYS A 51 47.234 -17.047 -1.162 1.00 14.32 H new ATOM 0 HA LYS A 51 49.073 -16.190 0.780 1.00 64.44 H new ATOM 0 HB2 LYS A 51 46.570 -16.109 0.799 1.00 41.10 H new ATOM 0 HB3 LYS A 51 46.515 -17.860 0.857 1.00 41.10 H new ATOM 0 HG2 LYS A 51 47.668 -17.729 3.106 1.00 73.21 H new ATOM 0 HG3 LYS A 51 47.450 -15.991 3.041 1.00 73.21 H new ATOM 0 HD2 LYS A 51 44.978 -16.357 2.668 1.00 42.42 H new ATOM 0 HD3 LYS A 51 45.234 -18.080 2.853 1.00 42.42 H new ATOM 0 HE2 LYS A 51 44.460 -17.226 4.959 1.00 70.32 H new ATOM 0 HE3 LYS A 51 46.147 -17.661 5.148 1.00 70.32 H new ATOM 0 HZ1 LYS A 51 45.515 -15.487 6.096 1.00 25.31 H new ATOM 0 HZ2 LYS A 51 46.793 -15.411 4.981 1.00 25.31 H new ATOM 0 HZ3 LYS A 51 45.235 -14.917 4.521 1.00 25.31 H new ATOM 764 N GLU A 52 48.905 -19.451 0.440 1.00 55.54 N ATOM 765 CA GLU A 52 49.564 -20.676 0.849 1.00 75.23 C ATOM 766 C GLU A 52 50.984 -20.722 0.332 1.00 14.34 C ATOM 767 O GLU A 52 51.862 -21.365 0.933 1.00 34.14 O ATOM 768 CB GLU A 52 48.813 -21.902 0.392 1.00 51.14 C ATOM 769 CG GLU A 52 47.384 -21.974 0.858 1.00 60.21 C ATOM 770 CD GLU A 52 47.227 -21.790 2.336 1.00 40.45 C ATOM 771 OE1 GLU A 52 47.493 -22.739 3.103 1.00 4.25 O ATOM 772 OE2 GLU A 52 46.745 -20.732 2.752 1.00 34.40 O ATOM 0 H GLU A 52 48.204 -19.563 -0.293 1.00 55.54 H new ATOM 0 HA GLU A 52 49.579 -20.678 1.939 1.00 75.23 H new ATOM 0 HB2 GLU A 52 48.828 -21.935 -0.697 1.00 51.14 H new ATOM 0 HB3 GLU A 52 49.341 -22.788 0.745 1.00 51.14 H new ATOM 0 HG2 GLU A 52 46.803 -21.210 0.341 1.00 60.21 H new ATOM 0 HG3 GLU A 52 46.966 -22.940 0.574 1.00 60.21 H new ATOM 779 N VAL A 53 51.223 -20.031 -0.778 1.00 43.32 N ATOM 780 CA VAL A 53 52.555 -19.929 -1.325 1.00 51.12 C ATOM 781 C VAL A 53 53.378 -19.166 -0.348 1.00 21.10 C ATOM 782 O VAL A 53 54.429 -19.595 -0.036 1.00 11.23 O ATOM 783 CB VAL A 53 52.589 -19.246 -2.704 1.00 30.31 C ATOM 784 CG1 VAL A 53 53.976 -19.306 -3.310 1.00 1.34 C ATOM 785 CG2 VAL A 53 51.582 -19.874 -3.624 1.00 10.42 C ATOM 0 H VAL A 53 50.507 -19.537 -1.310 1.00 43.32 H new ATOM 0 HA VAL A 53 52.949 -20.933 -1.483 1.00 51.12 H new ATOM 0 HB VAL A 53 52.329 -18.196 -2.568 1.00 30.31 H new ATOM 0 HG11 VAL A 53 53.969 -18.816 -4.284 1.00 1.34 H new ATOM 0 HG12 VAL A 53 54.682 -18.798 -2.653 1.00 1.34 H new ATOM 0 HG13 VAL A 53 54.276 -20.347 -3.430 1.00 1.34 H new ATOM 0 HG21 VAL A 53 51.618 -19.380 -4.595 1.00 10.42 H new ATOM 0 HG22 VAL A 53 51.812 -20.932 -3.747 1.00 10.42 H new ATOM 0 HG23 VAL A 53 50.584 -19.766 -3.199 1.00 10.42 H new ATOM 795 N LEU A 54 52.856 -18.050 0.176 1.00 70.30 N ATOM 796 CA LEU A 54 53.502 -17.327 1.257 1.00 2.43 C ATOM 797 C LEU A 54 53.961 -18.265 2.346 1.00 14.03 C ATOM 798 O LEU A 54 55.112 -18.226 2.750 1.00 21.52 O ATOM 799 CB LEU A 54 52.561 -16.312 1.879 1.00 11.33 C ATOM 800 CG LEU A 54 52.357 -15.006 1.144 1.00 21.01 C ATOM 801 CD1 LEU A 54 51.693 -15.129 -0.190 1.00 70.35 C ATOM 802 CD2 LEU A 54 51.720 -13.984 2.025 1.00 72.44 C ATOM 0 H LEU A 54 51.981 -17.633 -0.140 1.00 70.30 H new ATOM 0 HA LEU A 54 54.361 -16.818 0.820 1.00 2.43 H new ATOM 0 HB2 LEU A 54 51.587 -16.786 1.999 1.00 11.33 H new ATOM 0 HB3 LEU A 54 52.929 -16.081 2.879 1.00 11.33 H new ATOM 0 HG LEU A 54 53.357 -14.652 0.894 1.00 21.01 H new ATOM 0 HD11 LEU A 54 51.591 -14.141 -0.638 1.00 70.35 H new ATOM 0 HD12 LEU A 54 52.297 -15.762 -0.840 1.00 70.35 H new ATOM 0 HD13 LEU A 54 50.706 -15.574 -0.065 1.00 70.35 H new ATOM 0 HD21 LEU A 54 51.586 -13.056 1.469 1.00 72.44 H new ATOM 0 HD22 LEU A 54 50.749 -14.348 2.362 1.00 72.44 H new ATOM 0 HD23 LEU A 54 52.358 -13.800 2.889 1.00 72.44 H new ATOM 814 N PHE A 55 53.097 -19.166 2.744 1.00 3.44 N ATOM 815 CA PHE A 55 53.429 -20.049 3.831 1.00 31.34 C ATOM 816 C PHE A 55 54.576 -20.967 3.466 1.00 34.30 C ATOM 817 O PHE A 55 55.600 -20.942 4.112 1.00 13.01 O ATOM 818 CB PHE A 55 52.223 -20.845 4.337 1.00 43.03 C ATOM 819 CG PHE A 55 51.109 -19.986 4.862 1.00 50.44 C ATOM 820 CD1 PHE A 55 51.369 -18.918 5.711 1.00 43.53 C ATOM 821 CD2 PHE A 55 49.807 -20.232 4.494 1.00 13.12 C ATOM 822 CE1 PHE A 55 50.345 -18.125 6.176 1.00 44.21 C ATOM 823 CE2 PHE A 55 48.782 -19.442 4.956 1.00 72.04 C ATOM 824 CZ PHE A 55 49.049 -18.391 5.797 1.00 42.14 C ATOM 0 H PHE A 55 52.172 -19.305 2.338 1.00 3.44 H new ATOM 0 HA PHE A 55 53.752 -19.414 4.656 1.00 31.34 H new ATOM 0 HB2 PHE A 55 51.841 -21.464 3.525 1.00 43.03 H new ATOM 0 HB3 PHE A 55 52.551 -21.522 5.126 1.00 43.03 H new ATOM 0 HD1 PHE A 55 52.385 -18.708 6.009 1.00 43.53 H new ATOM 0 HD2 PHE A 55 49.587 -21.057 3.833 1.00 13.12 H new ATOM 0 HE1 PHE A 55 50.558 -17.297 6.836 1.00 44.21 H new ATOM 0 HE2 PHE A 55 47.765 -19.648 4.657 1.00 72.04 H new ATOM 0 HZ PHE A 55 48.242 -17.773 6.161 1.00 42.14 H new ATOM 834 N TYR A 56 54.437 -21.710 2.404 1.00 63.30 N ATOM 835 CA TYR A 56 55.452 -22.685 2.040 1.00 1.22 C ATOM 836 C TYR A 56 56.689 -22.067 1.387 1.00 62.54 C ATOM 837 O TYR A 56 57.809 -22.515 1.645 1.00 21.03 O ATOM 838 CB TYR A 56 54.875 -23.786 1.173 1.00 51.34 C ATOM 839 CG TYR A 56 53.818 -24.596 1.864 1.00 64.03 C ATOM 840 CD1 TYR A 56 54.148 -25.438 2.911 1.00 33.42 C ATOM 841 CD2 TYR A 56 52.494 -24.508 1.483 1.00 1.33 C ATOM 842 CE1 TYR A 56 53.184 -26.179 3.560 1.00 32.12 C ATOM 843 CE2 TYR A 56 51.519 -25.242 2.127 1.00 50.53 C ATOM 844 CZ TYR A 56 51.870 -26.079 3.163 1.00 61.21 C ATOM 845 OH TYR A 56 50.904 -26.817 3.811 1.00 44.45 O ATOM 0 H TYR A 56 53.638 -21.667 1.771 1.00 63.30 H new ATOM 0 HA TYR A 56 55.791 -23.122 2.979 1.00 1.22 H new ATOM 0 HB2 TYR A 56 54.452 -23.344 0.271 1.00 51.34 H new ATOM 0 HB3 TYR A 56 55.680 -24.448 0.856 1.00 51.34 H new ATOM 0 HD1 TYR A 56 55.178 -25.516 3.225 1.00 33.42 H new ATOM 0 HD2 TYR A 56 52.217 -23.855 0.669 1.00 1.33 H new ATOM 0 HE1 TYR A 56 53.458 -26.833 4.374 1.00 32.12 H new ATOM 0 HE2 TYR A 56 50.487 -25.161 1.820 1.00 50.53 H new ATOM 0 HH TYR A 56 50.028 -26.632 3.412 1.00 44.45 H new ATOM 855 N LEU A 57 56.500 -21.026 0.577 1.00 33.41 N ATOM 856 CA LEU A 57 57.611 -20.376 -0.110 1.00 40.31 C ATOM 857 C LEU A 57 58.520 -19.763 0.948 1.00 40.54 C ATOM 858 O LEU A 57 59.754 -19.853 0.879 1.00 5.14 O ATOM 859 CB LEU A 57 57.088 -19.296 -1.109 1.00 53.03 C ATOM 860 CG LEU A 57 57.983 -18.890 -2.308 1.00 24.54 C ATOM 861 CD1 LEU A 57 57.269 -17.890 -3.194 1.00 53.32 C ATOM 862 CD2 LEU A 57 59.312 -18.322 -1.889 1.00 3.30 C ATOM 0 H LEU A 57 55.587 -20.616 0.382 1.00 33.41 H new ATOM 0 HA LEU A 57 58.171 -21.103 -0.699 1.00 40.31 H new ATOM 0 HB2 LEU A 57 56.139 -19.651 -1.511 1.00 53.03 H new ATOM 0 HB3 LEU A 57 56.874 -18.393 -0.537 1.00 53.03 H new ATOM 0 HG LEU A 57 58.179 -19.809 -2.861 1.00 24.54 H new ATOM 0 HD11 LEU A 57 57.914 -17.618 -4.029 1.00 53.32 H new ATOM 0 HD12 LEU A 57 56.349 -18.333 -3.575 1.00 53.32 H new ATOM 0 HD13 LEU A 57 57.029 -16.998 -2.616 1.00 53.32 H new ATOM 0 HD21 LEU A 57 59.890 -18.058 -2.774 1.00 3.30 H new ATOM 0 HD22 LEU A 57 59.152 -17.431 -1.281 1.00 3.30 H new ATOM 0 HD23 LEU A 57 59.858 -19.065 -1.307 1.00 3.30 H new ATOM 874 N GLY A 58 57.879 -19.218 1.965 1.00 34.05 N ATOM 875 CA GLY A 58 58.575 -18.601 3.060 1.00 74.30 C ATOM 876 C GLY A 58 59.390 -19.588 3.841 1.00 10.41 C ATOM 877 O GLY A 58 60.515 -19.278 4.233 1.00 32.52 O ATOM 0 H GLY A 58 56.863 -19.195 2.048 1.00 34.05 H new ATOM 0 HA2 GLY A 58 59.227 -17.816 2.678 1.00 74.30 H new ATOM 0 HA3 GLY A 58 57.854 -18.122 3.723 1.00 74.30 H new ATOM 881 N GLN A 59 58.847 -20.804 4.031 1.00 63.23 N ATOM 882 CA GLN A 59 59.547 -21.843 4.779 1.00 64.13 C ATOM 883 C GLN A 59 60.862 -22.138 4.100 1.00 12.12 C ATOM 884 O GLN A 59 61.894 -22.130 4.734 1.00 60.00 O ATOM 885 CB GLN A 59 58.748 -23.155 4.850 1.00 61.45 C ATOM 886 CG GLN A 59 57.312 -23.019 5.301 1.00 71.21 C ATOM 887 CD GLN A 59 57.139 -22.394 6.665 1.00 24.51 C ATOM 888 OE1 GLN A 59 57.969 -22.549 7.566 1.00 74.24 O ATOM 889 NE2 GLN A 59 56.086 -21.640 6.806 1.00 73.55 N ATOM 0 H GLN A 59 57.932 -21.082 3.677 1.00 63.23 H new ATOM 0 HA GLN A 59 59.689 -21.470 5.793 1.00 64.13 H new ATOM 0 HB2 GLN A 59 58.758 -23.620 3.864 1.00 61.45 H new ATOM 0 HB3 GLN A 59 59.261 -23.836 5.529 1.00 61.45 H new ATOM 0 HG2 GLN A 59 56.770 -22.419 4.570 1.00 71.21 H new ATOM 0 HG3 GLN A 59 56.852 -24.007 5.307 1.00 71.21 H new ATOM 0 HE21 GLN A 59 55.424 -21.539 6.036 1.00 73.55 H new ATOM 0 HE22 GLN A 59 55.923 -21.151 7.686 1.00 73.55 H new ATOM 898 N TYR A 60 60.803 -22.325 2.786 1.00 52.35 N ATOM 899 CA TYR A 60 61.962 -22.687 1.977 1.00 12.25 C ATOM 900 C TYR A 60 63.086 -21.657 2.086 1.00 54.12 C ATOM 901 O TYR A 60 64.235 -22.009 2.335 1.00 53.15 O ATOM 902 CB TYR A 60 61.538 -22.883 0.514 1.00 33.44 C ATOM 903 CG TYR A 60 62.645 -23.358 -0.410 1.00 22.14 C ATOM 904 CD1 TYR A 60 63.135 -24.653 -0.326 1.00 22.44 C ATOM 905 CD2 TYR A 60 63.189 -22.515 -1.374 1.00 3.25 C ATOM 906 CE1 TYR A 60 64.131 -25.097 -1.172 1.00 63.13 C ATOM 907 CE2 TYR A 60 64.185 -22.955 -2.228 1.00 41.23 C ATOM 908 CZ TYR A 60 64.651 -24.246 -2.123 1.00 64.01 C ATOM 909 OH TYR A 60 65.647 -24.693 -2.969 1.00 62.05 O ATOM 0 H TYR A 60 59.942 -22.229 2.247 1.00 52.35 H new ATOM 0 HA TYR A 60 62.358 -23.626 2.363 1.00 12.25 H new ATOM 0 HB2 TYR A 60 60.721 -23.604 0.480 1.00 33.44 H new ATOM 0 HB3 TYR A 60 61.146 -21.939 0.134 1.00 33.44 H new ATOM 0 HD1 TYR A 60 62.730 -25.326 0.415 1.00 22.44 H new ATOM 0 HD2 TYR A 60 62.828 -21.501 -1.457 1.00 3.25 H new ATOM 0 HE1 TYR A 60 64.502 -26.108 -1.089 1.00 63.13 H new ATOM 0 HE2 TYR A 60 64.595 -22.289 -2.973 1.00 41.23 H new ATOM 0 HH TYR A 60 66.271 -23.961 -3.156 1.00 62.05 H new ATOM 919 N ILE A 61 62.744 -20.397 1.974 1.00 22.33 N ATOM 920 CA ILE A 61 63.742 -19.333 1.998 1.00 54.32 C ATOM 921 C ILE A 61 64.323 -19.213 3.391 1.00 22.41 C ATOM 922 O ILE A 61 65.545 -19.053 3.577 1.00 45.34 O ATOM 923 CB ILE A 61 63.120 -17.968 1.625 1.00 71.30 C ATOM 924 CG1 ILE A 61 62.446 -18.028 0.263 1.00 3.12 C ATOM 925 CG2 ILE A 61 64.181 -16.862 1.636 1.00 71.24 C ATOM 926 CD1 ILE A 61 61.783 -16.732 -0.134 1.00 12.42 C ATOM 0 H ILE A 61 61.783 -20.073 1.865 1.00 22.33 H new ATOM 0 HA ILE A 61 64.513 -19.589 1.271 1.00 54.32 H new ATOM 0 HB ILE A 61 62.365 -17.735 2.375 1.00 71.30 H new ATOM 0 HG12 ILE A 61 63.188 -18.294 -0.490 1.00 3.12 H new ATOM 0 HG13 ILE A 61 61.700 -18.822 0.270 1.00 3.12 H new ATOM 0 HG21 ILE A 61 63.718 -15.911 1.370 1.00 71.24 H new ATOM 0 HG22 ILE A 61 64.618 -16.787 2.632 1.00 71.24 H new ATOM 0 HG23 ILE A 61 64.962 -17.100 0.914 1.00 71.24 H new ATOM 0 HD11 ILE A 61 61.322 -16.845 -1.115 1.00 12.42 H new ATOM 0 HD12 ILE A 61 61.018 -16.475 0.599 1.00 12.42 H new ATOM 0 HD13 ILE A 61 62.529 -15.938 -0.173 1.00 12.42 H new ATOM 938 N MET A 62 63.452 -19.323 4.355 1.00 72.44 N ATOM 939 CA MET A 62 63.804 -19.136 5.727 1.00 41.23 C ATOM 940 C MET A 62 64.613 -20.293 6.275 1.00 61.21 C ATOM 941 O MET A 62 65.593 -20.073 6.935 1.00 12.42 O ATOM 942 CB MET A 62 62.563 -18.921 6.560 1.00 32.32 C ATOM 943 CG MET A 62 62.830 -18.599 8.010 1.00 13.52 C ATOM 944 SD MET A 62 61.326 -18.263 8.951 1.00 44.31 S ATOM 945 CE MET A 62 60.406 -19.787 8.714 1.00 63.31 C ATOM 0 H MET A 62 62.468 -19.547 4.204 1.00 72.44 H new ATOM 0 HA MET A 62 64.434 -18.248 5.782 1.00 41.23 H new ATOM 0 HB2 MET A 62 61.983 -18.109 6.122 1.00 32.32 H new ATOM 0 HB3 MET A 62 61.946 -19.818 6.508 1.00 32.32 H new ATOM 0 HG2 MET A 62 63.360 -19.433 8.469 1.00 13.52 H new ATOM 0 HG3 MET A 62 63.489 -17.732 8.068 1.00 13.52 H new ATOM 0 HE1 MET A 62 59.615 -19.854 9.461 1.00 63.31 H new ATOM 0 HE2 MET A 62 59.965 -19.795 7.717 1.00 63.31 H new ATOM 0 HE3 MET A 62 61.079 -20.638 8.820 1.00 63.31 H new ATOM 955 N THR A 63 64.217 -21.512 5.956 1.00 24.30 N ATOM 956 CA THR A 63 64.867 -22.706 6.497 1.00 13.21 C ATOM 957 C THR A 63 66.300 -22.854 5.974 1.00 64.20 C ATOM 958 O THR A 63 67.178 -23.370 6.668 1.00 74.44 O ATOM 959 CB THR A 63 64.039 -24.012 6.213 1.00 32.20 C ATOM 960 OG1 THR A 63 64.602 -25.135 6.908 1.00 73.21 O ATOM 961 CG2 THR A 63 63.985 -24.343 4.727 1.00 71.34 C ATOM 0 H THR A 63 63.443 -21.708 5.321 1.00 24.30 H new ATOM 0 HA THR A 63 64.911 -22.571 7.578 1.00 13.21 H new ATOM 0 HB THR A 63 63.027 -23.819 6.569 1.00 32.20 H new ATOM 0 HG1 THR A 63 64.071 -25.937 6.719 1.00 73.21 H new ATOM 0 HG21 THR A 63 63.403 -25.252 4.578 1.00 71.34 H new ATOM 0 HG22 THR A 63 63.516 -23.520 4.188 1.00 71.34 H new ATOM 0 HG23 THR A 63 64.997 -24.494 4.351 1.00 71.34 H new ATOM 969 N LYS A 64 66.538 -22.373 4.771 1.00 74.50 N ATOM 970 CA LYS A 64 67.851 -22.475 4.168 1.00 35.22 C ATOM 971 C LYS A 64 68.650 -21.234 4.505 1.00 24.12 C ATOM 972 O LYS A 64 69.879 -21.251 4.487 1.00 50.03 O ATOM 973 CB LYS A 64 67.736 -22.592 2.648 1.00 41.22 C ATOM 974 CG LYS A 64 66.775 -23.658 2.153 1.00 22.42 C ATOM 975 CD LYS A 64 67.142 -25.060 2.599 1.00 13.51 C ATOM 976 CE LYS A 64 66.097 -26.055 2.121 1.00 12.10 C ATOM 977 NZ LYS A 64 66.409 -27.444 2.506 1.00 42.24 N ATOM 0 H LYS A 64 65.839 -21.908 4.192 1.00 74.50 H new ATOM 0 HA LYS A 64 68.347 -23.364 4.556 1.00 35.22 H new ATOM 0 HB2 LYS A 64 67.422 -21.628 2.248 1.00 41.22 H new ATOM 0 HB3 LYS A 64 68.725 -22.799 2.240 1.00 41.22 H new ATOM 0 HG2 LYS A 64 65.771 -23.424 2.508 1.00 22.42 H new ATOM 0 HG3 LYS A 64 66.743 -23.629 1.064 1.00 22.42 H new ATOM 0 HD2 LYS A 64 68.120 -25.331 2.202 1.00 13.51 H new ATOM 0 HD3 LYS A 64 67.218 -25.095 3.686 1.00 13.51 H new ATOM 0 HE2 LYS A 64 65.125 -25.779 2.531 1.00 12.10 H new ATOM 0 HE3 LYS A 64 66.014 -25.994 1.036 1.00 12.10 H new ATOM 0 HZ1 LYS A 64 65.663 -28.078 2.154 1.00 42.24 H new ATOM 0 HZ2 LYS A 64 67.323 -27.722 2.094 1.00 42.24 H new ATOM 0 HZ3 LYS A 64 66.462 -27.514 3.542 1.00 42.24 H new ATOM 991 N ARG A 65 67.921 -20.167 4.839 1.00 62.41 N ATOM 992 CA ARG A 65 68.501 -18.855 5.121 1.00 10.24 C ATOM 993 C ARG A 65 69.176 -18.289 3.873 1.00 55.32 C ATOM 994 O ARG A 65 70.400 -18.239 3.768 1.00 33.21 O ATOM 995 CB ARG A 65 69.450 -18.804 6.360 1.00 10.13 C ATOM 996 CG ARG A 65 68.782 -18.993 7.732 1.00 12.01 C ATOM 997 CD ARG A 65 68.360 -20.430 7.988 1.00 0.21 C ATOM 998 NE ARG A 65 67.579 -20.582 9.230 1.00 35.32 N ATOM 999 CZ ARG A 65 67.613 -21.659 10.035 1.00 62.31 C ATOM 1000 NH1 ARG A 65 68.540 -22.603 9.867 1.00 53.35 N ATOM 1001 NH2 ARG A 65 66.752 -21.762 11.043 1.00 23.34 N ATOM 0 H ARG A 65 66.905 -20.191 4.922 1.00 62.41 H new ATOM 0 HA ARG A 65 67.661 -18.219 5.400 1.00 10.24 H new ATOM 0 HB2 ARG A 65 70.212 -19.574 6.240 1.00 10.13 H new ATOM 0 HB3 ARG A 65 69.965 -17.843 6.359 1.00 10.13 H new ATOM 0 HG2 ARG A 65 69.473 -18.677 8.514 1.00 12.01 H new ATOM 0 HG3 ARG A 65 67.908 -18.345 7.798 1.00 12.01 H new ATOM 0 HD2 ARG A 65 67.767 -20.786 7.145 1.00 0.21 H new ATOM 0 HD3 ARG A 65 69.247 -21.061 8.042 1.00 0.21 H new ATOM 0 HE ARG A 65 66.967 -19.812 9.499 1.00 35.32 H new ATOM 0 HH11 ARG A 65 69.232 -22.512 9.123 1.00 53.35 H new ATOM 0 HH12 ARG A 65 68.557 -23.416 10.483 1.00 53.35 H new ATOM 0 HH21 ARG A 65 66.066 -21.025 11.205 1.00 23.34 H new ATOM 0 HH22 ARG A 65 66.777 -22.578 11.654 1.00 23.34 H new ATOM 1015 N LEU A 66 68.358 -17.976 2.888 1.00 53.51 N ATOM 1016 CA LEU A 66 68.836 -17.419 1.620 1.00 71.15 C ATOM 1017 C LEU A 66 68.593 -15.914 1.580 1.00 32.04 C ATOM 1018 O LEU A 66 68.711 -15.260 0.526 1.00 73.22 O ATOM 1019 CB LEU A 66 68.119 -18.102 0.456 1.00 33.23 C ATOM 1020 CG LEU A 66 68.327 -19.614 0.326 1.00 74.22 C ATOM 1021 CD1 LEU A 66 67.444 -20.181 -0.770 1.00 34.12 C ATOM 1022 CD2 LEU A 66 69.791 -19.942 0.050 1.00 42.44 C ATOM 0 H LEU A 66 67.346 -18.097 2.935 1.00 53.51 H new ATOM 0 HA LEU A 66 69.908 -17.598 1.533 1.00 71.15 H new ATOM 0 HB2 LEU A 66 67.050 -17.910 0.552 1.00 33.23 H new ATOM 0 HB3 LEU A 66 68.445 -17.631 -0.471 1.00 33.23 H new ATOM 0 HG LEU A 66 68.047 -20.075 1.273 1.00 74.22 H new ATOM 0 HD11 LEU A 66 67.606 -21.256 -0.848 1.00 34.12 H new ATOM 0 HD12 LEU A 66 66.398 -19.987 -0.531 1.00 34.12 H new ATOM 0 HD13 LEU A 66 67.693 -19.707 -1.720 1.00 34.12 H new ATOM 0 HD21 LEU A 66 69.912 -21.022 -0.038 1.00 42.44 H new ATOM 0 HD22 LEU A 66 70.102 -19.465 -0.880 1.00 42.44 H new ATOM 0 HD23 LEU A 66 70.407 -19.574 0.870 1.00 42.44 H new ATOM 1034 N TYR A 67 68.261 -15.372 2.726 1.00 50.33 N ATOM 1035 CA TYR A 67 67.994 -13.964 2.859 1.00 63.44 C ATOM 1036 C TYR A 67 69.163 -13.280 3.555 1.00 41.21 C ATOM 1037 O TYR A 67 70.081 -13.962 4.032 1.00 0.14 O ATOM 1038 CB TYR A 67 66.660 -13.716 3.594 1.00 32.51 C ATOM 1039 CG TYR A 67 66.588 -14.256 5.011 1.00 55.05 C ATOM 1040 CD1 TYR A 67 67.024 -13.495 6.081 1.00 24.21 C ATOM 1041 CD2 TYR A 67 66.071 -15.520 5.277 1.00 64.31 C ATOM 1042 CE1 TYR A 67 66.956 -13.968 7.369 1.00 3.00 C ATOM 1043 CE2 TYR A 67 66.002 -15.998 6.570 1.00 44.51 C ATOM 1044 CZ TYR A 67 66.446 -15.215 7.609 1.00 62.24 C ATOM 1045 OH TYR A 67 66.378 -15.684 8.898 1.00 52.04 O ATOM 0 H TYR A 67 68.168 -15.898 3.595 1.00 50.33 H new ATOM 0 HA TYR A 67 67.889 -13.529 1.865 1.00 63.44 H new ATOM 0 HB2 TYR A 67 66.474 -12.642 3.622 1.00 32.51 H new ATOM 0 HB3 TYR A 67 65.855 -14.163 3.011 1.00 32.51 H new ATOM 0 HD1 TYR A 67 67.426 -12.509 5.900 1.00 24.21 H new ATOM 0 HD2 TYR A 67 65.719 -16.135 4.462 1.00 64.31 H new ATOM 0 HE1 TYR A 67 67.304 -13.358 8.189 1.00 3.00 H new ATOM 0 HE2 TYR A 67 65.601 -16.982 6.764 1.00 44.51 H new ATOM 0 HH TYR A 67 65.991 -16.584 8.899 1.00 52.04 H new ATOM 1055 N ASP A 68 69.122 -11.970 3.638 1.00 63.44 N ATOM 1056 CA ASP A 68 70.212 -11.208 4.220 1.00 21.32 C ATOM 1057 C ASP A 68 70.216 -11.329 5.717 1.00 52.35 C ATOM 1058 O ASP A 68 69.175 -11.294 6.370 1.00 13.34 O ATOM 1059 CB ASP A 68 70.159 -9.735 3.833 1.00 1.00 C ATOM 1060 CG ASP A 68 71.412 -8.996 4.235 1.00 51.10 C ATOM 1061 OD1 ASP A 68 72.434 -9.104 3.539 1.00 62.33 O ATOM 1062 OD2 ASP A 68 71.406 -8.306 5.243 1.00 24.12 O ATOM 0 H ASP A 68 68.341 -11.403 3.308 1.00 63.44 H new ATOM 0 HA ASP A 68 71.132 -11.632 3.818 1.00 21.32 H new ATOM 0 HB2 ASP A 68 70.018 -9.649 2.756 1.00 1.00 H new ATOM 0 HB3 ASP A 68 69.295 -9.267 4.306 1.00 1.00 H new ATOM 1067 N GLU A 69 71.384 -11.473 6.243 1.00 63.22 N ATOM 1068 CA GLU A 69 71.581 -11.621 7.664 1.00 62.14 C ATOM 1069 C GLU A 69 71.349 -10.320 8.447 1.00 64.00 C ATOM 1070 O GLU A 69 71.047 -10.365 9.637 1.00 30.11 O ATOM 1071 CB GLU A 69 72.960 -12.193 7.932 1.00 42.41 C ATOM 1072 CG GLU A 69 74.072 -11.447 7.225 1.00 61.33 C ATOM 1073 CD GLU A 69 75.400 -12.087 7.415 1.00 74.11 C ATOM 1074 OE1 GLU A 69 75.643 -13.146 6.816 1.00 24.54 O ATOM 1075 OE2 GLU A 69 76.237 -11.533 8.158 1.00 52.31 O ATOM 0 H GLU A 69 72.247 -11.493 5.700 1.00 63.22 H new ATOM 0 HA GLU A 69 70.825 -12.317 8.027 1.00 62.14 H new ATOM 0 HB2 GLU A 69 73.148 -12.178 9.005 1.00 42.41 H new ATOM 0 HB3 GLU A 69 72.978 -13.237 7.620 1.00 42.41 H new ATOM 0 HG2 GLU A 69 73.848 -11.393 6.160 1.00 61.33 H new ATOM 0 HG3 GLU A 69 74.110 -10.423 7.595 1.00 61.33 H new ATOM 1082 N LYS A 70 71.476 -9.170 7.801 1.00 21.31 N ATOM 1083 CA LYS A 70 71.274 -7.913 8.513 1.00 43.13 C ATOM 1084 C LYS A 70 69.882 -7.395 8.175 1.00 3.23 C ATOM 1085 O LYS A 70 69.222 -6.727 8.987 1.00 14.52 O ATOM 1086 CB LYS A 70 72.246 -6.828 8.026 1.00 51.11 C ATOM 1087 CG LYS A 70 73.573 -7.288 7.439 1.00 5.05 C ATOM 1088 CD LYS A 70 74.536 -7.900 8.431 1.00 31.00 C ATOM 1089 CE LYS A 70 75.852 -8.210 7.727 1.00 65.43 C ATOM 1090 NZ LYS A 70 76.799 -8.932 8.583 1.00 33.03 N ATOM 0 H LYS A 70 71.711 -9.078 6.813 1.00 21.31 H new ATOM 0 HA LYS A 70 71.422 -8.104 9.576 1.00 43.13 H new ATOM 0 HB2 LYS A 70 71.733 -6.230 7.272 1.00 51.11 H new ATOM 0 HB3 LYS A 70 72.460 -6.167 8.865 1.00 51.11 H new ATOM 0 HG2 LYS A 70 73.372 -8.017 6.654 1.00 5.05 H new ATOM 0 HG3 LYS A 70 74.058 -6.435 6.965 1.00 5.05 H new ATOM 0 HD2 LYS A 70 74.707 -7.214 9.261 1.00 31.00 H new ATOM 0 HD3 LYS A 70 74.112 -8.811 8.853 1.00 31.00 H new ATOM 0 HE2 LYS A 70 75.650 -8.803 6.835 1.00 65.43 H new ATOM 0 HE3 LYS A 70 76.309 -7.278 7.394 1.00 65.43 H new ATOM 0 HZ1 LYS A 70 77.737 -8.488 8.515 1.00 33.03 H new ATOM 0 HZ2 LYS A 70 76.471 -8.898 9.569 1.00 33.03 H new ATOM 0 HZ3 LYS A 70 76.862 -9.923 8.273 1.00 33.03 H new ATOM 1104 N GLN A 71 69.444 -7.705 6.974 1.00 50.03 N ATOM 1105 CA GLN A 71 68.168 -7.269 6.471 1.00 5.34 C ATOM 1106 C GLN A 71 67.317 -8.456 6.107 1.00 62.15 C ATOM 1107 O GLN A 71 67.437 -8.992 5.023 1.00 64.52 O ATOM 1108 CB GLN A 71 68.362 -6.413 5.219 1.00 3.32 C ATOM 1109 CG GLN A 71 69.153 -5.134 5.414 1.00 21.51 C ATOM 1110 CD GLN A 71 68.398 -4.063 6.167 1.00 43.20 C ATOM 1111 OE1 GLN A 71 67.559 -4.337 7.028 1.00 23.33 O ATOM 1112 NE2 GLN A 71 68.653 -2.841 5.816 1.00 3.50 N ATOM 0 H GLN A 71 69.974 -8.274 6.314 1.00 50.03 H new ATOM 0 HA GLN A 71 67.677 -6.686 7.250 1.00 5.34 H new ATOM 0 HB2 GLN A 71 68.863 -7.017 4.462 1.00 3.32 H new ATOM 0 HB3 GLN A 71 67.380 -6.155 4.822 1.00 3.32 H new ATOM 0 HG2 GLN A 71 70.073 -5.364 5.952 1.00 21.51 H new ATOM 0 HG3 GLN A 71 69.443 -4.744 4.438 1.00 21.51 H new ATOM 0 HE21 GLN A 71 69.354 -2.652 5.100 1.00 3.50 H new ATOM 0 HE22 GLN A 71 68.153 -2.069 6.256 1.00 3.50 H new ATOM 1121 N GLN A 72 66.452 -8.855 6.991 1.00 33.03 N ATOM 1122 CA GLN A 72 65.598 -9.988 6.738 1.00 64.41 C ATOM 1123 C GLN A 72 64.568 -9.691 5.659 1.00 73.12 C ATOM 1124 O GLN A 72 64.028 -10.599 5.046 1.00 1.14 O ATOM 1125 CB GLN A 72 64.947 -10.482 8.010 1.00 2.34 C ATOM 1126 CG GLN A 72 65.954 -10.909 9.055 1.00 64.34 C ATOM 1127 CD GLN A 72 65.337 -11.733 10.146 1.00 20.23 C ATOM 1128 OE1 GLN A 72 64.169 -11.586 10.464 1.00 21.44 O ATOM 1129 NE2 GLN A 72 66.109 -12.600 10.728 1.00 52.04 N ATOM 0 H GLN A 72 66.315 -8.413 7.900 1.00 33.03 H new ATOM 0 HA GLN A 72 66.230 -10.792 6.361 1.00 64.41 H new ATOM 0 HB2 GLN A 72 64.316 -9.693 8.420 1.00 2.34 H new ATOM 0 HB3 GLN A 72 64.294 -11.323 7.776 1.00 2.34 H new ATOM 0 HG2 GLN A 72 66.748 -11.482 8.577 1.00 64.34 H new ATOM 0 HG3 GLN A 72 66.418 -10.024 9.491 1.00 64.34 H new ATOM 0 HE21 GLN A 72 67.081 -12.695 10.435 1.00 52.04 H new ATOM 0 HE22 GLN A 72 65.743 -13.186 11.478 1.00 52.04 H new ATOM 1138 N HIS A 73 64.288 -8.405 5.428 1.00 20.12 N ATOM 1139 CA HIS A 73 63.388 -8.009 4.353 1.00 23.35 C ATOM 1140 C HIS A 73 64.069 -8.088 2.978 1.00 72.14 C ATOM 1141 O HIS A 73 63.444 -7.819 1.949 1.00 10.11 O ATOM 1142 CB HIS A 73 62.783 -6.591 4.597 1.00 41.31 C ATOM 1143 CG HIS A 73 63.718 -5.411 4.403 1.00 54.10 C ATOM 1144 ND1 HIS A 73 64.394 -4.798 5.428 1.00 32.14 N ATOM 1145 CD2 HIS A 73 64.036 -4.714 3.287 1.00 65.33 C ATOM 1146 CE1 HIS A 73 65.085 -3.785 4.963 1.00 3.33 C ATOM 1147 NE2 HIS A 73 64.888 -3.710 3.663 1.00 73.14 N ATOM 0 H HIS A 73 64.671 -7.629 5.969 1.00 20.12 H new ATOM 0 HA HIS A 73 62.565 -8.724 4.354 1.00 23.35 H new ATOM 0 HB2 HIS A 73 61.931 -6.464 3.929 1.00 41.31 H new ATOM 0 HB3 HIS A 73 62.397 -6.556 5.616 1.00 41.31 H new ATOM 0 HD2 HIS A 73 63.683 -4.913 2.286 1.00 65.33 H new ATOM 0 HE1 HIS A 73 65.709 -3.125 5.547 1.00 3.33 H new ATOM 0 HE2 HIS A 73 65.302 -3.018 3.039 1.00 73.14 H new ATOM 1155 N ILE A 74 65.323 -8.459 2.982 1.00 50.14 N ATOM 1156 CA ILE A 74 66.114 -8.572 1.784 1.00 22.31 C ATOM 1157 C ILE A 74 66.453 -10.016 1.567 1.00 55.40 C ATOM 1158 O ILE A 74 67.070 -10.653 2.414 1.00 73.00 O ATOM 1159 CB ILE A 74 67.416 -7.712 1.843 1.00 31.00 C ATOM 1160 CG1 ILE A 74 67.079 -6.218 1.870 1.00 41.50 C ATOM 1161 CG2 ILE A 74 68.360 -8.024 0.680 1.00 3.51 C ATOM 1162 CD1 ILE A 74 66.255 -5.761 0.684 1.00 73.44 C ATOM 0 H ILE A 74 65.832 -8.695 3.833 1.00 50.14 H new ATOM 0 HA ILE A 74 65.527 -8.188 0.950 1.00 22.31 H new ATOM 0 HB ILE A 74 67.933 -7.973 2.766 1.00 31.00 H new ATOM 0 HG12 ILE A 74 66.536 -5.993 2.788 1.00 41.50 H new ATOM 0 HG13 ILE A 74 68.006 -5.645 1.900 1.00 41.50 H new ATOM 0 HG21 ILE A 74 69.253 -7.404 0.760 1.00 3.51 H new ATOM 0 HG22 ILE A 74 68.644 -9.076 0.714 1.00 3.51 H new ATOM 0 HG23 ILE A 74 67.856 -7.815 -0.264 1.00 3.51 H new ATOM 0 HD11 ILE A 74 66.054 -4.693 0.770 1.00 73.44 H new ATOM 0 HD12 ILE A 74 66.805 -5.954 -0.237 1.00 73.44 H new ATOM 0 HD13 ILE A 74 65.312 -6.307 0.664 1.00 73.44 H new ATOM 1174 N VAL A 75 66.024 -10.544 0.467 1.00 45.43 N ATOM 1175 CA VAL A 75 66.272 -11.906 0.170 1.00 24.42 C ATOM 1176 C VAL A 75 67.110 -11.981 -1.089 1.00 52.54 C ATOM 1177 O VAL A 75 66.821 -11.296 -2.062 1.00 42.31 O ATOM 1178 CB VAL A 75 64.957 -12.683 -0.030 1.00 63.14 C ATOM 1179 CG1 VAL A 75 65.241 -14.143 -0.170 1.00 1.24 C ATOM 1180 CG2 VAL A 75 63.988 -12.440 1.114 1.00 11.12 C ATOM 0 H VAL A 75 65.494 -10.041 -0.245 1.00 45.43 H new ATOM 0 HA VAL A 75 66.802 -12.361 1.007 1.00 24.42 H new ATOM 0 HB VAL A 75 64.487 -12.321 -0.944 1.00 63.14 H new ATOM 0 HG11 VAL A 75 64.305 -14.684 -0.311 1.00 1.24 H new ATOM 0 HG12 VAL A 75 65.888 -14.307 -1.032 1.00 1.24 H new ATOM 0 HG13 VAL A 75 65.737 -14.505 0.730 1.00 1.24 H new ATOM 0 HG21 VAL A 75 63.071 -13.003 0.940 1.00 11.12 H new ATOM 0 HG22 VAL A 75 64.442 -12.765 2.050 1.00 11.12 H new ATOM 0 HG23 VAL A 75 63.755 -11.377 1.174 1.00 11.12 H new ATOM 1190 N TYR A 76 68.146 -12.779 -1.075 1.00 5.33 N ATOM 1191 CA TYR A 76 68.994 -12.883 -2.233 1.00 2.23 C ATOM 1192 C TYR A 76 68.598 -14.061 -3.071 1.00 20.23 C ATOM 1193 O TYR A 76 68.056 -13.889 -4.157 1.00 22.13 O ATOM 1194 CB TYR A 76 70.471 -12.956 -1.840 1.00 71.42 C ATOM 1195 CG TYR A 76 70.928 -11.740 -1.088 1.00 63.21 C ATOM 1196 CD1 TYR A 76 71.120 -10.531 -1.743 1.00 72.11 C ATOM 1197 CD2 TYR A 76 71.138 -11.781 0.279 1.00 34.51 C ATOM 1198 CE1 TYR A 76 71.511 -9.404 -1.057 1.00 3.12 C ATOM 1199 CE2 TYR A 76 71.521 -10.664 0.961 1.00 53.13 C ATOM 1200 CZ TYR A 76 71.705 -9.478 0.299 1.00 44.23 C ATOM 1201 OH TYR A 76 72.088 -8.358 1.003 1.00 11.02 O ATOM 0 H TYR A 76 68.421 -13.361 -0.283 1.00 5.33 H new ATOM 0 HA TYR A 76 68.861 -11.980 -2.829 1.00 2.23 H new ATOM 0 HB2 TYR A 76 70.637 -13.842 -1.227 1.00 71.42 H new ATOM 0 HB3 TYR A 76 71.077 -13.072 -2.738 1.00 71.42 H new ATOM 0 HD1 TYR A 76 70.960 -10.474 -2.810 1.00 72.11 H new ATOM 0 HD2 TYR A 76 70.997 -12.709 0.813 1.00 34.51 H new ATOM 0 HE1 TYR A 76 71.663 -8.472 -1.580 1.00 3.12 H new ATOM 0 HE2 TYR A 76 71.680 -10.714 2.028 1.00 53.13 H new ATOM 0 HH TYR A 76 72.393 -8.621 1.896 1.00 11.02 H new ATOM 1211 N CYS A 77 68.825 -15.260 -2.538 1.00 54.53 N ATOM 1212 CA CYS A 77 68.536 -16.516 -3.236 1.00 52.14 C ATOM 1213 C CYS A 77 69.291 -16.617 -4.557 1.00 4.33 C ATOM 1214 O CYS A 77 68.903 -17.368 -5.441 1.00 62.20 O ATOM 1215 CB CYS A 77 67.043 -16.676 -3.474 1.00 61.41 C ATOM 1216 SG CYS A 77 66.072 -16.701 -1.970 1.00 54.33 S ATOM 0 H CYS A 77 69.217 -15.391 -1.605 1.00 54.53 H new ATOM 0 HA CYS A 77 68.878 -17.325 -2.591 1.00 52.14 H new ATOM 0 HB2 CYS A 77 66.695 -15.859 -4.107 1.00 61.41 H new ATOM 0 HB3 CYS A 77 66.869 -17.601 -4.024 1.00 61.41 H new ATOM 0 HG CYS A 77 66.765 -16.186 -0.998 1.00 54.33 H new ATOM 1222 N SER A 78 70.401 -15.922 -4.650 1.00 74.53 N ATOM 1223 CA SER A 78 71.207 -15.911 -5.841 1.00 1.24 C ATOM 1224 C SER A 78 71.955 -17.234 -5.965 1.00 20.30 C ATOM 1225 O SER A 78 72.366 -17.640 -7.058 1.00 21.43 O ATOM 1226 CB SER A 78 72.161 -14.746 -5.761 1.00 41.00 C ATOM 1227 OG SER A 78 71.440 -13.567 -5.448 1.00 62.31 O ATOM 0 H SER A 78 70.770 -15.345 -3.894 1.00 74.53 H new ATOM 0 HA SER A 78 70.583 -15.797 -6.728 1.00 1.24 H new ATOM 0 HB2 SER A 78 72.919 -14.934 -5.001 1.00 41.00 H new ATOM 0 HB3 SER A 78 72.684 -14.624 -6.710 1.00 41.00 H new ATOM 0 HG SER A 78 70.741 -13.423 -6.120 1.00 62.31 H new ATOM 1233 N ASN A 79 72.092 -17.912 -4.840 1.00 41.54 N ATOM 1234 CA ASN A 79 72.712 -19.220 -4.784 1.00 73.42 C ATOM 1235 C ASN A 79 71.690 -20.302 -5.155 1.00 0.00 C ATOM 1236 O ASN A 79 72.042 -21.444 -5.455 1.00 53.23 O ATOM 1237 CB ASN A 79 73.281 -19.456 -3.373 1.00 72.51 C ATOM 1238 CG ASN A 79 73.997 -20.778 -3.231 1.00 60.42 C ATOM 1239 OD1 ASN A 79 75.187 -20.891 -3.534 1.00 34.51 O ATOM 1240 ND2 ASN A 79 73.314 -21.769 -2.733 1.00 12.14 N ATOM 0 H ASN A 79 71.774 -17.567 -3.935 1.00 41.54 H new ATOM 0 HA ASN A 79 73.530 -19.270 -5.502 1.00 73.42 H new ATOM 0 HB2 ASN A 79 73.971 -18.649 -3.127 1.00 72.51 H new ATOM 0 HB3 ASN A 79 72.468 -19.412 -2.649 1.00 72.51 H new ATOM 0 HD21 ASN A 79 73.762 -22.673 -2.583 1.00 12.14 H new ATOM 0 HD22 ASN A 79 72.331 -21.641 -2.493 1.00 12.14 H new ATOM 1247 N ASP A 80 70.431 -19.926 -5.188 1.00 63.10 N ATOM 1248 CA ASP A 80 69.356 -20.863 -5.481 1.00 44.31 C ATOM 1249 C ASP A 80 68.724 -20.462 -6.820 1.00 54.24 C ATOM 1250 O ASP A 80 69.103 -19.438 -7.401 1.00 62.42 O ATOM 1251 CB ASP A 80 68.310 -20.844 -4.343 1.00 54.35 C ATOM 1252 CG ASP A 80 67.349 -22.024 -4.383 1.00 4.01 C ATOM 1253 OD1 ASP A 80 66.357 -21.979 -5.144 1.00 31.11 O ATOM 1254 OD2 ASP A 80 67.585 -23.020 -3.649 1.00 51.55 O ATOM 0 H ASP A 80 70.119 -18.970 -5.015 1.00 63.10 H new ATOM 0 HA ASP A 80 69.744 -21.879 -5.553 1.00 44.31 H new ATOM 0 HB2 ASP A 80 68.828 -20.840 -3.384 1.00 54.35 H new ATOM 0 HB3 ASP A 80 67.738 -19.918 -4.401 1.00 54.35 H new ATOM 1259 N LEU A 81 67.816 -21.248 -7.329 1.00 71.31 N ATOM 1260 CA LEU A 81 67.204 -20.948 -8.599 1.00 11.32 C ATOM 1261 C LEU A 81 65.902 -20.151 -8.392 1.00 12.11 C ATOM 1262 O LEU A 81 65.478 -19.429 -9.293 1.00 75.03 O ATOM 1263 CB LEU A 81 66.972 -22.265 -9.398 1.00 25.11 C ATOM 1264 CG LEU A 81 66.842 -22.198 -10.954 1.00 40.03 C ATOM 1265 CD1 LEU A 81 65.568 -21.525 -11.426 1.00 43.44 C ATOM 1266 CD2 LEU A 81 68.043 -21.495 -11.550 1.00 21.25 C ATOM 0 H LEU A 81 67.481 -22.103 -6.885 1.00 71.31 H new ATOM 0 HA LEU A 81 67.872 -20.319 -9.188 1.00 11.32 H new ATOM 0 HB2 LEU A 81 67.796 -22.939 -9.166 1.00 25.11 H new ATOM 0 HB3 LEU A 81 66.064 -22.728 -9.012 1.00 25.11 H new ATOM 0 HG LEU A 81 66.799 -23.230 -11.301 1.00 40.03 H new ATOM 0 HD11 LEU A 81 65.545 -21.514 -12.516 1.00 43.44 H new ATOM 0 HD12 LEU A 81 64.705 -22.075 -11.050 1.00 43.44 H new ATOM 0 HD13 LEU A 81 65.537 -20.502 -11.052 1.00 43.44 H new ATOM 0 HD21 LEU A 81 67.940 -21.455 -12.634 1.00 21.25 H new ATOM 0 HD22 LEU A 81 68.105 -20.481 -11.154 1.00 21.25 H new ATOM 0 HD23 LEU A 81 68.950 -22.042 -11.292 1.00 21.25 H new ATOM 1278 N LEU A 82 65.303 -20.245 -7.175 1.00 22.23 N ATOM 1279 CA LEU A 82 63.971 -19.632 -6.893 1.00 31.14 C ATOM 1280 C LEU A 82 63.892 -18.172 -7.360 1.00 51.53 C ATOM 1281 O LEU A 82 62.968 -17.799 -8.074 1.00 75.13 O ATOM 1282 CB LEU A 82 63.553 -19.775 -5.372 1.00 51.31 C ATOM 1283 CG LEU A 82 64.060 -18.712 -4.342 1.00 44.45 C ATOM 1284 CD1 LEU A 82 63.202 -17.449 -4.328 1.00 51.52 C ATOM 1285 CD2 LEU A 82 64.124 -19.260 -2.953 1.00 64.25 C ATOM 0 H LEU A 82 65.714 -20.733 -6.379 1.00 22.23 H new ATOM 0 HA LEU A 82 63.247 -20.197 -7.480 1.00 31.14 H new ATOM 0 HB2 LEU A 82 62.464 -19.781 -5.329 1.00 51.31 H new ATOM 0 HB3 LEU A 82 63.891 -20.753 -5.029 1.00 51.31 H new ATOM 0 HG LEU A 82 65.064 -18.451 -4.676 1.00 44.45 H new ATOM 0 HD11 LEU A 82 63.600 -16.747 -3.595 1.00 51.52 H new ATOM 0 HD12 LEU A 82 63.216 -16.989 -5.316 1.00 51.52 H new ATOM 0 HD13 LEU A 82 62.177 -17.708 -4.063 1.00 51.52 H new ATOM 0 HD21 LEU A 82 64.481 -18.487 -2.273 1.00 64.25 H new ATOM 0 HD22 LEU A 82 63.130 -19.585 -2.644 1.00 64.25 H new ATOM 0 HD23 LEU A 82 64.807 -20.109 -2.928 1.00 64.25 H new ATOM 1297 N GLY A 83 64.902 -17.377 -7.002 1.00 33.33 N ATOM 1298 CA GLY A 83 64.887 -15.969 -7.322 1.00 13.41 C ATOM 1299 C GLY A 83 65.011 -15.741 -8.792 1.00 23.02 C ATOM 1300 O GLY A 83 64.233 -14.963 -9.393 1.00 63.21 O ATOM 0 H GLY A 83 65.729 -17.691 -6.495 1.00 33.33 H new ATOM 0 HA2 GLY A 83 63.961 -15.522 -6.960 1.00 13.41 H new ATOM 0 HA3 GLY A 83 65.706 -15.468 -6.805 1.00 13.41 H new ATOM 1304 N ASP A 84 65.940 -16.471 -9.393 1.00 74.23 N ATOM 1305 CA ASP A 84 66.232 -16.341 -10.806 1.00 72.30 C ATOM 1306 C ASP A 84 64.957 -16.511 -11.586 1.00 60.45 C ATOM 1307 O ASP A 84 64.550 -15.595 -12.294 1.00 21.25 O ATOM 1308 CB ASP A 84 67.266 -17.376 -11.253 1.00 32.43 C ATOM 1309 CG ASP A 84 67.758 -17.142 -12.668 1.00 23.04 C ATOM 1310 OD1 ASP A 84 67.053 -17.490 -13.638 1.00 34.12 O ATOM 1311 OD2 ASP A 84 68.886 -16.602 -12.831 1.00 12.11 O ATOM 0 H ASP A 84 66.509 -17.168 -8.912 1.00 74.23 H new ATOM 0 HA ASP A 84 66.652 -15.352 -10.991 1.00 72.30 H new ATOM 0 HB2 ASP A 84 68.115 -17.353 -10.570 1.00 32.43 H new ATOM 0 HB3 ASP A 84 66.829 -18.372 -11.185 1.00 32.43 H new ATOM 1316 N LEU A 85 64.269 -17.625 -11.287 1.00 51.32 N ATOM 1317 CA LEU A 85 63.020 -18.073 -11.888 1.00 55.15 C ATOM 1318 C LEU A 85 61.922 -17.029 -11.754 1.00 45.10 C ATOM 1319 O LEU A 85 61.053 -16.887 -12.631 1.00 62.02 O ATOM 1320 CB LEU A 85 62.600 -19.289 -11.121 1.00 35.13 C ATOM 1321 CG LEU A 85 61.449 -20.083 -11.674 1.00 61.13 C ATOM 1322 CD1 LEU A 85 61.796 -20.713 -13.018 1.00 14.13 C ATOM 1323 CD2 LEU A 85 60.992 -21.123 -10.676 1.00 34.22 C ATOM 0 H LEU A 85 64.599 -18.273 -10.572 1.00 51.32 H new ATOM 0 HA LEU A 85 63.172 -18.264 -12.950 1.00 55.15 H new ATOM 0 HB2 LEU A 85 63.461 -19.952 -11.040 1.00 35.13 H new ATOM 0 HB3 LEU A 85 62.341 -18.978 -10.109 1.00 35.13 H new ATOM 0 HG LEU A 85 60.621 -19.396 -11.849 1.00 61.13 H new ATOM 0 HD11 LEU A 85 60.940 -21.279 -13.386 1.00 14.13 H new ATOM 0 HD12 LEU A 85 62.048 -19.930 -13.733 1.00 14.13 H new ATOM 0 HD13 LEU A 85 62.648 -21.382 -12.897 1.00 14.13 H new ATOM 0 HD21 LEU A 85 60.159 -21.687 -11.094 1.00 34.22 H new ATOM 0 HD22 LEU A 85 61.816 -21.802 -10.455 1.00 34.22 H new ATOM 0 HD23 LEU A 85 60.672 -20.630 -9.758 1.00 34.22 H new ATOM 1335 N PHE A 86 61.954 -16.323 -10.654 1.00 13.22 N ATOM 1336 CA PHE A 86 61.021 -15.250 -10.368 1.00 14.21 C ATOM 1337 C PHE A 86 61.314 -14.043 -11.224 1.00 25.43 C ATOM 1338 O PHE A 86 60.524 -13.111 -11.309 1.00 74.23 O ATOM 1339 CB PHE A 86 61.091 -14.896 -8.897 1.00 60.11 C ATOM 1340 CG PHE A 86 60.431 -15.902 -7.973 1.00 12.33 C ATOM 1341 CD1 PHE A 86 59.526 -16.854 -8.455 1.00 60.04 C ATOM 1342 CD2 PHE A 86 60.712 -15.897 -6.623 1.00 61.20 C ATOM 1343 CE1 PHE A 86 58.932 -17.761 -7.610 1.00 63.23 C ATOM 1344 CE2 PHE A 86 60.112 -16.808 -5.773 1.00 21.42 C ATOM 1345 CZ PHE A 86 59.224 -17.739 -6.270 1.00 2.54 C ATOM 0 H PHE A 86 62.640 -16.476 -9.914 1.00 13.22 H new ATOM 0 HA PHE A 86 60.011 -15.586 -10.604 1.00 14.21 H new ATOM 0 HB2 PHE A 86 62.138 -14.792 -8.611 1.00 60.11 H new ATOM 0 HB3 PHE A 86 60.622 -13.923 -8.748 1.00 60.11 H new ATOM 0 HD1 PHE A 86 59.290 -16.877 -9.509 1.00 60.04 H new ATOM 0 HD2 PHE A 86 61.408 -15.174 -6.225 1.00 61.20 H new ATOM 0 HE1 PHE A 86 58.237 -18.489 -8.000 1.00 63.23 H new ATOM 0 HE2 PHE A 86 60.339 -16.790 -4.717 1.00 21.42 H new ATOM 0 HZ PHE A 86 58.759 -18.451 -5.604 1.00 2.54 H new ATOM 1355 N GLY A 87 62.450 -14.082 -11.835 1.00 24.41 N ATOM 1356 CA GLY A 87 62.855 -13.054 -12.754 1.00 31.24 C ATOM 1357 C GLY A 87 63.770 -12.091 -12.094 1.00 3.13 C ATOM 1358 O GLY A 87 64.002 -10.968 -12.594 1.00 20.13 O ATOM 0 H GLY A 87 63.133 -14.830 -11.715 1.00 24.41 H new ATOM 0 HA2 GLY A 87 63.351 -13.503 -13.614 1.00 31.24 H new ATOM 0 HA3 GLY A 87 61.977 -12.529 -13.130 1.00 31.24 H new ATOM 1362 N VAL A 88 64.316 -12.507 -10.987 1.00 0.24 N ATOM 1363 CA VAL A 88 65.145 -11.605 -10.198 1.00 65.43 C ATOM 1364 C VAL A 88 66.480 -12.213 -9.767 1.00 62.04 C ATOM 1365 O VAL A 88 66.654 -13.417 -9.779 1.00 2.43 O ATOM 1366 CB VAL A 88 64.390 -11.050 -8.949 1.00 34.42 C ATOM 1367 CG1 VAL A 88 63.213 -10.169 -9.342 1.00 53.13 C ATOM 1368 CG2 VAL A 88 63.935 -12.166 -8.026 1.00 52.45 C ATOM 0 H VAL A 88 64.212 -13.447 -10.605 1.00 0.24 H new ATOM 0 HA VAL A 88 65.369 -10.779 -10.873 1.00 65.43 H new ATOM 0 HB VAL A 88 65.103 -10.431 -8.405 1.00 34.42 H new ATOM 0 HG11 VAL A 88 62.716 -9.804 -8.443 1.00 53.13 H new ATOM 0 HG12 VAL A 88 63.572 -9.322 -9.927 1.00 53.13 H new ATOM 0 HG13 VAL A 88 62.507 -10.749 -9.937 1.00 53.13 H new ATOM 0 HG21 VAL A 88 63.414 -11.740 -7.169 1.00 52.45 H new ATOM 0 HG22 VAL A 88 63.262 -12.832 -8.565 1.00 52.45 H new ATOM 0 HG23 VAL A 88 64.802 -12.728 -7.680 1.00 52.45 H new ATOM 1378 N PRO A 89 67.477 -11.374 -9.463 1.00 11.32 N ATOM 1379 CA PRO A 89 68.728 -11.840 -8.871 1.00 74.43 C ATOM 1380 C PRO A 89 68.573 -11.977 -7.350 1.00 61.01 C ATOM 1381 O PRO A 89 69.184 -12.838 -6.714 1.00 1.24 O ATOM 1382 CB PRO A 89 69.719 -10.704 -9.193 1.00 25.13 C ATOM 1383 CG PRO A 89 68.977 -9.760 -10.091 1.00 40.51 C ATOM 1384 CD PRO A 89 67.534 -9.934 -9.757 1.00 22.11 C ATOM 0 HA PRO A 89 69.044 -12.812 -9.250 1.00 74.43 H new ATOM 0 HB2 PRO A 89 70.048 -10.202 -8.283 1.00 25.13 H new ATOM 0 HB3 PRO A 89 70.612 -11.091 -9.684 1.00 25.13 H new ATOM 0 HG2 PRO A 89 69.296 -8.731 -9.926 1.00 40.51 H new ATOM 0 HG3 PRO A 89 69.166 -9.988 -11.140 1.00 40.51 H new ATOM 0 HD2 PRO A 89 67.234 -9.328 -8.902 1.00 22.11 H new ATOM 0 HD3 PRO A 89 66.884 -9.658 -10.587 1.00 22.11 H new ATOM 1392 N SER A 90 67.749 -11.106 -6.796 1.00 72.45 N ATOM 1393 CA SER A 90 67.437 -11.001 -5.391 1.00 0.12 C ATOM 1394 C SER A 90 66.107 -10.260 -5.310 1.00 72.25 C ATOM 1395 O SER A 90 65.692 -9.652 -6.319 1.00 42.34 O ATOM 1396 CB SER A 90 68.541 -10.213 -4.673 1.00 14.22 C ATOM 1397 OG SER A 90 69.792 -10.871 -4.813 1.00 32.43 O ATOM 0 H SER A 90 67.251 -10.412 -7.354 1.00 72.45 H new ATOM 0 HA SER A 90 67.370 -11.979 -4.913 1.00 0.12 H new ATOM 0 HB2 SER A 90 68.605 -9.206 -5.086 1.00 14.22 H new ATOM 0 HB3 SER A 90 68.294 -10.109 -3.616 1.00 14.22 H new ATOM 0 HG SER A 90 69.647 -11.784 -5.139 1.00 32.43 H new ATOM 1403 N PHE A 91 65.449 -10.263 -4.165 1.00 22.52 N ATOM 1404 CA PHE A 91 64.145 -9.657 -4.088 1.00 23.10 C ATOM 1405 C PHE A 91 63.878 -9.069 -2.696 1.00 42.12 C ATOM 1406 O PHE A 91 64.415 -9.555 -1.692 1.00 74.32 O ATOM 1407 CB PHE A 91 63.048 -10.680 -4.517 1.00 64.21 C ATOM 1408 CG PHE A 91 62.609 -11.732 -3.496 1.00 51.33 C ATOM 1409 CD1 PHE A 91 61.590 -11.418 -2.628 1.00 4.31 C ATOM 1410 CD2 PHE A 91 63.156 -13.043 -3.427 1.00 11.25 C ATOM 1411 CE1 PHE A 91 61.118 -12.318 -1.731 1.00 61.22 C ATOM 1412 CE2 PHE A 91 62.669 -13.939 -2.508 1.00 2.33 C ATOM 1413 CZ PHE A 91 61.649 -13.576 -1.663 1.00 72.40 C ATOM 0 H PHE A 91 65.792 -10.671 -3.295 1.00 22.52 H new ATOM 0 HA PHE A 91 64.111 -8.821 -4.786 1.00 23.10 H new ATOM 0 HB2 PHE A 91 62.165 -10.116 -4.817 1.00 64.21 H new ATOM 0 HB3 PHE A 91 63.408 -11.204 -5.403 1.00 64.21 H new ATOM 0 HD1 PHE A 91 61.155 -10.430 -2.662 1.00 4.31 H new ATOM 0 HD2 PHE A 91 63.953 -13.333 -4.096 1.00 11.25 H new ATOM 0 HE1 PHE A 91 60.316 -12.039 -1.064 1.00 61.22 H new ATOM 0 HE2 PHE A 91 63.089 -14.932 -2.449 1.00 2.33 H new ATOM 0 HZ PHE A 91 61.266 -14.285 -0.944 1.00 72.40 H new ATOM 1423 N SER A 92 63.093 -8.017 -2.643 1.00 13.21 N ATOM 1424 CA SER A 92 62.722 -7.410 -1.399 1.00 63.42 C ATOM 1425 C SER A 92 61.295 -7.804 -1.072 1.00 12.35 C ATOM 1426 O SER A 92 60.383 -7.595 -1.878 1.00 65.40 O ATOM 1427 CB SER A 92 62.848 -5.878 -1.499 1.00 64.34 C ATOM 1428 OG SER A 92 62.521 -5.230 -0.268 1.00 72.34 O ATOM 0 H SER A 92 62.697 -7.563 -3.466 1.00 13.21 H new ATOM 0 HA SER A 92 63.386 -7.754 -0.606 1.00 63.42 H new ATOM 0 HB2 SER A 92 63.866 -5.617 -1.786 1.00 64.34 H new ATOM 0 HB3 SER A 92 62.190 -5.511 -2.287 1.00 64.34 H new ATOM 0 HG SER A 92 62.615 -4.260 -0.374 1.00 72.34 H new ATOM 1434 N VAL A 93 61.094 -8.355 0.112 1.00 15.21 N ATOM 1435 CA VAL A 93 59.768 -8.793 0.556 1.00 44.32 C ATOM 1436 C VAL A 93 58.828 -7.601 0.768 1.00 70.53 C ATOM 1437 O VAL A 93 57.612 -7.763 0.892 1.00 62.34 O ATOM 1438 CB VAL A 93 59.852 -9.598 1.864 1.00 54.24 C ATOM 1439 CG1 VAL A 93 60.752 -10.796 1.703 1.00 62.31 C ATOM 1440 CG2 VAL A 93 60.336 -8.725 2.994 1.00 71.25 C ATOM 0 H VAL A 93 61.835 -8.514 0.794 1.00 15.21 H new ATOM 0 HA VAL A 93 59.369 -9.430 -0.234 1.00 44.32 H new ATOM 0 HB VAL A 93 58.851 -9.955 2.105 1.00 54.24 H new ATOM 0 HG11 VAL A 93 60.794 -11.348 2.642 1.00 62.31 H new ATOM 0 HG12 VAL A 93 60.359 -11.443 0.919 1.00 62.31 H new ATOM 0 HG13 VAL A 93 61.754 -10.464 1.432 1.00 62.31 H new ATOM 0 HG21 VAL A 93 60.389 -9.312 3.911 1.00 71.25 H new ATOM 0 HG22 VAL A 93 61.326 -8.336 2.755 1.00 71.25 H new ATOM 0 HG23 VAL A 93 59.644 -7.895 3.134 1.00 71.25 H new ATOM 1450 N LYS A 94 59.413 -6.409 0.830 1.00 25.30 N ATOM 1451 CA LYS A 94 58.666 -5.188 1.002 1.00 34.12 C ATOM 1452 C LYS A 94 57.839 -4.879 -0.223 1.00 43.13 C ATOM 1453 O LYS A 94 56.822 -4.203 -0.139 1.00 62.22 O ATOM 1454 CB LYS A 94 59.604 -4.045 1.361 1.00 44.32 C ATOM 1455 CG LYS A 94 60.245 -4.228 2.721 1.00 11.41 C ATOM 1456 CD LYS A 94 59.228 -4.026 3.837 1.00 61.24 C ATOM 1457 CE LYS A 94 59.776 -4.468 5.182 1.00 64.21 C ATOM 1458 NZ LYS A 94 58.961 -3.975 6.312 1.00 40.32 N ATOM 0 H LYS A 94 60.421 -6.272 0.761 1.00 25.30 H new ATOM 0 HA LYS A 94 57.968 -5.318 1.829 1.00 34.12 H new ATOM 0 HB2 LYS A 94 60.383 -3.967 0.603 1.00 44.32 H new ATOM 0 HB3 LYS A 94 59.050 -3.106 1.347 1.00 44.32 H new ATOM 0 HG2 LYS A 94 60.675 -5.227 2.793 1.00 11.41 H new ATOM 0 HG3 LYS A 94 61.065 -3.519 2.839 1.00 11.41 H new ATOM 0 HD2 LYS A 94 58.946 -2.974 3.887 1.00 61.24 H new ATOM 0 HD3 LYS A 94 58.322 -4.588 3.610 1.00 61.24 H new ATOM 0 HE2 LYS A 94 59.817 -5.557 5.215 1.00 64.21 H new ATOM 0 HE3 LYS A 94 60.799 -4.107 5.291 1.00 64.21 H new ATOM 0 HZ1 LYS A 94 59.552 -3.393 6.939 1.00 40.32 H new ATOM 0 HZ2 LYS A 94 58.173 -3.402 5.948 1.00 40.32 H new ATOM 0 HZ3 LYS A 94 58.583 -4.783 6.846 1.00 40.32 H new ATOM 1472 N GLU A 95 58.247 -5.391 -1.353 1.00 41.22 N ATOM 1473 CA GLU A 95 57.476 -5.231 -2.546 1.00 25.25 C ATOM 1474 C GLU A 95 56.467 -6.327 -2.673 1.00 44.21 C ATOM 1475 O GLU A 95 56.651 -7.292 -3.404 1.00 11.24 O ATOM 1476 CB GLU A 95 58.308 -5.182 -3.762 1.00 62.12 C ATOM 1477 CG GLU A 95 59.054 -3.884 -3.971 1.00 1.24 C ATOM 1478 CD GLU A 95 58.100 -2.745 -4.278 1.00 20.02 C ATOM 1479 OE1 GLU A 95 57.437 -2.229 -3.359 1.00 30.24 O ATOM 1480 OE2 GLU A 95 57.972 -2.357 -5.453 1.00 35.23 O ATOM 0 H GLU A 95 59.110 -5.922 -1.468 1.00 41.22 H new ATOM 0 HA GLU A 95 56.968 -4.270 -2.457 1.00 25.25 H new ATOM 0 HB2 GLU A 95 59.031 -5.997 -3.723 1.00 62.12 H new ATOM 0 HB3 GLU A 95 57.671 -5.362 -4.628 1.00 62.12 H new ATOM 0 HG2 GLU A 95 59.633 -3.646 -3.078 1.00 1.24 H new ATOM 0 HG3 GLU A 95 59.764 -3.998 -4.790 1.00 1.24 H new ATOM 1487 N HIS A 96 55.417 -6.151 -1.970 1.00 61.03 N ATOM 1488 CA HIS A 96 54.328 -7.130 -1.870 1.00 22.11 C ATOM 1489 C HIS A 96 53.695 -7.413 -3.228 1.00 24.20 C ATOM 1490 O HIS A 96 53.288 -8.531 -3.505 1.00 4.12 O ATOM 1491 CB HIS A 96 53.251 -6.747 -0.798 1.00 0.11 C ATOM 1492 CG HIS A 96 52.373 -5.547 -1.102 1.00 4.44 C ATOM 1493 ND1 HIS A 96 52.654 -4.268 -0.677 1.00 0.33 N ATOM 1494 CD2 HIS A 96 51.196 -5.459 -1.769 1.00 64.43 C ATOM 1495 CE1 HIS A 96 51.708 -3.449 -1.062 1.00 53.21 C ATOM 1496 NE2 HIS A 96 50.803 -4.144 -1.732 1.00 71.43 N ATOM 0 H HIS A 96 55.255 -5.308 -1.420 1.00 61.03 H new ATOM 0 HA HIS A 96 54.787 -8.055 -1.520 1.00 22.11 H new ATOM 0 HB2 HIS A 96 52.604 -7.610 -0.645 1.00 0.11 H new ATOM 0 HB3 HIS A 96 53.764 -6.561 0.146 1.00 0.11 H new ATOM 0 HD2 HIS A 96 50.666 -6.272 -2.242 1.00 64.43 H new ATOM 0 HE1 HIS A 96 51.672 -2.387 -0.866 1.00 53.21 H new ATOM 0 HE2 HIS A 96 49.954 -3.765 -2.152 1.00 71.43 H new ATOM 1504 N ARG A 97 53.655 -6.405 -4.088 1.00 61.45 N ATOM 1505 CA ARG A 97 53.080 -6.586 -5.406 1.00 2.00 C ATOM 1506 C ARG A 97 54.026 -7.351 -6.305 1.00 60.51 C ATOM 1507 O ARG A 97 53.596 -8.127 -7.143 1.00 63.44 O ATOM 1508 CB ARG A 97 52.643 -5.268 -6.031 1.00 25.22 C ATOM 1509 CG ARG A 97 51.472 -4.620 -5.324 1.00 31.52 C ATOM 1510 CD ARG A 97 51.050 -3.337 -6.003 1.00 61.22 C ATOM 1511 NE ARG A 97 49.898 -2.730 -5.337 1.00 52.14 N ATOM 1512 CZ ARG A 97 49.513 -1.456 -5.471 1.00 35.43 C ATOM 1513 NH1 ARG A 97 50.172 -0.632 -6.284 1.00 32.04 N ATOM 1514 NH2 ARG A 97 48.465 -1.012 -4.795 1.00 50.15 N ATOM 0 H ARG A 97 54.009 -5.468 -3.898 1.00 61.45 H new ATOM 0 HA ARG A 97 52.175 -7.183 -5.289 1.00 2.00 H new ATOM 0 HB2 ARG A 97 53.486 -4.577 -6.028 1.00 25.22 H new ATOM 0 HB3 ARG A 97 52.377 -5.441 -7.074 1.00 25.22 H new ATOM 0 HG2 ARG A 97 50.631 -5.313 -5.301 1.00 31.52 H new ATOM 0 HG3 ARG A 97 51.742 -4.412 -4.289 1.00 31.52 H new ATOM 0 HD2 ARG A 97 51.883 -2.634 -6.004 1.00 61.22 H new ATOM 0 HD3 ARG A 97 50.803 -3.540 -7.045 1.00 61.22 H new ATOM 0 HE ARG A 97 49.344 -3.326 -4.721 1.00 52.14 H new ATOM 0 HH11 ARG A 97 50.977 -0.971 -6.810 1.00 32.04 H new ATOM 0 HH12 ARG A 97 49.871 0.338 -6.380 1.00 32.04 H new ATOM 0 HH21 ARG A 97 47.954 -1.641 -4.175 1.00 50.15 H new ATOM 0 HH22 ARG A 97 48.168 -0.041 -4.894 1.00 50.15 H new ATOM 1528 N LYS A 98 55.322 -7.185 -6.076 1.00 3.30 N ATOM 1529 CA LYS A 98 56.313 -7.932 -6.841 1.00 1.24 C ATOM 1530 C LYS A 98 56.356 -9.359 -6.378 1.00 33.20 C ATOM 1531 O LYS A 98 56.755 -10.250 -7.122 1.00 63.32 O ATOM 1532 CB LYS A 98 57.719 -7.303 -6.828 1.00 62.12 C ATOM 1533 CG LYS A 98 57.906 -6.095 -7.757 1.00 4.31 C ATOM 1534 CD LYS A 98 57.054 -4.906 -7.359 1.00 4.22 C ATOM 1535 CE LYS A 98 57.280 -3.727 -8.293 1.00 21.35 C ATOM 1536 NZ LYS A 98 56.618 -2.504 -7.792 1.00 63.10 N ATOM 0 H LYS A 98 55.708 -6.550 -5.378 1.00 3.30 H new ATOM 0 HA LYS A 98 55.990 -7.895 -7.881 1.00 1.24 H new ATOM 0 HB2 LYS A 98 57.952 -6.996 -5.808 1.00 62.12 H new ATOM 0 HB3 LYS A 98 58.444 -8.069 -7.104 1.00 62.12 H new ATOM 0 HG2 LYS A 98 58.955 -5.800 -7.755 1.00 4.31 H new ATOM 0 HG3 LYS A 98 57.659 -6.387 -8.778 1.00 4.31 H new ATOM 0 HD2 LYS A 98 56.001 -5.189 -7.375 1.00 4.22 H new ATOM 0 HD3 LYS A 98 57.290 -4.613 -6.336 1.00 4.22 H new ATOM 0 HE2 LYS A 98 58.350 -3.546 -8.399 1.00 21.35 H new ATOM 0 HE3 LYS A 98 56.898 -3.969 -9.285 1.00 21.35 H new ATOM 0 HZ1 LYS A 98 56.834 -1.708 -8.425 1.00 63.10 H new ATOM 0 HZ2 LYS A 98 55.589 -2.653 -7.762 1.00 63.10 H new ATOM 0 HZ3 LYS A 98 56.964 -2.289 -6.835 1.00 63.10 H new ATOM 1550 N ILE A 99 55.930 -9.578 -5.147 1.00 54.20 N ATOM 1551 CA ILE A 99 55.809 -10.918 -4.626 1.00 3.41 C ATOM 1552 C ILE A 99 54.701 -11.618 -5.380 1.00 32.52 C ATOM 1553 O ILE A 99 54.853 -12.748 -5.825 1.00 34.24 O ATOM 1554 CB ILE A 99 55.493 -10.952 -3.112 1.00 74.14 C ATOM 1555 CG1 ILE A 99 56.522 -10.141 -2.310 1.00 62.20 C ATOM 1556 CG2 ILE A 99 55.429 -12.388 -2.610 1.00 53.21 C ATOM 1557 CD1 ILE A 99 57.964 -10.474 -2.602 1.00 13.25 C ATOM 0 H ILE A 99 55.663 -8.842 -4.493 1.00 54.20 H new ATOM 0 HA ILE A 99 56.769 -11.417 -4.760 1.00 3.41 H new ATOM 0 HB ILE A 99 54.517 -10.491 -2.963 1.00 74.14 H new ATOM 0 HG12 ILE A 99 56.362 -9.081 -2.509 1.00 62.20 H new ATOM 0 HG13 ILE A 99 56.337 -10.297 -1.247 1.00 62.20 H new ATOM 0 HG21 ILE A 99 55.206 -12.391 -1.543 1.00 53.21 H new ATOM 0 HG22 ILE A 99 54.647 -12.926 -3.146 1.00 53.21 H new ATOM 0 HG23 ILE A 99 56.388 -12.876 -2.781 1.00 53.21 H new ATOM 0 HD11 ILE A 99 58.613 -9.850 -1.988 1.00 13.25 H new ATOM 0 HD12 ILE A 99 58.148 -11.524 -2.374 1.00 13.25 H new ATOM 0 HD13 ILE A 99 58.174 -10.289 -3.655 1.00 13.25 H new ATOM 1569 N TYR A 100 53.593 -10.920 -5.559 1.00 43.11 N ATOM 1570 CA TYR A 100 52.488 -11.456 -6.319 1.00 15.13 C ATOM 1571 C TYR A 100 52.929 -11.748 -7.729 1.00 34.44 C ATOM 1572 O TYR A 100 52.709 -12.837 -8.229 1.00 3.54 O ATOM 1573 CB TYR A 100 51.299 -10.498 -6.361 1.00 21.14 C ATOM 1574 CG TYR A 100 50.799 -10.051 -5.013 1.00 60.15 C ATOM 1575 CD1 TYR A 100 50.865 -10.881 -3.900 1.00 64.34 C ATOM 1576 CD2 TYR A 100 50.257 -8.794 -4.858 1.00 74.45 C ATOM 1577 CE1 TYR A 100 50.404 -10.466 -2.676 1.00 62.13 C ATOM 1578 CE2 TYR A 100 49.794 -8.364 -3.643 1.00 71.11 C ATOM 1579 CZ TYR A 100 49.866 -9.200 -2.550 1.00 51.34 C ATOM 1580 OH TYR A 100 49.393 -8.762 -1.334 1.00 40.22 O ATOM 0 H TYR A 100 53.439 -9.983 -5.187 1.00 43.11 H new ATOM 0 HA TYR A 100 52.170 -12.372 -5.821 1.00 15.13 H new ATOM 0 HB2 TYR A 100 51.580 -9.617 -6.939 1.00 21.14 H new ATOM 0 HB3 TYR A 100 50.480 -10.981 -6.895 1.00 21.14 H new ATOM 0 HD1 TYR A 100 51.287 -11.870 -4.000 1.00 64.34 H new ATOM 0 HD2 TYR A 100 50.196 -8.135 -5.711 1.00 74.45 H new ATOM 0 HE1 TYR A 100 50.461 -11.122 -1.820 1.00 62.13 H new ATOM 0 HE2 TYR A 100 49.374 -7.374 -3.542 1.00 71.11 H new ATOM 0 HH TYR A 100 50.106 -8.823 -0.664 1.00 40.22 H new ATOM 1590 N THR A 101 53.617 -10.803 -8.342 1.00 71.31 N ATOM 1591 CA THR A 101 54.017 -10.953 -9.705 1.00 4.12 C ATOM 1592 C THR A 101 55.091 -12.025 -9.930 1.00 22.22 C ATOM 1593 O THR A 101 55.091 -12.676 -10.961 1.00 14.53 O ATOM 1594 CB THR A 101 54.390 -9.617 -10.352 1.00 52.21 C ATOM 1595 OG1 THR A 101 55.332 -8.910 -9.542 1.00 1.34 O ATOM 1596 CG2 THR A 101 53.148 -8.777 -10.548 1.00 55.24 C ATOM 0 H THR A 101 53.905 -9.927 -7.906 1.00 71.31 H new ATOM 0 HA THR A 101 53.131 -11.326 -10.219 1.00 4.12 H new ATOM 0 HB THR A 101 54.848 -9.817 -11.321 1.00 52.21 H new ATOM 0 HG1 THR A 101 55.345 -7.966 -9.804 1.00 1.34 H new ATOM 0 HG21 THR A 101 53.420 -7.827 -11.009 1.00 55.24 H new ATOM 0 HG22 THR A 101 52.449 -9.307 -11.195 1.00 55.24 H new ATOM 0 HG23 THR A 101 52.679 -8.590 -9.582 1.00 55.24 H new ATOM 1604 N MET A 102 55.976 -12.241 -8.964 1.00 34.35 N ATOM 1605 CA MET A 102 57.001 -13.285 -9.111 1.00 63.42 C ATOM 1606 C MET A 102 56.359 -14.671 -9.101 1.00 13.22 C ATOM 1607 O MET A 102 56.796 -15.589 -9.812 1.00 73.13 O ATOM 1608 CB MET A 102 58.116 -13.175 -8.049 1.00 43.15 C ATOM 1609 CG MET A 102 57.677 -13.404 -6.613 1.00 11.42 C ATOM 1610 SD MET A 102 59.005 -13.224 -5.398 1.00 45.04 S ATOM 1611 CE MET A 102 59.527 -11.536 -5.684 1.00 54.24 C ATOM 0 H MET A 102 56.012 -11.723 -8.086 1.00 34.35 H new ATOM 0 HA MET A 102 57.482 -13.132 -10.077 1.00 63.42 H new ATOM 0 HB2 MET A 102 58.897 -13.896 -8.291 1.00 43.15 H new ATOM 0 HB3 MET A 102 58.564 -12.184 -8.120 1.00 43.15 H new ATOM 0 HG2 MET A 102 56.880 -12.701 -6.371 1.00 11.42 H new ATOM 0 HG3 MET A 102 57.255 -14.405 -6.529 1.00 11.42 H new ATOM 0 HE1 MET A 102 59.955 -11.128 -4.769 1.00 54.24 H new ATOM 0 HE2 MET A 102 60.276 -11.516 -6.476 1.00 54.24 H new ATOM 0 HE3 MET A 102 58.668 -10.935 -5.982 1.00 54.24 H new ATOM 1621 N ILE A 103 55.293 -14.794 -8.343 1.00 3.21 N ATOM 1622 CA ILE A 103 54.552 -16.028 -8.263 1.00 52.20 C ATOM 1623 C ILE A 103 53.646 -16.133 -9.492 1.00 5.52 C ATOM 1624 O ILE A 103 53.592 -17.171 -10.156 1.00 70.30 O ATOM 1625 CB ILE A 103 53.716 -16.072 -6.958 1.00 14.12 C ATOM 1626 CG1 ILE A 103 54.658 -15.904 -5.751 1.00 12.42 C ATOM 1627 CG2 ILE A 103 52.945 -17.392 -6.860 1.00 5.55 C ATOM 1628 CD1 ILE A 103 53.958 -15.713 -4.415 1.00 2.12 C ATOM 0 H ILE A 103 54.917 -14.041 -7.766 1.00 3.21 H new ATOM 0 HA ILE A 103 55.240 -16.874 -8.244 1.00 52.20 H new ATOM 0 HB ILE A 103 52.990 -15.259 -6.965 1.00 14.12 H new ATOM 0 HG12 ILE A 103 55.301 -16.782 -5.686 1.00 12.42 H new ATOM 0 HG13 ILE A 103 55.306 -15.046 -5.931 1.00 12.42 H new ATOM 0 HG21 ILE A 103 52.364 -17.406 -5.938 1.00 5.55 H new ATOM 0 HG22 ILE A 103 52.274 -17.486 -7.714 1.00 5.55 H new ATOM 0 HG23 ILE A 103 53.648 -18.225 -6.858 1.00 5.55 H new ATOM 0 HD11 ILE A 103 54.703 -15.604 -3.626 1.00 2.12 H new ATOM 0 HD12 ILE A 103 53.337 -14.818 -4.454 1.00 2.12 H new ATOM 0 HD13 ILE A 103 53.332 -16.580 -4.205 1.00 2.12 H new ATOM 1640 N TYR A 104 52.997 -15.020 -9.822 1.00 40.11 N ATOM 1641 CA TYR A 104 52.119 -14.908 -10.980 1.00 44.15 C ATOM 1642 C TYR A 104 52.852 -15.220 -12.281 1.00 13.14 C ATOM 1643 O TYR A 104 52.287 -15.801 -13.195 1.00 40.12 O ATOM 1644 CB TYR A 104 51.448 -13.512 -11.000 1.00 10.23 C ATOM 1645 CG TYR A 104 51.417 -12.793 -12.340 1.00 54.34 C ATOM 1646 CD1 TYR A 104 52.491 -12.014 -12.729 1.00 23.41 C ATOM 1647 CD2 TYR A 104 50.329 -12.883 -13.197 1.00 54.33 C ATOM 1648 CE1 TYR A 104 52.498 -11.346 -13.920 1.00 54.14 C ATOM 1649 CE2 TYR A 104 50.324 -12.209 -14.406 1.00 5.31 C ATOM 1650 CZ TYR A 104 51.417 -11.439 -14.757 1.00 60.51 C ATOM 1651 OH TYR A 104 51.435 -10.765 -15.960 1.00 1.15 O ATOM 0 H TYR A 104 53.068 -14.157 -9.283 1.00 40.11 H new ATOM 0 HA TYR A 104 51.333 -15.658 -10.894 1.00 44.15 H new ATOM 0 HB2 TYR A 104 50.422 -13.621 -10.648 1.00 10.23 H new ATOM 0 HB3 TYR A 104 51.965 -12.875 -10.283 1.00 10.23 H new ATOM 0 HD1 TYR A 104 53.346 -11.932 -12.074 1.00 23.41 H new ATOM 0 HD2 TYR A 104 49.477 -13.485 -12.918 1.00 54.33 H new ATOM 0 HE1 TYR A 104 53.352 -10.747 -14.201 1.00 54.14 H new ATOM 0 HE2 TYR A 104 49.474 -12.284 -15.069 1.00 5.31 H new ATOM 0 HH TYR A 104 50.597 -10.931 -16.441 1.00 1.15 H new ATOM 1661 N ARG A 105 54.117 -14.858 -12.333 1.00 53.53 N ATOM 1662 CA ARG A 105 54.953 -15.069 -13.495 1.00 5.51 C ATOM 1663 C ARG A 105 55.203 -16.555 -13.716 1.00 13.24 C ATOM 1664 O ARG A 105 55.495 -16.993 -14.826 1.00 2.23 O ATOM 1665 CB ARG A 105 56.272 -14.354 -13.275 1.00 24.32 C ATOM 1666 CG ARG A 105 57.215 -14.360 -14.451 1.00 13.52 C ATOM 1667 CD ARG A 105 58.511 -13.686 -14.082 1.00 62.13 C ATOM 1668 NE ARG A 105 58.313 -12.304 -13.610 1.00 23.52 N ATOM 1669 CZ ARG A 105 59.201 -11.310 -13.756 1.00 63.44 C ATOM 1670 NH1 ARG A 105 60.313 -11.500 -14.471 1.00 4.40 N ATOM 1671 NH2 ARG A 105 58.975 -10.125 -13.194 1.00 43.11 N ATOM 0 H ARG A 105 54.599 -14.403 -11.558 1.00 53.53 H new ATOM 0 HA ARG A 105 54.451 -14.675 -14.379 1.00 5.51 H new ATOM 0 HB2 ARG A 105 56.064 -13.319 -13.003 1.00 24.32 H new ATOM 0 HB3 ARG A 105 56.776 -14.812 -12.424 1.00 24.32 H new ATOM 0 HG2 ARG A 105 57.407 -15.385 -14.767 1.00 13.52 H new ATOM 0 HG3 ARG A 105 56.757 -13.846 -15.296 1.00 13.52 H new ATOM 0 HD2 ARG A 105 59.009 -14.265 -13.304 1.00 62.13 H new ATOM 0 HD3 ARG A 105 59.173 -13.680 -14.948 1.00 62.13 H new ATOM 0 HE ARG A 105 57.435 -12.088 -13.137 1.00 23.52 H new ATOM 0 HH11 ARG A 105 60.490 -12.404 -14.909 1.00 4.40 H new ATOM 0 HH12 ARG A 105 60.986 -10.741 -14.579 1.00 4.40 H new ATOM 0 HH21 ARG A 105 58.125 -9.972 -12.651 1.00 43.11 H new ATOM 0 HH22 ARG A 105 59.652 -9.370 -13.306 1.00 43.11 H new ATOM 1685 N ASN A 106 55.063 -17.327 -12.670 1.00 14.40 N ATOM 1686 CA ASN A 106 55.330 -18.740 -12.758 1.00 75.13 C ATOM 1687 C ASN A 106 54.068 -19.583 -12.809 1.00 64.35 C ATOM 1688 O ASN A 106 54.130 -20.794 -13.012 1.00 43.10 O ATOM 1689 CB ASN A 106 56.311 -19.216 -11.676 1.00 32.11 C ATOM 1690 CG ASN A 106 57.754 -18.825 -11.991 1.00 41.53 C ATOM 1691 OD1 ASN A 106 58.455 -19.552 -12.688 1.00 63.30 O ATOM 1692 ND2 ASN A 106 58.220 -17.704 -11.476 1.00 61.11 N ATOM 0 H ASN A 106 54.767 -17.003 -11.749 1.00 14.40 H new ATOM 0 HA ASN A 106 55.825 -18.892 -13.717 1.00 75.13 H new ATOM 0 HB2 ASN A 106 56.023 -18.791 -10.715 1.00 32.11 H new ATOM 0 HB3 ASN A 106 56.243 -20.299 -11.578 1.00 32.11 H new ATOM 0 HD21 ASN A 106 59.184 -17.423 -11.654 1.00 61.11 H new ATOM 0 HD22 ASN A 106 57.616 -17.118 -10.900 1.00 61.11 H new ATOM 1699 N LEU A 107 52.934 -18.954 -12.656 1.00 34.24 N ATOM 1700 CA LEU A 107 51.670 -19.656 -12.762 1.00 22.31 C ATOM 1701 C LEU A 107 51.071 -19.387 -14.138 1.00 22.33 C ATOM 1702 O LEU A 107 51.636 -18.609 -14.925 1.00 3.21 O ATOM 1703 CB LEU A 107 50.711 -19.273 -11.602 1.00 10.31 C ATOM 1704 CG LEU A 107 50.284 -17.801 -11.491 1.00 32.14 C ATOM 1705 CD1 LEU A 107 49.143 -17.442 -12.421 1.00 53.04 C ATOM 1706 CD2 LEU A 107 49.965 -17.421 -10.067 1.00 33.10 C ATOM 0 H LEU A 107 52.853 -17.957 -12.457 1.00 34.24 H new ATOM 0 HA LEU A 107 51.834 -20.729 -12.664 1.00 22.31 H new ATOM 0 HB2 LEU A 107 49.810 -19.878 -11.697 1.00 10.31 H new ATOM 0 HB3 LEU A 107 51.188 -19.557 -10.664 1.00 10.31 H new ATOM 0 HG LEU A 107 51.144 -17.214 -11.814 1.00 32.14 H new ATOM 0 HD11 LEU A 107 48.888 -16.390 -12.295 1.00 53.04 H new ATOM 0 HD12 LEU A 107 49.445 -17.621 -13.453 1.00 53.04 H new ATOM 0 HD13 LEU A 107 48.274 -18.056 -12.185 1.00 53.04 H new ATOM 0 HD21 LEU A 107 49.667 -16.373 -10.028 1.00 33.10 H new ATOM 0 HD22 LEU A 107 49.150 -18.044 -9.698 1.00 33.10 H new ATOM 0 HD23 LEU A 107 50.847 -17.571 -9.444 1.00 33.10 H new ATOM 1718 N VAL A 108 49.978 -20.014 -14.458 1.00 63.11 N ATOM 1719 CA VAL A 108 49.380 -19.787 -15.759 1.00 1.01 C ATOM 1720 C VAL A 108 48.060 -19.015 -15.647 1.00 71.42 C ATOM 1721 O VAL A 108 47.197 -19.356 -14.828 1.00 31.43 O ATOM 1722 CB VAL A 108 49.228 -21.100 -16.591 1.00 35.03 C ATOM 1723 CG1 VAL A 108 48.346 -22.110 -15.897 1.00 45.42 C ATOM 1724 CG2 VAL A 108 48.719 -20.809 -17.993 1.00 72.10 C ATOM 0 H VAL A 108 49.484 -20.674 -13.858 1.00 63.11 H new ATOM 0 HA VAL A 108 50.075 -19.158 -16.316 1.00 1.01 H new ATOM 0 HB VAL A 108 50.222 -21.539 -16.675 1.00 35.03 H new ATOM 0 HG11 VAL A 108 48.268 -23.007 -16.511 1.00 45.42 H new ATOM 0 HG12 VAL A 108 48.779 -22.368 -14.930 1.00 45.42 H new ATOM 0 HG13 VAL A 108 47.353 -21.685 -15.748 1.00 45.42 H new ATOM 0 HG21 VAL A 108 48.624 -21.743 -18.547 1.00 72.10 H new ATOM 0 HG22 VAL A 108 47.746 -20.322 -17.933 1.00 72.10 H new ATOM 0 HG23 VAL A 108 49.422 -20.153 -18.506 1.00 72.10 H new ATOM 1734 N VAL A 109 47.950 -17.954 -16.413 1.00 53.02 N ATOM 1735 CA VAL A 109 46.751 -17.134 -16.502 1.00 54.14 C ATOM 1736 C VAL A 109 46.542 -16.675 -17.933 1.00 41.24 C ATOM 1737 O VAL A 109 47.169 -15.680 -18.358 1.00 0.00 O ATOM 1738 CB VAL A 109 46.738 -15.910 -15.533 1.00 42.33 C ATOM 1739 CG1 VAL A 109 46.220 -16.310 -14.158 1.00 54.03 C ATOM 1740 CG2 VAL A 109 48.128 -15.343 -15.403 1.00 33.31 C ATOM 1741 OXT VAL A 109 45.789 -17.330 -18.672 1.00 0.00 O ATOM 0 H VAL A 109 48.709 -17.624 -17.009 1.00 53.02 H new ATOM 0 HA VAL A 109 45.926 -17.771 -16.184 1.00 54.14 H new ATOM 0 HB VAL A 109 46.072 -15.154 -15.949 1.00 42.33 H new ATOM 0 HG11 VAL A 109 46.221 -15.440 -13.502 1.00 54.03 H new ATOM 0 HG12 VAL A 109 45.204 -16.695 -14.250 1.00 54.03 H new ATOM 0 HG13 VAL A 109 46.864 -17.082 -13.737 1.00 54.03 H new ATOM 0 HG21 VAL A 109 48.111 -14.489 -14.725 1.00 33.31 H new ATOM 0 HG22 VAL A 109 48.797 -16.107 -15.007 1.00 33.31 H new ATOM 0 HG23 VAL A 109 48.483 -15.022 -16.382 1.00 33.31 H new TER 1751 VAL A 109 ATOM 1752 N ASP B 301 59.883 -1.489 11.453 1.00 70.03 N ATOM 1753 CA ASP B 301 60.767 -2.045 10.418 1.00 40.31 C ATOM 1754 C ASP B 301 62.148 -2.380 11.008 1.00 43.41 C ATOM 1755 O ASP B 301 63.089 -2.749 10.306 1.00 3.22 O ATOM 1756 CB ASP B 301 60.865 -1.062 9.228 1.00 55.03 C ATOM 1757 CG ASP B 301 61.659 -1.594 8.055 1.00 52.13 C ATOM 1758 OD1 ASP B 301 61.243 -2.602 7.446 1.00 11.23 O ATOM 1759 OD2 ASP B 301 62.692 -0.997 7.694 1.00 23.31 O ATOM 0 HA ASP B 301 60.345 -2.978 10.045 1.00 40.31 H new ATOM 0 HB2 ASP B 301 59.859 -0.815 8.890 1.00 55.03 H new ATOM 0 HB3 ASP B 301 61.322 -0.135 9.573 1.00 55.03 H new ATOM 1766 N GLY B 302 62.250 -2.310 12.310 1.00 32.14 N ATOM 1767 CA GLY B 302 63.487 -2.612 12.964 1.00 10.15 C ATOM 1768 C GLY B 302 63.280 -3.708 13.953 1.00 44.11 C ATOM 1769 O GLY B 302 62.872 -3.453 15.089 1.00 74.13 O ATOM 0 H GLY B 302 61.488 -2.046 12.935 1.00 32.14 H new ATOM 0 HA2 GLY B 302 64.235 -2.909 12.229 1.00 10.15 H new ATOM 0 HA3 GLY B 302 63.870 -1.724 13.466 1.00 10.15 H new ATOM 1773 N GLY B 303 63.536 -4.913 13.542 1.00 50.33 N ATOM 1774 CA GLY B 303 63.263 -6.041 14.386 1.00 63.40 C ATOM 1775 C GLY B 303 62.012 -6.739 13.923 1.00 53.01 C ATOM 1776 O GLY B 303 61.190 -7.188 14.721 1.00 2.33 O ATOM 0 H GLY B 303 63.932 -5.142 12.631 1.00 50.33 H new ATOM 0 HA2 GLY B 303 64.105 -6.733 14.365 1.00 63.40 H new ATOM 0 HA3 GLY B 303 63.145 -5.713 15.419 1.00 63.40 H new ATOM 1780 N THR B 304 61.843 -6.776 12.638 1.00 72.21 N ATOM 1781 CA THR B 304 60.741 -7.431 12.018 1.00 53.02 C ATOM 1782 C THR B 304 61.238 -8.703 11.353 1.00 61.42 C ATOM 1783 O THR B 304 61.925 -8.648 10.322 1.00 41.25 O ATOM 1784 CB THR B 304 60.084 -6.495 10.987 1.00 73.35 C ATOM 1785 OG1 THR B 304 61.105 -5.887 10.174 1.00 53.13 O ATOM 1786 CG2 THR B 304 59.289 -5.411 11.682 1.00 11.42 C ATOM 0 H THR B 304 62.486 -6.339 11.977 1.00 72.21 H new ATOM 0 HA THR B 304 59.991 -7.687 12.766 1.00 53.02 H new ATOM 0 HB THR B 304 59.409 -7.082 10.363 1.00 73.35 H new ATOM 0 HG1 THR B 304 61.764 -6.565 9.915 1.00 53.13 H new ATOM 0 HG21 THR B 304 58.833 -4.760 10.937 1.00 11.42 H new ATOM 0 HG22 THR B 304 58.509 -5.866 12.292 1.00 11.42 H new ATOM 0 HG23 THR B 304 59.952 -4.825 12.318 1.00 11.42 H new ATOM 1794 N THR B 305 60.965 -9.828 11.976 1.00 33.52 N ATOM 1795 CA THR B 305 61.422 -11.091 11.470 1.00 3.31 C ATOM 1796 C THR B 305 60.767 -11.443 10.135 1.00 54.44 C ATOM 1797 O THR B 305 59.556 -11.171 9.913 1.00 34.54 O ATOM 1798 CB THR B 305 61.233 -12.248 12.500 1.00 43.20 C ATOM 1799 OG1 THR B 305 61.694 -13.491 11.946 1.00 13.01 O ATOM 1800 CG2 THR B 305 59.778 -12.394 12.906 1.00 31.13 C ATOM 0 H THR B 305 60.425 -9.887 12.839 1.00 33.52 H new ATOM 0 HA THR B 305 62.492 -10.978 11.299 1.00 3.31 H new ATOM 0 HB THR B 305 61.820 -11.998 13.384 1.00 43.20 H new ATOM 0 HG1 THR B 305 61.571 -14.208 12.603 1.00 13.01 H new ATOM 0 HG21 THR B 305 59.681 -13.208 13.624 1.00 31.13 H new ATOM 0 HG22 THR B 305 59.432 -11.466 13.361 1.00 31.13 H new ATOM 0 HG23 THR B 305 59.175 -12.613 12.025 1.00 31.13 H new ATOM 1808 N PHE B 306 61.580 -12.027 9.243 1.00 23.43 N ATOM 1809 CA PHE B 306 61.147 -12.522 7.941 1.00 31.21 C ATOM 1810 C PHE B 306 59.915 -13.413 8.084 1.00 61.12 C ATOM 1811 O PHE B 306 58.970 -13.306 7.302 1.00 3.43 O ATOM 1812 CB PHE B 306 62.299 -13.302 7.270 1.00 53.41 C ATOM 1813 CG PHE B 306 61.960 -13.935 5.949 1.00 65.10 C ATOM 1814 CD1 PHE B 306 61.903 -13.176 4.793 1.00 73.14 C ATOM 1815 CD2 PHE B 306 61.708 -15.294 5.865 1.00 42.23 C ATOM 1816 CE1 PHE B 306 61.600 -13.759 3.580 1.00 14.34 C ATOM 1817 CE2 PHE B 306 61.405 -15.883 4.659 1.00 4.02 C ATOM 1818 CZ PHE B 306 61.349 -15.117 3.512 1.00 41.22 C ATOM 0 H PHE B 306 62.575 -12.168 9.416 1.00 23.43 H new ATOM 0 HA PHE B 306 60.879 -11.671 7.314 1.00 31.21 H new ATOM 0 HB2 PHE B 306 63.139 -12.623 7.124 1.00 53.41 H new ATOM 0 HB3 PHE B 306 62.634 -14.082 7.953 1.00 53.41 H new ATOM 0 HD1 PHE B 306 62.098 -12.115 4.841 1.00 73.14 H new ATOM 0 HD2 PHE B 306 61.750 -15.900 6.758 1.00 42.23 H new ATOM 0 HE1 PHE B 306 61.559 -13.156 2.685 1.00 14.34 H new ATOM 0 HE2 PHE B 306 61.211 -16.944 4.610 1.00 4.02 H new ATOM 0 HZ PHE B 306 61.110 -15.577 2.565 1.00 41.22 H new ATOM 1828 N GLU B 307 59.909 -14.217 9.144 1.00 22.24 N ATOM 1829 CA GLU B 307 58.850 -15.173 9.424 1.00 73.43 C ATOM 1830 C GLU B 307 57.487 -14.461 9.556 1.00 33.30 C ATOM 1831 O GLU B 307 56.449 -14.996 9.178 1.00 31.35 O ATOM 1832 CB GLU B 307 59.182 -15.917 10.724 1.00 34.14 C ATOM 1833 CG GLU B 307 58.273 -17.094 11.026 1.00 23.45 C ATOM 1834 CD GLU B 307 58.568 -17.731 12.359 1.00 64.23 C ATOM 1835 OE1 GLU B 307 59.518 -18.544 12.466 1.00 13.13 O ATOM 1836 OE2 GLU B 307 57.833 -17.461 13.330 1.00 53.15 O ATOM 0 H GLU B 307 60.653 -14.220 9.842 1.00 22.24 H new ATOM 0 HA GLU B 307 58.781 -15.881 8.598 1.00 73.43 H new ATOM 0 HB2 GLU B 307 60.211 -16.273 10.671 1.00 34.14 H new ATOM 0 HB3 GLU B 307 59.131 -15.212 11.554 1.00 34.14 H new ATOM 0 HG2 GLU B 307 57.236 -16.760 11.010 1.00 23.45 H new ATOM 0 HG3 GLU B 307 58.380 -17.841 10.240 1.00 23.45 H new ATOM 1843 N HIS B 308 57.512 -13.235 10.041 1.00 4.31 N ATOM 1844 CA HIS B 308 56.289 -12.495 10.266 1.00 63.23 C ATOM 1845 C HIS B 308 55.949 -11.678 9.044 1.00 43.42 C ATOM 1846 O HIS B 308 54.863 -11.799 8.496 1.00 4.03 O ATOM 1847 CB HIS B 308 56.442 -11.549 11.462 1.00 63.24 C ATOM 1848 CG HIS B 308 55.152 -10.897 11.934 1.00 24.31 C ATOM 1849 ND1 HIS B 308 54.479 -11.294 13.067 1.00 22.21 N ATOM 1850 CD2 HIS B 308 54.441 -9.853 11.431 1.00 2.42 C ATOM 1851 CE1 HIS B 308 53.418 -10.539 13.245 1.00 61.43 C ATOM 1852 NE2 HIS B 308 53.368 -9.649 12.263 1.00 65.13 N ATOM 0 H HIS B 308 58.365 -12.732 10.286 1.00 4.31 H new ATOM 0 HA HIS B 308 55.493 -13.211 10.471 1.00 63.23 H new ATOM 0 HB2 HIS B 308 56.876 -12.105 12.293 1.00 63.24 H new ATOM 0 HB3 HIS B 308 57.152 -10.765 11.198 1.00 63.24 H new ATOM 0 HD2 HIS B 308 54.677 -9.288 10.541 1.00 2.42 H new ATOM 0 HE1 HIS B 308 52.708 -10.628 14.054 1.00 61.43 H new ATOM 0 HE2 HIS B 308 52.652 -8.932 12.145 1.00 65.13 H new ATOM 1860 N LEU B 309 56.897 -10.866 8.609 1.00 64.14 N ATOM 1861 CA LEU B 309 56.657 -9.896 7.548 1.00 52.01 C ATOM 1862 C LEU B 309 56.289 -10.513 6.191 1.00 42.30 C ATOM 1863 O LEU B 309 55.503 -9.933 5.431 1.00 13.44 O ATOM 1864 CB LEU B 309 57.785 -8.829 7.472 1.00 30.00 C ATOM 1865 CG LEU B 309 59.259 -9.294 7.350 1.00 51.22 C ATOM 1866 CD1 LEU B 309 59.523 -10.016 6.059 1.00 10.42 C ATOM 1867 CD2 LEU B 309 60.198 -8.112 7.482 1.00 12.40 C ATOM 0 H LEU B 309 57.849 -10.858 8.976 1.00 64.14 H new ATOM 0 HA LEU B 309 55.749 -9.364 7.834 1.00 52.01 H new ATOM 0 HB2 LEU B 309 57.572 -8.187 6.618 1.00 30.00 H new ATOM 0 HB3 LEU B 309 57.710 -8.208 8.365 1.00 30.00 H new ATOM 0 HG LEU B 309 59.441 -9.997 8.163 1.00 51.22 H new ATOM 0 HD11 LEU B 309 60.569 -10.322 6.020 1.00 10.42 H new ATOM 0 HD12 LEU B 309 58.885 -10.897 5.998 1.00 10.42 H new ATOM 0 HD13 LEU B 309 59.308 -9.353 5.221 1.00 10.42 H new ATOM 0 HD21 LEU B 309 61.229 -8.455 7.394 1.00 12.40 H new ATOM 0 HD22 LEU B 309 59.987 -7.390 6.693 1.00 12.40 H new ATOM 0 HD23 LEU B 309 60.054 -7.640 8.454 1.00 12.40 H new ATOM 1879 N TRP B 310 56.800 -11.695 5.925 1.00 43.14 N ATOM 1880 CA TRP B 310 56.522 -12.392 4.685 1.00 14.01 C ATOM 1881 C TRP B 310 55.121 -12.965 4.749 1.00 31.23 C ATOM 1882 O TRP B 310 54.339 -12.841 3.816 1.00 14.12 O ATOM 1883 CB TRP B 310 57.586 -13.484 4.458 1.00 43.11 C ATOM 1884 CG TRP B 310 57.326 -14.401 3.304 1.00 74.31 C ATOM 1885 CD1 TRP B 310 56.825 -15.653 3.373 1.00 32.35 C ATOM 1886 CD2 TRP B 310 57.552 -14.142 1.920 1.00 15.41 C ATOM 1887 NE1 TRP B 310 56.729 -16.191 2.118 1.00 45.03 N ATOM 1888 CE2 TRP B 310 57.158 -15.290 1.214 1.00 2.52 C ATOM 1889 CE3 TRP B 310 58.039 -13.064 1.213 1.00 3.22 C ATOM 1890 CZ2 TRP B 310 57.236 -15.385 -0.162 1.00 23.13 C ATOM 1891 CZ3 TRP B 310 58.119 -13.157 -0.152 1.00 70.43 C ATOM 1892 CH2 TRP B 310 57.718 -14.309 -0.830 1.00 52.42 C ATOM 0 H TRP B 310 57.419 -12.200 6.559 1.00 43.14 H new ATOM 0 HA TRP B 310 56.570 -11.708 3.838 1.00 14.01 H new ATOM 0 HB2 TRP B 310 58.552 -13.001 4.307 1.00 43.11 H new ATOM 0 HB3 TRP B 310 57.668 -14.083 5.365 1.00 43.11 H new ATOM 0 HD1 TRP B 310 56.541 -16.157 4.285 1.00 32.35 H new ATOM 0 HE1 TRP B 310 56.386 -17.127 1.902 1.00 45.03 H new ATOM 0 HE3 TRP B 310 58.351 -12.165 1.724 1.00 3.22 H new ATOM 0 HZ2 TRP B 310 56.926 -16.279 -0.683 1.00 23.13 H new ATOM 0 HZ3 TRP B 310 58.501 -12.319 -0.716 1.00 70.43 H new ATOM 0 HH2 TRP B 310 57.793 -14.344 -1.907 1.00 52.42 H new ATOM 1903 N SER B 311 54.779 -13.489 5.901 1.00 14.42 N ATOM 1904 CA SER B 311 53.472 -14.069 6.133 1.00 14.14 C ATOM 1905 C SER B 311 52.395 -12.964 6.267 1.00 41.41 C ATOM 1906 O SER B 311 51.212 -13.246 6.428 1.00 31.14 O ATOM 1907 CB SER B 311 53.519 -14.911 7.413 1.00 42.43 C ATOM 1908 OG SER B 311 54.611 -15.829 7.377 1.00 14.24 O ATOM 0 H SER B 311 55.400 -13.527 6.709 1.00 14.42 H new ATOM 0 HA SER B 311 53.207 -14.699 5.284 1.00 14.14 H new ATOM 0 HB2 SER B 311 53.616 -14.257 8.280 1.00 42.43 H new ATOM 0 HB3 SER B 311 52.583 -15.457 7.529 1.00 42.43 H new ATOM 0 HG SER B 311 55.322 -15.515 7.974 1.00 14.24 H new ATOM 1914 N SER B 312 52.818 -11.712 6.198 1.00 1.11 N ATOM 1915 CA SER B 312 51.924 -10.598 6.376 1.00 11.44 C ATOM 1916 C SER B 312 51.786 -9.760 5.104 1.00 60.40 C ATOM 1917 O SER B 312 51.179 -8.696 5.128 1.00 41.34 O ATOM 1918 CB SER B 312 52.432 -9.735 7.525 1.00 21.31 C ATOM 1919 OG SER B 312 52.553 -10.506 8.707 1.00 22.34 O ATOM 0 H SER B 312 53.787 -11.449 6.018 1.00 1.11 H new ATOM 0 HA SER B 312 50.933 -10.988 6.607 1.00 11.44 H new ATOM 0 HB2 SER B 312 53.399 -9.304 7.264 1.00 21.31 H new ATOM 0 HB3 SER B 312 51.747 -8.904 7.694 1.00 21.31 H new ATOM 0 HG SER B 312 53.242 -11.191 8.581 1.00 22.34 H new ATOM 1925 N LEU B 313 52.301 -10.240 3.983 1.00 4.23 N ATOM 1926 CA LEU B 313 52.226 -9.441 2.765 1.00 14.51 C ATOM 1927 C LEU B 313 51.026 -9.848 1.910 1.00 52.23 C ATOM 1928 O LEU B 313 50.817 -9.339 0.807 1.00 52.02 O ATOM 1929 CB LEU B 313 53.577 -9.452 2.004 1.00 61.41 C ATOM 1930 CG LEU B 313 54.119 -10.785 1.468 1.00 1.40 C ATOM 1931 CD1 LEU B 313 53.392 -11.253 0.209 1.00 73.31 C ATOM 1932 CD2 LEU B 313 55.600 -10.653 1.218 1.00 23.23 C ATOM 0 H LEU B 313 52.760 -11.146 3.888 1.00 4.23 H new ATOM 0 HA LEU B 313 52.052 -8.400 3.038 1.00 14.51 H new ATOM 0 HB2 LEU B 313 53.484 -8.771 1.158 1.00 61.41 H new ATOM 0 HB3 LEU B 313 54.332 -9.033 2.669 1.00 61.41 H new ATOM 0 HG LEU B 313 53.938 -11.550 2.223 1.00 1.40 H new ATOM 0 HD11 LEU B 313 53.816 -12.200 -0.126 1.00 73.31 H new ATOM 0 HD12 LEU B 313 52.333 -11.388 0.429 1.00 73.31 H new ATOM 0 HD13 LEU B 313 53.507 -10.506 -0.576 1.00 73.31 H new ATOM 0 HD21 LEU B 313 55.990 -11.597 0.837 1.00 23.23 H new ATOM 0 HD22 LEU B 313 55.777 -9.865 0.485 1.00 23.23 H new ATOM 0 HD23 LEU B 313 56.105 -10.401 2.150 1.00 23.23 H new ATOM 1944 N GLU B 314 50.241 -10.744 2.465 1.00 50.02 N ATOM 1945 CA GLU B 314 49.035 -11.277 1.851 1.00 22.11 C ATOM 1946 C GLU B 314 47.920 -10.222 1.849 1.00 24.03 C ATOM 1947 O GLU B 314 47.996 -9.228 2.585 1.00 52.11 O ATOM 1948 CB GLU B 314 48.577 -12.492 2.663 1.00 41.12 C ATOM 1949 CG GLU B 314 48.335 -12.164 4.119 1.00 31.33 C ATOM 1950 CD GLU B 314 47.927 -13.350 4.939 1.00 73.45 C ATOM 1951 OE1 GLU B 314 48.109 -14.483 4.509 1.00 13.23 O ATOM 1952 OE2 GLU B 314 47.379 -13.166 6.045 1.00 40.53 O ATOM 0 H GLU B 314 50.427 -11.138 3.387 1.00 50.02 H new ATOM 0 HA GLU B 314 49.248 -11.559 0.820 1.00 22.11 H new ATOM 0 HB2 GLU B 314 47.661 -12.890 2.227 1.00 41.12 H new ATOM 0 HB3 GLU B 314 49.331 -13.276 2.592 1.00 41.12 H new ATOM 0 HG2 GLU B 314 49.243 -11.735 4.542 1.00 31.33 H new ATOM 0 HG3 GLU B 314 47.560 -11.401 4.187 1.00 31.33 H new ATOM 1959 N PRO B 315 46.887 -10.401 1.023 1.00 10.45 N ATOM 1960 CA PRO B 315 45.751 -9.507 1.018 1.00 54.32 C ATOM 1961 C PRO B 315 44.839 -9.761 2.215 1.00 3.22 C ATOM 1962 O PRO B 315 44.528 -8.839 2.986 1.00 2.51 O ATOM 1963 CB PRO B 315 45.028 -9.815 -0.301 1.00 25.23 C ATOM 1964 CG PRO B 315 45.530 -11.149 -0.762 1.00 44.42 C ATOM 1965 CD PRO B 315 46.776 -11.473 0.014 1.00 62.12 C ATOM 0 HA PRO B 315 46.051 -8.462 1.094 1.00 54.32 H new ATOM 0 HB2 PRO B 315 43.948 -9.837 -0.155 1.00 25.23 H new ATOM 0 HB3 PRO B 315 45.234 -9.045 -1.045 1.00 25.23 H new ATOM 0 HG2 PRO B 315 44.772 -11.916 -0.603 1.00 44.42 H new ATOM 0 HG3 PRO B 315 45.742 -11.127 -1.831 1.00 44.42 H new ATOM 0 HD2 PRO B 315 46.704 -12.453 0.486 1.00 62.12 H new ATOM 0 HD3 PRO B 315 47.651 -11.496 -0.636 1.00 62.12 H new ATOM 1973 N ASP B 316 44.458 -11.004 2.381 1.00 41.21 N ATOM 1974 CA ASP B 316 43.552 -11.444 3.410 1.00 41.22 C ATOM 1975 C ASP B 316 43.549 -12.952 3.395 1.00 10.30 C ATOM 1976 O ASP B 316 43.067 -13.530 2.399 1.00 0.00 O ATOM 1977 CB ASP B 316 42.141 -10.889 3.149 1.00 11.05 C ATOM 1978 CG ASP B 316 41.080 -11.394 4.120 1.00 61.13 C ATOM 1979 OD1 ASP B 316 41.018 -10.903 5.269 1.00 52.21 O ATOM 1980 OD2 ASP B 316 40.259 -12.266 3.741 1.00 1.52 O ATOM 1981 OXT ASP B 316 44.066 -13.576 4.352 1.00 0.00 O ATOM 0 H ASP B 316 44.783 -11.763 1.781 1.00 41.21 H new ATOM 0 HA ASP B 316 43.869 -11.079 4.387 1.00 41.22 H new ATOM 0 HB2 ASP B 316 42.176 -9.801 3.201 1.00 11.05 H new ATOM 0 HB3 ASP B 316 41.842 -11.151 2.134 1.00 11.05 H new TER 1986 ASP B 316