USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1329 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 41 LYS NZ :NH3+ -106:sc= 0.633 (180deg=-1.93) USER MOD Set 1.2: A 163 SER OG : rot 129:sc= 1.5 USER MOD Single : A 3 TYR OH : rot -31:sc= 0.0901 USER MOD Single : A 4 HIS :FLIP no HD1:sc= -1.73 F(o=-3.4!,f=-1.7) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -4.63 K(o=-4.6,f=-11!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN :FLIP amide:sc= -9.28! C(o=-12!,f=-9.3!) USER MOD Single : A 22 TYR OH : rot 165:sc= -0.276 USER MOD Single : A 23 HIS :FLIP no HD1:sc= -0.863 F(o=-2.2!,f=-0.86) USER MOD Single : A 25 LYS NZ :NH3+ -179:sc= 0.184! (180deg=0.14!) USER MOD Single : A 31 LYS NZ :NH3+ -104:sc= 0.971 (180deg=-2.61!) USER MOD Single : A 32 TYR OH : rot 180:sc= -0.578 USER MOD Single : A 34 SER OG : rot 142:sc= -1.78! USER MOD Single : A 36 ASN : amide:sc= -0.343 K(o=-0.34,f=-3.3!) USER MOD Single : A 38 LYS NZ :NH3+ 160:sc= 1.17 (180deg=1.07) USER MOD Single : A 39 TYR OH : rot -146:sc= -1.18! USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= 0.0429 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 39:sc= 0.0829 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.21) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl -124:sc= -1.93! (180deg=-3.7) USER MOD Single : A 72 THR OG1 : rot 170:sc= -0.0982 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= -0.0313 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 HIS :FLIP no HE2:sc= -4.66! C(o=-5.2!,f=-4.7!) USER MOD Single : A 87 SER OG : rot 180:sc= -0.152 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.123 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= -5.5! USER MOD Single : A 95 LYS NZ :NH3+ -116:sc= 0 (180deg=-0.998) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.201 K(o=-0.2,f=-4.7!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 44:sc= -2.65! USER MOD Single : A 106 ASN :FLIP amide:sc= -2.71! C(o=-3.4!,f=-2.7!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN : amide:sc= -2.01 K(o=-2,f=-4.1!) USER MOD Single : A 109 TYR OH : rot 62:sc= 0.0548 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 170:sc= -0.0765 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0843) USER MOD Single : A 124 HIS : no HD1:sc= -10! C(o=-10!,f=-10!) USER MOD Single : A 127 HIS : no HD1:sc= -3.46! C(o=-3.5!,f=-3.7!) USER MOD Single : A 132 SER OG : rot -150:sc= -0.0671 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.0848 X(o=-0.085,f=-0.56) USER MOD Single : A 148 TYR OH : rot 130:sc= -3.6! USER MOD Single : A 152 SER OG : rot -96:sc= 0.963 USER MOD Single : A 157 SER OG : rot 180:sc= -0.22 USER MOD Single : A 158 GLN : amide:sc= -0.126 K(o=-0.13,f=-2.1!) USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 166 SER OG : rot 180:sc= 0 USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 2 -10.918 11.812 1.192 1.00 0.00 N ATOM 15 CA VAL A 2 -12.021 11.332 2.007 1.00 0.00 C ATOM 16 C VAL A 2 -11.824 11.799 3.450 1.00 0.00 C ATOM 17 O VAL A 2 -10.816 11.477 4.078 1.00 0.00 O ATOM 18 CB VAL A 2 -12.142 9.812 1.881 1.00 0.00 C ATOM 19 CG1 VAL A 2 -12.788 9.422 0.550 1.00 0.00 C ATOM 20 CG2 VAL A 2 -10.779 9.138 2.048 1.00 0.00 C ATOM 0 HA VAL A 2 -12.965 11.750 1.657 1.00 0.00 H new ATOM 0 HB VAL A 2 -12.790 9.460 2.683 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -12.862 8.336 0.486 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -13.785 9.858 0.488 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -12.178 9.793 -0.273 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -10.893 8.058 1.954 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -10.098 9.499 1.278 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -10.374 9.376 3.031 1.00 0.00 H new ATOM 30 N TYR A 3 -12.802 12.550 3.935 1.00 0.00 N ATOM 31 CA TYR A 3 -12.748 13.064 5.293 1.00 0.00 C ATOM 32 C TYR A 3 -13.801 12.391 6.176 1.00 0.00 C ATOM 33 O TYR A 3 -14.786 11.853 5.673 1.00 0.00 O ATOM 34 CB TYR A 3 -13.065 14.558 5.191 1.00 0.00 C ATOM 35 CG TYR A 3 -13.632 15.163 6.477 1.00 0.00 C ATOM 36 CD1 TYR A 3 -12.785 15.504 7.511 1.00 0.00 C ATOM 37 CD2 TYR A 3 -14.992 15.367 6.602 1.00 0.00 C ATOM 38 CE1 TYR A 3 -13.319 16.074 8.721 1.00 0.00 C ATOM 39 CE2 TYR A 3 -15.526 15.936 7.812 1.00 0.00 C ATOM 40 CZ TYR A 3 -14.663 16.261 8.812 1.00 0.00 C ATOM 41 OH TYR A 3 -15.167 16.799 9.955 1.00 0.00 O ATOM 0 H TYR A 3 -13.636 12.815 3.412 1.00 0.00 H new ATOM 0 HA TYR A 3 -11.771 12.873 5.737 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -12.156 15.094 4.920 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -13.780 14.713 4.383 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -11.721 15.344 7.413 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -15.655 15.100 5.792 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -12.667 16.347 9.538 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -16.588 16.101 7.923 1.00 0.00 H new ATOM 0 HH TYR A 3 -14.602 16.543 10.714 1.00 0.00 H new ATOM 51 N HIS A 4 -13.556 12.443 7.477 1.00 0.00 N ATOM 52 CA HIS A 4 -14.471 11.845 8.435 1.00 0.00 C ATOM 53 C HIS A 4 -14.448 12.649 9.736 1.00 0.00 C ATOM 54 O HIS A 4 -13.749 13.656 9.837 1.00 0.00 O ATOM 55 CB HIS A 4 -14.145 10.365 8.646 1.00 0.00 C ATOM 56 CG HIS A 4 -14.256 9.527 7.395 1.00 0.00 C ATOM 57 ND1 HIS A 4 -13.471 9.481 6.280 1.00 0.00 N flip ATOM 58 CD2 HIS A 4 -15.271 8.607 7.197 1.00 0.00 C flip ATOM 59 CE1 HIS A 4 -13.978 8.580 5.448 1.00 0.00 C flip ATOM 60 NE2 HIS A 4 -15.094 8.038 6.014 1.00 0.00 N flip ATOM 0 H HIS A 4 -12.737 12.890 7.890 1.00 0.00 H new ATOM 0 HA HIS A 4 -15.488 11.881 8.044 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -13.132 10.279 9.040 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -14.817 9.960 9.403 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -16.071 8.390 7.889 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -13.573 8.319 4.481 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -15.688 7.320 5.599 1.00 0.00 H new ATOM 68 N ASP A 5 -15.223 12.174 10.701 1.00 0.00 N ATOM 69 CA ASP A 5 -15.301 12.836 11.992 1.00 0.00 C ATOM 70 C ASP A 5 -15.007 11.821 13.099 1.00 0.00 C ATOM 71 O ASP A 5 -15.316 12.062 14.265 1.00 0.00 O ATOM 72 CB ASP A 5 -16.699 13.408 12.234 1.00 0.00 C ATOM 73 CG ASP A 5 -16.749 14.622 13.165 1.00 0.00 C ATOM 74 OD1 ASP A 5 -16.664 15.749 12.632 1.00 0.00 O ATOM 75 OD2 ASP A 5 -16.871 14.394 14.388 1.00 0.00 O ATOM 0 H ASP A 5 -15.802 11.339 10.614 1.00 0.00 H new ATOM 0 HA ASP A 5 -14.573 13.647 12.000 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -17.132 13.688 11.274 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -17.329 12.623 12.651 1.00 0.00 H new ATOM 81 N GLY A 6 -14.413 10.708 12.695 1.00 0.00 N ATOM 82 CA GLY A 6 -14.074 9.656 13.638 1.00 0.00 C ATOM 83 C GLY A 6 -12.705 9.054 13.318 1.00 0.00 C ATOM 84 O GLY A 6 -11.758 9.780 13.019 1.00 0.00 O ATOM 0 H GLY A 6 -14.158 10.512 11.727 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -14.071 10.058 14.651 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -14.835 8.876 13.607 1.00 0.00 H new ATOM 88 N ALA A 7 -12.643 7.732 13.393 1.00 0.00 N ATOM 89 CA ALA A 7 -11.404 7.024 13.116 1.00 0.00 C ATOM 90 C ALA A 7 -11.673 5.915 12.097 1.00 0.00 C ATOM 91 O ALA A 7 -12.764 5.835 11.535 1.00 0.00 O ATOM 92 CB ALA A 7 -10.820 6.486 14.424 1.00 0.00 C ATOM 0 H ALA A 7 -13.430 7.133 13.641 1.00 0.00 H new ATOM 0 HA ALA A 7 -10.665 7.698 12.682 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.891 5.955 14.216 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -10.620 7.316 15.102 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -11.532 5.803 14.887 1.00 0.00 H new ATOM 98 N CYS A 8 -10.660 5.086 11.891 1.00 0.00 N ATOM 99 CA CYS A 8 -10.774 3.985 10.950 1.00 0.00 C ATOM 100 C CYS A 8 -12.034 3.188 11.293 1.00 0.00 C ATOM 101 O CYS A 8 -12.267 2.859 12.454 1.00 0.00 O ATOM 102 CB CYS A 8 -9.522 3.105 10.955 1.00 0.00 C ATOM 103 SG CYS A 8 -8.340 3.444 9.600 1.00 0.00 S ATOM 0 H CYS A 8 -9.757 5.155 12.360 1.00 0.00 H new ATOM 0 HA CYS A 8 -10.859 4.377 9.936 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -9.008 3.234 11.907 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -9.829 2.061 10.898 1.00 0.00 H new ATOM 109 N PRO A 9 -12.834 2.893 10.233 1.00 0.00 N ATOM 110 CA PRO A 9 -14.064 2.141 10.410 1.00 0.00 C ATOM 111 C PRO A 9 -13.771 0.658 10.646 1.00 0.00 C ATOM 112 O PRO A 9 -12.618 0.271 10.829 1.00 0.00 O ATOM 113 CB PRO A 9 -14.866 2.394 9.145 1.00 0.00 C ATOM 114 CG PRO A 9 -13.869 2.895 8.112 1.00 0.00 C ATOM 115 CD PRO A 9 -12.589 3.267 8.843 1.00 0.00 C ATOM 0 HA PRO A 9 -14.625 2.454 11.290 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -15.356 1.482 8.804 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -15.650 3.131 9.320 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -13.673 2.125 7.366 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -14.270 3.758 7.581 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -11.731 2.734 8.435 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -12.376 4.332 8.751 1.00 0.00 H new ATOM 123 N GLU A 10 -14.834 -0.132 10.632 1.00 0.00 N ATOM 124 CA GLU A 10 -14.705 -1.564 10.842 1.00 0.00 C ATOM 125 C GLU A 10 -14.306 -2.258 9.538 1.00 0.00 C ATOM 126 O GLU A 10 -15.040 -2.204 8.552 1.00 0.00 O ATOM 127 CB GLU A 10 -16.000 -2.155 11.403 1.00 0.00 C ATOM 128 CG GLU A 10 -16.002 -2.118 12.932 1.00 0.00 C ATOM 129 CD GLU A 10 -17.423 -2.261 13.482 1.00 0.00 C ATOM 130 OE1 GLU A 10 -17.568 -2.967 14.503 1.00 0.00 O ATOM 131 OE2 GLU A 10 -18.332 -1.660 12.869 1.00 0.00 O ATOM 0 H GLU A 10 -15.789 0.192 10.478 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.918 -1.734 11.577 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -16.854 -1.596 11.021 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -16.113 -3.184 11.060 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -15.376 -2.921 13.320 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -15.567 -1.180 13.277 1.00 0.00 H new ATOM 139 N VAL A 11 -13.144 -2.893 9.575 1.00 0.00 N ATOM 140 CA VAL A 11 -12.638 -3.596 8.408 1.00 0.00 C ATOM 141 C VAL A 11 -11.843 -4.822 8.862 1.00 0.00 C ATOM 142 O VAL A 11 -10.794 -4.689 9.490 1.00 0.00 O ATOM 143 CB VAL A 11 -11.819 -2.642 7.536 1.00 0.00 C ATOM 144 CG1 VAL A 11 -12.732 -1.751 6.692 1.00 0.00 C ATOM 145 CG2 VAL A 11 -10.867 -1.800 8.389 1.00 0.00 C ATOM 0 H VAL A 11 -12.538 -2.936 10.395 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.462 -3.953 7.790 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.216 -3.244 6.856 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.125 -1.082 6.082 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.350 -2.373 6.044 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.373 -1.162 7.348 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.297 -1.131 7.745 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.443 -1.212 9.104 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.183 -2.457 8.926 1.00 0.00 H new ATOM 155 N LYS A 12 -12.374 -5.989 8.526 1.00 0.00 N ATOM 156 CA LYS A 12 -11.727 -7.238 8.891 1.00 0.00 C ATOM 157 C LYS A 12 -10.526 -7.472 7.974 1.00 0.00 C ATOM 158 O LYS A 12 -10.689 -7.690 6.774 1.00 0.00 O ATOM 159 CB LYS A 12 -12.739 -8.386 8.886 1.00 0.00 C ATOM 160 CG LYS A 12 -12.227 -9.571 9.708 1.00 0.00 C ATOM 161 CD LYS A 12 -13.363 -10.542 10.037 1.00 0.00 C ATOM 162 CE LYS A 12 -12.926 -11.559 11.093 1.00 0.00 C ATOM 163 NZ LYS A 12 -13.185 -12.938 10.622 1.00 0.00 N ATOM 0 H LYS A 12 -13.245 -6.096 8.005 1.00 0.00 H new ATOM 0 HA LYS A 12 -11.344 -7.186 9.910 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -13.689 -8.040 9.293 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -12.928 -8.704 7.861 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.447 -10.093 9.154 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -11.774 -9.209 10.631 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -14.228 -9.986 10.398 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -13.674 -11.063 9.132 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.865 -11.435 11.309 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -13.463 -11.379 12.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -12.883 -13.616 11.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -14.202 -13.057 10.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -12.653 -13.111 9.746 1.00 0.00 H new ATOM 177 N PRO A 13 -9.314 -7.418 8.588 1.00 0.00 N ATOM 178 CA PRO A 13 -8.085 -7.622 7.840 1.00 0.00 C ATOM 179 C PRO A 13 -7.887 -9.101 7.504 1.00 0.00 C ATOM 180 O PRO A 13 -8.640 -9.954 7.972 1.00 0.00 O ATOM 181 CB PRO A 13 -6.986 -7.062 8.728 1.00 0.00 C ATOM 182 CG PRO A 13 -7.576 -6.991 10.127 1.00 0.00 C ATOM 183 CD PRO A 13 -9.082 -7.162 10.007 1.00 0.00 C ATOM 0 HA PRO A 13 -8.092 -7.118 6.873 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -6.104 -7.702 8.708 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -6.672 -6.076 8.386 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -7.152 -7.771 10.760 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -7.336 -6.036 10.594 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -9.437 -7.989 10.622 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -9.610 -6.268 10.340 1.00 0.00 H new ATOM 191 N VAL A 14 -6.871 -9.361 6.695 1.00 0.00 N ATOM 192 CA VAL A 14 -6.564 -10.722 6.290 1.00 0.00 C ATOM 193 C VAL A 14 -6.371 -11.588 7.536 1.00 0.00 C ATOM 194 O VAL A 14 -5.697 -11.181 8.481 1.00 0.00 O ATOM 195 CB VAL A 14 -5.348 -10.731 5.362 1.00 0.00 C ATOM 196 CG1 VAL A 14 -5.708 -10.178 3.981 1.00 0.00 C ATOM 197 CG2 VAL A 14 -4.183 -9.954 5.977 1.00 0.00 C ATOM 0 H VAL A 14 -6.249 -8.651 6.308 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.392 -11.147 5.722 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.031 -11.766 5.236 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.826 -10.195 3.341 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.491 -10.792 3.536 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.063 -9.152 4.081 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.332 -9.976 5.297 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.485 -8.920 6.147 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.901 -10.411 6.926 1.00 0.00 H new ATOM 207 N ASP A 15 -6.975 -12.767 7.498 1.00 0.00 N ATOM 208 CA ASP A 15 -6.878 -13.694 8.613 1.00 0.00 C ATOM 209 C ASP A 15 -5.438 -14.199 8.727 1.00 0.00 C ATOM 210 O ASP A 15 -4.908 -14.331 9.829 1.00 0.00 O ATOM 211 CB ASP A 15 -7.787 -14.906 8.402 1.00 0.00 C ATOM 212 CG ASP A 15 -7.312 -15.894 7.334 1.00 0.00 C ATOM 213 OD1 ASP A 15 -6.967 -17.029 7.725 1.00 0.00 O ATOM 214 OD2 ASP A 15 -7.306 -15.491 6.151 1.00 0.00 O ATOM 0 H ASP A 15 -7.533 -13.101 6.713 1.00 0.00 H new ATOM 0 HA ASP A 15 -7.183 -13.167 9.517 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -7.884 -15.437 9.349 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -8.782 -14.552 8.131 1.00 0.00 H new ATOM 220 N ASN A 16 -4.845 -14.467 7.573 1.00 0.00 N ATOM 221 CA ASN A 16 -3.477 -14.954 7.529 1.00 0.00 C ATOM 222 C ASN A 16 -2.848 -14.577 6.186 1.00 0.00 C ATOM 223 O ASN A 16 -2.943 -15.331 5.219 1.00 0.00 O ATOM 224 CB ASN A 16 -3.429 -16.477 7.662 1.00 0.00 C ATOM 225 CG ASN A 16 -4.383 -17.144 6.669 1.00 0.00 C ATOM 226 OD1 ASN A 16 -5.026 -16.499 5.857 1.00 0.00 O ATOM 227 ND2 ASN A 16 -4.439 -18.468 6.778 1.00 0.00 N ATOM 0 H ASN A 16 -5.287 -14.356 6.661 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.933 -14.502 8.358 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -2.412 -16.829 7.488 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -3.696 -16.766 8.679 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -5.047 -19.005 6.160 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -3.874 -18.946 7.480 1.00 0.00 H new ATOM 234 N PHE A 17 -2.220 -13.410 6.170 1.00 0.00 N ATOM 235 CA PHE A 17 -1.576 -12.924 4.962 1.00 0.00 C ATOM 236 C PHE A 17 -0.381 -13.803 4.585 1.00 0.00 C ATOM 237 O PHE A 17 0.430 -14.154 5.441 1.00 0.00 O ATOM 238 CB PHE A 17 -1.078 -11.508 5.259 1.00 0.00 C ATOM 239 CG PHE A 17 -1.211 -10.541 4.080 1.00 0.00 C ATOM 240 CD1 PHE A 17 -1.503 -11.018 2.840 1.00 0.00 C ATOM 241 CD2 PHE A 17 -1.038 -9.206 4.273 1.00 0.00 C ATOM 242 CE1 PHE A 17 -1.627 -10.121 1.746 1.00 0.00 C ATOM 243 CE2 PHE A 17 -1.161 -8.309 3.179 1.00 0.00 C ATOM 244 CZ PHE A 17 -1.453 -8.785 1.939 1.00 0.00 C ATOM 0 H PHE A 17 -2.144 -12.787 6.974 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.282 -12.942 4.132 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -1.634 -11.109 6.107 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -0.031 -11.557 5.559 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.640 -12.078 2.688 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -0.807 -8.828 5.258 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -1.859 -10.499 0.761 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -1.023 -7.249 3.332 1.00 0.00 H new ATOM 0 HZ PHE A 17 -1.547 -8.103 1.107 1.00 0.00 H new ATOM 254 N ASP A 18 -0.311 -14.134 3.304 1.00 0.00 N ATOM 255 CA ASP A 18 0.770 -14.965 2.804 1.00 0.00 C ATOM 256 C ASP A 18 1.533 -14.203 1.718 1.00 0.00 C ATOM 257 O ASP A 18 0.941 -13.752 0.739 1.00 0.00 O ATOM 258 CB ASP A 18 0.232 -16.257 2.186 1.00 0.00 C ATOM 259 CG ASP A 18 0.486 -17.522 3.007 1.00 0.00 C ATOM 260 OD1 ASP A 18 0.832 -18.546 2.380 1.00 0.00 O ATOM 261 OD2 ASP A 18 0.329 -17.436 4.245 1.00 0.00 O ATOM 0 H ASP A 18 -0.986 -13.841 2.597 1.00 0.00 H new ATOM 0 HA ASP A 18 1.421 -15.211 3.643 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -0.842 -16.150 2.035 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.681 -16.385 1.201 1.00 0.00 H new ATOM 267 N TRP A 19 2.836 -14.083 1.928 1.00 0.00 N ATOM 268 CA TRP A 19 3.686 -13.384 0.979 1.00 0.00 C ATOM 269 C TRP A 19 4.111 -14.382 -0.099 1.00 0.00 C ATOM 270 O TRP A 19 4.965 -14.077 -0.930 1.00 0.00 O ATOM 271 CB TRP A 19 4.872 -12.727 1.687 1.00 0.00 C ATOM 272 CG TRP A 19 4.542 -12.177 3.076 1.00 0.00 C ATOM 273 CD1 TRP A 19 4.657 -12.798 4.258 1.00 0.00 C ATOM 274 CD2 TRP A 19 4.035 -10.861 3.381 1.00 0.00 C ATOM 275 NE1 TRP A 19 4.262 -11.981 5.298 1.00 0.00 N ATOM 276 CE2 TRP A 19 3.872 -10.766 4.748 1.00 0.00 C ATOM 277 CE3 TRP A 19 3.725 -9.785 2.530 1.00 0.00 C ATOM 278 CZ2 TRP A 19 3.394 -9.615 5.385 1.00 0.00 C ATOM 279 CZ3 TRP A 19 3.248 -8.642 3.182 1.00 0.00 C ATOM 280 CH2 TRP A 19 3.078 -8.531 4.557 1.00 0.00 C ATOM 0 H TRP A 19 3.324 -14.458 2.742 1.00 0.00 H new ATOM 0 HA TRP A 19 3.143 -12.568 0.502 1.00 0.00 H new ATOM 0 HB2 TRP A 19 5.677 -13.457 1.778 1.00 0.00 H new ATOM 0 HB3 TRP A 19 5.248 -11.914 1.066 1.00 0.00 H new ATOM 0 HD1 TRP A 19 5.014 -13.810 4.381 1.00 0.00 H new ATOM 0 HE1 TRP A 19 4.257 -12.224 6.289 1.00 0.00 H new ATOM 0 HE3 TRP A 19 3.846 -9.837 1.458 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 3.275 -9.566 6.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 2.994 -7.786 2.574 1.00 0.00 H new ATOM 0 HH2 TRP A 19 2.704 -7.613 4.985 1.00 0.00 H new ATOM 291 N SER A 20 3.495 -15.554 -0.052 1.00 0.00 N ATOM 292 CA SER A 20 3.799 -16.599 -1.015 1.00 0.00 C ATOM 293 C SER A 20 3.874 -16.007 -2.423 1.00 0.00 C ATOM 294 O SER A 20 4.936 -16.003 -3.044 1.00 0.00 O ATOM 295 CB SER A 20 2.755 -17.716 -0.964 1.00 0.00 C ATOM 296 OG SER A 20 3.340 -19.003 -1.143 1.00 0.00 O ATOM 0 H SER A 20 2.786 -15.803 0.638 1.00 0.00 H new ATOM 0 HA SER A 20 4.766 -17.031 -0.757 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.236 -17.684 -0.006 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.006 -17.548 -1.738 1.00 0.00 H new ATOM 0 HG SER A 20 2.641 -19.689 -1.102 1.00 0.00 H new ATOM 302 N GLN A 21 2.732 -15.520 -2.888 1.00 0.00 N ATOM 303 CA GLN A 21 2.655 -14.926 -4.212 1.00 0.00 C ATOM 304 C GLN A 21 2.679 -13.399 -4.111 1.00 0.00 C ATOM 305 O GLN A 21 3.432 -12.738 -4.825 1.00 0.00 O ATOM 306 CB GLN A 21 1.409 -15.407 -4.956 1.00 0.00 C ATOM 307 CG GLN A 21 0.134 -14.948 -4.245 1.00 0.00 C ATOM 308 CD GLN A 21 -0.277 -13.547 -4.706 1.00 0.00 C ATOM 309 OE1 GLN A 21 -0.835 -12.807 -3.753 1.00 0.00 O flip ATOM 310 NE2 GLN A 21 -0.099 -13.165 -5.851 1.00 0.00 N flip ATOM 0 H GLN A 21 1.853 -15.525 -2.371 1.00 0.00 H new ATOM 0 HA GLN A 21 3.526 -15.246 -4.784 1.00 0.00 H new ATOM 0 HB2 GLN A 21 1.419 -15.023 -5.976 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.420 -16.495 -5.025 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -0.673 -15.652 -4.447 1.00 0.00 H new ATOM 0 HG3 GLN A 21 0.295 -14.948 -3.167 1.00 0.00 H new ATOM 0 HE21 GLN A 21 0.336 -13.786 -6.534 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -0.385 -12.225 -6.125 1.00 0.00 H new ATOM 319 N TYR A 22 1.847 -12.884 -3.219 1.00 0.00 N ATOM 320 CA TYR A 22 1.763 -11.448 -3.015 1.00 0.00 C ATOM 321 C TYR A 22 3.127 -10.867 -2.636 1.00 0.00 C ATOM 322 O TYR A 22 3.432 -10.709 -1.455 1.00 0.00 O ATOM 323 CB TYR A 22 0.793 -11.243 -1.850 1.00 0.00 C ATOM 324 CG TYR A 22 1.064 -9.979 -1.030 1.00 0.00 C ATOM 325 CD1 TYR A 22 1.524 -8.838 -1.653 1.00 0.00 C ATOM 326 CD2 TYR A 22 0.847 -9.982 0.333 1.00 0.00 C ATOM 327 CE1 TYR A 22 1.779 -7.649 -0.882 1.00 0.00 C ATOM 328 CE2 TYR A 22 1.101 -8.793 1.105 1.00 0.00 C ATOM 329 CZ TYR A 22 1.555 -7.685 0.459 1.00 0.00 C ATOM 330 OH TYR A 22 1.796 -6.562 1.188 1.00 0.00 O ATOM 0 H TYR A 22 1.224 -13.436 -2.629 1.00 0.00 H new ATOM 0 HA TYR A 22 1.432 -10.950 -3.926 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -0.224 -11.200 -2.240 1.00 0.00 H new ATOM 0 HB3 TYR A 22 0.845 -12.110 -1.191 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.693 -8.836 -2.720 1.00 0.00 H new ATOM 0 HD2 TYR A 22 0.487 -10.876 0.821 1.00 0.00 H new ATOM 0 HE1 TYR A 22 2.140 -6.749 -1.358 1.00 0.00 H new ATOM 0 HE2 TYR A 22 0.935 -8.781 2.172 1.00 0.00 H new ATOM 0 HH TYR A 22 1.375 -6.647 2.069 1.00 0.00 H new ATOM 340 N HIS A 23 3.911 -10.565 -3.661 1.00 0.00 N ATOM 341 CA HIS A 23 5.235 -10.005 -3.450 1.00 0.00 C ATOM 342 C HIS A 23 5.861 -9.647 -4.799 1.00 0.00 C ATOM 343 O HIS A 23 5.151 -9.436 -5.781 1.00 0.00 O ATOM 344 CB HIS A 23 6.103 -10.959 -2.628 1.00 0.00 C ATOM 345 CG HIS A 23 6.493 -12.221 -3.360 1.00 0.00 C ATOM 346 ND1 HIS A 23 6.265 -12.611 -4.647 1.00 0.00 N flip ATOM 347 CD2 HIS A 23 7.203 -13.247 -2.761 1.00 0.00 C flip ATOM 348 CE1 HIS A 23 6.806 -13.810 -4.824 1.00 0.00 C flip ATOM 349 NE2 HIS A 23 7.388 -14.206 -3.656 1.00 0.00 N flip ATOM 0 H HIS A 23 3.655 -10.698 -4.639 1.00 0.00 H new ATOM 0 HA HIS A 23 5.157 -9.086 -2.869 1.00 0.00 H new ATOM 0 HB2 HIS A 23 7.008 -10.436 -2.320 1.00 0.00 H new ATOM 0 HB3 HIS A 23 5.566 -11.230 -1.719 1.00 0.00 H new ATOM 0 HD2 HIS A 23 7.548 -13.263 -1.738 1.00 0.00 H new ATOM 0 HE1 HIS A 23 6.788 -14.379 -5.742 1.00 0.00 H new ATOM 0 HE2 HIS A 23 7.879 -15.086 -3.499 1.00 0.00 H new ATOM 357 N GLY A 24 7.185 -9.589 -4.804 1.00 0.00 N ATOM 358 CA GLY A 24 7.915 -9.260 -6.016 1.00 0.00 C ATOM 359 C GLY A 24 7.512 -7.881 -6.542 1.00 0.00 C ATOM 360 O GLY A 24 7.244 -6.969 -5.762 1.00 0.00 O ATOM 0 H GLY A 24 7.771 -9.764 -3.988 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.986 -9.278 -5.816 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.721 -10.015 -6.778 1.00 0.00 H new ATOM 364 N LYS A 25 7.482 -7.772 -7.862 1.00 0.00 N ATOM 365 CA LYS A 25 7.116 -6.520 -8.502 1.00 0.00 C ATOM 366 C LYS A 25 5.610 -6.511 -8.771 1.00 0.00 C ATOM 367 O LYS A 25 5.053 -7.503 -9.238 1.00 0.00 O ATOM 368 CB LYS A 25 7.965 -6.289 -9.753 1.00 0.00 C ATOM 369 CG LYS A 25 8.780 -5.000 -9.632 1.00 0.00 C ATOM 370 CD LYS A 25 9.333 -4.571 -10.993 1.00 0.00 C ATOM 371 CE LYS A 25 8.211 -4.441 -12.025 1.00 0.00 C ATOM 372 NZ LYS A 25 8.238 -5.582 -12.967 1.00 0.00 N ATOM 0 H LYS A 25 7.705 -8.531 -8.506 1.00 0.00 H new ATOM 0 HA LYS A 25 7.328 -5.679 -7.842 1.00 0.00 H new ATOM 0 HB2 LYS A 25 8.636 -7.135 -9.903 1.00 0.00 H new ATOM 0 HB3 LYS A 25 7.320 -6.235 -10.630 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.154 -4.207 -9.223 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.602 -5.150 -8.932 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.853 -3.618 -10.894 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.066 -5.300 -11.338 1.00 0.00 H new ATOM 0 HE2 LYS A 25 7.246 -4.402 -11.519 1.00 0.00 H new ATOM 0 HE3 LYS A 25 8.321 -3.506 -12.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 7.481 -5.469 -13.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 9.158 -5.611 -13.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 8.094 -6.469 -12.443 1.00 0.00 H new ATOM 386 N TRP A 26 4.993 -5.379 -8.464 1.00 0.00 N ATOM 387 CA TRP A 26 3.562 -5.227 -8.667 1.00 0.00 C ATOM 388 C TRP A 26 3.313 -3.839 -9.261 1.00 0.00 C ATOM 389 O TRP A 26 4.225 -3.016 -9.327 1.00 0.00 O ATOM 390 CB TRP A 26 2.796 -5.467 -7.365 1.00 0.00 C ATOM 391 CG TRP A 26 2.544 -6.944 -7.054 1.00 0.00 C ATOM 392 CD1 TRP A 26 3.445 -7.928 -6.939 1.00 0.00 C ATOM 393 CD2 TRP A 26 1.263 -7.567 -6.822 1.00 0.00 C ATOM 394 NE1 TRP A 26 2.842 -9.135 -6.651 1.00 0.00 N ATOM 395 CE2 TRP A 26 1.473 -8.909 -6.577 1.00 0.00 C ATOM 396 CE3 TRP A 26 -0.030 -7.015 -6.818 1.00 0.00 C ATOM 397 CZ2 TRP A 26 0.436 -9.811 -6.311 1.00 0.00 C ATOM 398 CZ3 TRP A 26 -1.056 -7.930 -6.550 1.00 0.00 C ATOM 399 CH2 TRP A 26 -0.861 -9.284 -6.302 1.00 0.00 C ATOM 0 H TRP A 26 5.458 -4.558 -8.076 1.00 0.00 H new ATOM 0 HA TRP A 26 3.190 -5.976 -9.366 1.00 0.00 H new ATOM 0 HB2 TRP A 26 3.353 -5.023 -6.540 1.00 0.00 H new ATOM 0 HB3 TRP A 26 1.838 -4.949 -7.418 1.00 0.00 H new ATOM 0 HD1 TRP A 26 4.510 -7.794 -7.057 1.00 0.00 H new ATOM 0 HE1 TRP A 26 3.314 -10.029 -6.517 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -0.217 -5.968 -7.007 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 0.626 -10.857 -6.123 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -2.070 -7.558 -6.535 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.706 -9.926 -6.103 1.00 0.00 H new ATOM 410 N TRP A 27 2.074 -3.622 -9.677 1.00 0.00 N ATOM 411 CA TRP A 27 1.694 -2.348 -10.263 1.00 0.00 C ATOM 412 C TRP A 27 0.284 -2.007 -9.778 1.00 0.00 C ATOM 413 O TRP A 27 -0.657 -2.764 -10.014 1.00 0.00 O ATOM 414 CB TRP A 27 1.808 -2.390 -11.788 1.00 0.00 C ATOM 415 CG TRP A 27 2.798 -3.433 -12.310 1.00 0.00 C ATOM 416 CD1 TRP A 27 2.816 -4.750 -12.064 1.00 0.00 C ATOM 417 CD2 TRP A 27 3.922 -3.191 -13.182 1.00 0.00 C ATOM 418 NE1 TRP A 27 3.864 -5.372 -12.711 1.00 0.00 N ATOM 419 CE2 TRP A 27 4.558 -4.393 -13.413 1.00 0.00 C ATOM 420 CE3 TRP A 27 4.386 -1.995 -13.758 1.00 0.00 C ATOM 421 CZ2 TRP A 27 5.694 -4.517 -14.222 1.00 0.00 C ATOM 422 CZ3 TRP A 27 5.522 -2.135 -14.564 1.00 0.00 C ATOM 423 CH2 TRP A 27 6.174 -3.339 -14.806 1.00 0.00 C ATOM 0 H TRP A 27 1.320 -4.307 -9.620 1.00 0.00 H new ATOM 0 HA TRP A 27 2.373 -1.558 -9.943 1.00 0.00 H new ATOM 0 HB2 TRP A 27 0.824 -2.595 -12.210 1.00 0.00 H new ATOM 0 HB3 TRP A 27 2.110 -1.406 -12.147 1.00 0.00 H new ATOM 0 HD1 TRP A 27 2.100 -5.261 -11.438 1.00 0.00 H new ATOM 0 HE1 TRP A 27 4.088 -6.367 -12.680 1.00 0.00 H new ATOM 0 HE3 TRP A 27 3.904 -1.043 -13.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 6.174 -5.470 -14.387 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 5.920 -1.246 -15.030 1.00 0.00 H new ATOM 0 HH2 TRP A 27 7.047 -3.365 -15.442 1.00 0.00 H new ATOM 434 N GLU A 28 0.181 -0.868 -9.109 1.00 0.00 N ATOM 435 CA GLU A 28 -1.098 -0.418 -8.589 1.00 0.00 C ATOM 436 C GLU A 28 -2.173 -0.505 -9.675 1.00 0.00 C ATOM 437 O GLU A 28 -1.861 -0.486 -10.865 1.00 0.00 O ATOM 438 CB GLU A 28 -0.995 1.004 -8.034 1.00 0.00 C ATOM 439 CG GLU A 28 -0.031 1.060 -6.846 1.00 0.00 C ATOM 440 CD GLU A 28 1.084 2.078 -7.092 1.00 0.00 C ATOM 441 OE1 GLU A 28 1.782 1.919 -8.116 1.00 0.00 O ATOM 442 OE2 GLU A 28 1.212 2.993 -6.250 1.00 0.00 O ATOM 0 H GLU A 28 0.964 -0.243 -8.915 1.00 0.00 H new ATOM 0 HA GLU A 28 -1.385 -1.074 -7.767 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.652 1.680 -8.817 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -1.981 1.350 -7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.578 1.326 -5.942 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.402 0.074 -6.678 1.00 0.00 H new ATOM 450 N VAL A 29 -3.416 -0.599 -9.226 1.00 0.00 N ATOM 451 CA VAL A 29 -4.538 -0.689 -10.144 1.00 0.00 C ATOM 452 C VAL A 29 -5.449 0.525 -9.951 1.00 0.00 C ATOM 453 O VAL A 29 -5.520 1.397 -10.816 1.00 0.00 O ATOM 454 CB VAL A 29 -5.267 -2.021 -9.951 1.00 0.00 C ATOM 455 CG1 VAL A 29 -5.469 -2.735 -11.289 1.00 0.00 C ATOM 456 CG2 VAL A 29 -4.521 -2.915 -8.959 1.00 0.00 C ATOM 0 H VAL A 29 -3.671 -0.615 -8.238 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.189 -0.672 -11.176 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.251 -1.807 -9.534 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.989 -3.678 -11.123 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -6.062 -2.105 -11.952 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.499 -2.931 -11.747 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.060 -3.855 -8.840 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.518 -3.117 -9.334 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -4.453 -2.411 -7.995 1.00 0.00 H new ATOM 466 N ALA A 30 -6.124 0.542 -8.810 1.00 0.00 N ATOM 467 CA ALA A 30 -7.027 1.635 -8.492 1.00 0.00 C ATOM 468 C ALA A 30 -7.135 1.776 -6.972 1.00 0.00 C ATOM 469 O ALA A 30 -7.381 0.796 -6.271 1.00 0.00 O ATOM 470 CB ALA A 30 -8.384 1.384 -9.153 1.00 0.00 C ATOM 0 H ALA A 30 -6.063 -0.183 -8.095 1.00 0.00 H new ATOM 0 HA ALA A 30 -6.643 2.577 -8.883 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.062 2.204 -8.915 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.256 1.321 -10.234 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.802 0.448 -8.782 1.00 0.00 H new ATOM 476 N LYS A 31 -6.946 3.002 -6.509 1.00 0.00 N ATOM 477 CA LYS A 31 -7.019 3.283 -5.085 1.00 0.00 C ATOM 478 C LYS A 31 -7.425 4.744 -4.878 1.00 0.00 C ATOM 479 O LYS A 31 -7.466 5.521 -5.831 1.00 0.00 O ATOM 480 CB LYS A 31 -5.706 2.907 -4.396 1.00 0.00 C ATOM 481 CG LYS A 31 -4.585 3.873 -4.787 1.00 0.00 C ATOM 482 CD LYS A 31 -3.327 3.111 -5.207 1.00 0.00 C ATOM 483 CE LYS A 31 -2.282 4.061 -5.796 1.00 0.00 C ATOM 484 NZ LYS A 31 -0.970 3.859 -5.141 1.00 0.00 N ATOM 0 H LYS A 31 -6.742 3.812 -7.094 1.00 0.00 H new ATOM 0 HA LYS A 31 -7.786 2.668 -4.615 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -5.842 2.921 -3.315 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -5.426 1.890 -4.669 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.919 4.511 -5.606 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.354 4.528 -3.947 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.907 2.592 -4.345 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -3.587 2.350 -5.942 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -2.190 3.890 -6.869 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -2.606 5.094 -5.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.794 4.634 -4.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -0.973 2.953 -4.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -0.220 3.847 -5.862 1.00 0.00 H new ATOM 498 N TYR A 32 -7.715 5.073 -3.628 1.00 0.00 N ATOM 499 CA TYR A 32 -8.116 6.427 -3.284 1.00 0.00 C ATOM 500 C TYR A 32 -7.057 7.441 -3.723 1.00 0.00 C ATOM 501 O TYR A 32 -5.882 7.302 -3.387 1.00 0.00 O ATOM 502 CB TYR A 32 -8.233 6.458 -1.759 1.00 0.00 C ATOM 503 CG TYR A 32 -9.637 6.150 -1.236 1.00 0.00 C ATOM 504 CD1 TYR A 32 -10.564 5.546 -2.062 1.00 0.00 C ATOM 505 CD2 TYR A 32 -9.978 6.476 0.061 1.00 0.00 C ATOM 506 CE1 TYR A 32 -11.886 5.256 -1.570 1.00 0.00 C ATOM 507 CE2 TYR A 32 -11.300 6.186 0.553 1.00 0.00 C ATOM 508 CZ TYR A 32 -12.189 5.591 -0.287 1.00 0.00 C ATOM 509 OH TYR A 32 -13.437 5.317 0.178 1.00 0.00 O ATOM 0 H TYR A 32 -7.680 4.425 -2.841 1.00 0.00 H new ATOM 0 HA TYR A 32 -9.051 6.688 -3.780 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -7.533 5.737 -1.337 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -7.931 7.443 -1.402 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -10.298 5.291 -3.077 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -9.253 6.949 0.707 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -12.620 4.783 -2.205 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -11.579 6.435 1.566 1.00 0.00 H new ATOM 0 HH TYR A 32 -13.511 5.611 1.110 1.00 0.00 H new ATOM 519 N PRO A 33 -7.524 8.464 -4.488 1.00 0.00 N ATOM 520 CA PRO A 33 -6.631 9.501 -4.976 1.00 0.00 C ATOM 521 C PRO A 33 -6.247 10.468 -3.854 1.00 0.00 C ATOM 522 O PRO A 33 -6.619 10.263 -2.699 1.00 0.00 O ATOM 523 CB PRO A 33 -7.391 10.175 -6.107 1.00 0.00 C ATOM 524 CG PRO A 33 -8.852 9.804 -5.906 1.00 0.00 C ATOM 525 CD PRO A 33 -8.909 8.661 -4.905 1.00 0.00 C ATOM 0 HA PRO A 33 -5.681 9.103 -5.334 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.255 11.256 -6.079 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.031 9.833 -7.078 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -9.417 10.661 -5.539 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -9.304 9.506 -6.852 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -9.547 8.909 -4.056 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -9.318 7.758 -5.358 1.00 0.00 H new ATOM 533 N SER A 34 -5.509 11.501 -4.233 1.00 0.00 N ATOM 534 CA SER A 34 -5.071 12.500 -3.273 1.00 0.00 C ATOM 535 C SER A 34 -5.441 13.899 -3.769 1.00 0.00 C ATOM 536 O SER A 34 -5.934 14.056 -4.885 1.00 0.00 O ATOM 537 CB SER A 34 -3.564 12.404 -3.027 1.00 0.00 C ATOM 538 OG SER A 34 -2.876 13.571 -3.472 1.00 0.00 O ATOM 0 H SER A 34 -5.203 11.668 -5.192 1.00 0.00 H new ATOM 0 HA SER A 34 -5.578 12.311 -2.327 1.00 0.00 H new ATOM 0 HB2 SER A 34 -3.379 12.257 -1.963 1.00 0.00 H new ATOM 0 HB3 SER A 34 -3.167 11.530 -3.543 1.00 0.00 H new ATOM 0 HG SER A 34 -2.156 13.786 -2.843 1.00 0.00 H new ATOM 544 N PRO A 35 -5.182 14.906 -2.893 1.00 0.00 N ATOM 545 CA PRO A 35 -5.482 16.288 -3.230 1.00 0.00 C ATOM 546 C PRO A 35 -4.461 16.843 -4.224 1.00 0.00 C ATOM 547 O PRO A 35 -4.833 17.407 -5.253 1.00 0.00 O ATOM 548 CB PRO A 35 -5.481 17.026 -1.902 1.00 0.00 C ATOM 549 CG PRO A 35 -4.727 16.134 -0.929 1.00 0.00 C ATOM 550 CD PRO A 35 -4.599 14.758 -1.562 1.00 0.00 C ATOM 0 HA PRO A 35 -6.443 16.400 -3.731 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -4.997 17.998 -1.996 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -6.498 17.209 -1.556 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -3.742 16.549 -0.715 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -5.259 16.070 0.020 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -3.557 14.444 -1.619 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -5.128 14.004 -0.980 1.00 0.00 H new ATOM 558 N ASN A 36 -3.193 16.666 -3.883 1.00 0.00 N ATOM 559 CA ASN A 36 -2.115 17.143 -4.733 1.00 0.00 C ATOM 560 C ASN A 36 -1.697 16.027 -5.693 1.00 0.00 C ATOM 561 O ASN A 36 -0.597 16.057 -6.243 1.00 0.00 O ATOM 562 CB ASN A 36 -0.891 17.534 -3.902 1.00 0.00 C ATOM 563 CG ASN A 36 -0.558 19.017 -4.083 1.00 0.00 C ATOM 564 OD1 ASN A 36 -1.244 19.755 -4.770 1.00 0.00 O ATOM 565 ND2 ASN A 36 0.532 19.410 -3.430 1.00 0.00 N ATOM 0 H ASN A 36 -2.888 16.199 -3.029 1.00 0.00 H new ATOM 0 HA ASN A 36 -2.475 18.016 -5.278 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.080 17.326 -2.849 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.036 16.926 -4.199 1.00 0.00 H new ATOM 0 HD21 ASN A 36 0.839 20.381 -3.487 1.00 0.00 H new ATOM 0 HD22 ASN A 36 1.061 18.740 -2.872 1.00 0.00 H new ATOM 572 N GLY A 37 -2.597 15.070 -5.865 1.00 0.00 N ATOM 573 CA GLY A 37 -2.336 13.947 -6.749 1.00 0.00 C ATOM 574 C GLY A 37 -0.865 13.529 -6.684 1.00 0.00 C ATOM 575 O GLY A 37 -0.036 14.044 -7.432 1.00 0.00 O ATOM 0 H GLY A 37 -3.508 15.049 -5.407 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -2.970 13.105 -6.470 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -2.596 14.217 -7.772 1.00 0.00 H new ATOM 579 N LYS A 38 -0.587 12.598 -5.783 1.00 0.00 N ATOM 580 CA LYS A 38 0.768 12.105 -5.611 1.00 0.00 C ATOM 581 C LYS A 38 0.814 10.617 -5.963 1.00 0.00 C ATOM 582 O LYS A 38 0.176 9.799 -5.302 1.00 0.00 O ATOM 583 CB LYS A 38 1.278 12.419 -4.202 1.00 0.00 C ATOM 584 CG LYS A 38 0.250 12.012 -3.144 1.00 0.00 C ATOM 585 CD LYS A 38 0.928 11.327 -1.956 1.00 0.00 C ATOM 586 CE LYS A 38 0.423 9.893 -1.789 1.00 0.00 C ATOM 587 NZ LYS A 38 0.897 9.043 -2.904 1.00 0.00 N ATOM 0 H LYS A 38 -1.278 12.172 -5.165 1.00 0.00 H new ATOM 0 HA LYS A 38 1.448 12.616 -6.293 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.216 11.892 -4.025 1.00 0.00 H new ATOM 0 HB3 LYS A 38 1.490 13.485 -4.117 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.291 12.893 -2.800 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.485 11.339 -3.586 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.008 11.321 -2.103 1.00 0.00 H new ATOM 0 HD3 LYS A 38 0.733 11.893 -1.045 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.773 9.486 -0.840 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -0.667 9.886 -1.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.848 8.043 -2.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 0.296 9.198 -3.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.880 9.290 -3.135 1.00 0.00 H new ATOM 601 N TYR A 39 1.574 10.311 -7.005 1.00 0.00 N ATOM 602 CA TYR A 39 1.710 8.936 -7.453 1.00 0.00 C ATOM 603 C TYR A 39 2.832 8.805 -8.485 1.00 0.00 C ATOM 604 O TYR A 39 3.360 9.807 -8.965 1.00 0.00 O ATOM 605 CB TYR A 39 0.379 8.574 -8.115 1.00 0.00 C ATOM 606 CG TYR A 39 -0.744 8.260 -7.125 1.00 0.00 C ATOM 607 CD1 TYR A 39 -0.509 7.411 -6.062 1.00 0.00 C ATOM 608 CD2 TYR A 39 -1.991 8.826 -7.294 1.00 0.00 C ATOM 609 CE1 TYR A 39 -1.566 7.116 -5.130 1.00 0.00 C ATOM 610 CE2 TYR A 39 -3.048 8.531 -6.361 1.00 0.00 C ATOM 611 CZ TYR A 39 -2.783 7.690 -5.325 1.00 0.00 C ATOM 612 OH TYR A 39 -3.782 7.411 -4.445 1.00 0.00 O ATOM 0 H TYR A 39 2.102 10.992 -7.551 1.00 0.00 H new ATOM 0 HA TYR A 39 1.951 8.281 -6.616 1.00 0.00 H new ATOM 0 HB2 TYR A 39 0.066 9.400 -8.753 1.00 0.00 H new ATOM 0 HB3 TYR A 39 0.530 7.710 -8.763 1.00 0.00 H new ATOM 0 HD1 TYR A 39 0.467 6.968 -5.930 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.174 9.490 -8.126 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -1.396 6.453 -4.294 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -4.029 8.967 -6.481 1.00 0.00 H new ATOM 0 HH TYR A 39 -4.640 7.395 -4.918 1.00 0.00 H new ATOM 622 N GLY A 40 3.163 7.560 -8.797 1.00 0.00 N ATOM 623 CA GLY A 40 4.213 7.285 -9.764 1.00 0.00 C ATOM 624 C GLY A 40 4.029 5.902 -10.393 1.00 0.00 C ATOM 625 O GLY A 40 4.230 4.884 -9.733 1.00 0.00 O ATOM 0 H GLY A 40 2.723 6.731 -8.398 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.204 8.047 -10.543 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.186 7.340 -9.276 1.00 0.00 H new ATOM 629 N LYS A 41 3.651 5.911 -11.663 1.00 0.00 N ATOM 630 CA LYS A 41 3.439 4.670 -12.389 1.00 0.00 C ATOM 631 C LYS A 41 4.553 4.491 -13.422 1.00 0.00 C ATOM 632 O LYS A 41 4.383 4.838 -14.590 1.00 0.00 O ATOM 633 CB LYS A 41 2.032 4.635 -12.989 1.00 0.00 C ATOM 634 CG LYS A 41 1.822 3.367 -13.820 1.00 0.00 C ATOM 635 CD LYS A 41 0.562 2.622 -13.374 1.00 0.00 C ATOM 636 CE LYS A 41 0.903 1.521 -12.368 1.00 0.00 C ATOM 637 NZ LYS A 41 -0.093 1.494 -11.273 1.00 0.00 N ATOM 0 H LYS A 41 3.486 6.758 -12.208 1.00 0.00 H new ATOM 0 HA LYS A 41 3.493 3.818 -11.711 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.291 4.678 -12.191 1.00 0.00 H new ATOM 0 HB3 LYS A 41 1.878 5.514 -13.615 1.00 0.00 H new ATOM 0 HG2 LYS A 41 1.740 3.629 -14.875 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.689 2.714 -13.720 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -0.140 3.324 -12.925 1.00 0.00 H new ATOM 0 HD3 LYS A 41 0.067 2.186 -14.242 1.00 0.00 H new ATOM 0 HE2 LYS A 41 0.925 0.554 -12.871 1.00 0.00 H new ATOM 0 HE3 LYS A 41 1.899 1.690 -11.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 0.329 1.893 -10.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -0.923 2.058 -11.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -0.385 0.512 -11.094 1.00 0.00 H new ATOM 651 N CYS A 42 5.668 3.951 -12.954 1.00 0.00 N ATOM 652 CA CYS A 42 6.811 3.722 -13.823 1.00 0.00 C ATOM 653 C CYS A 42 8.062 3.603 -12.950 1.00 0.00 C ATOM 654 O CYS A 42 9.079 4.236 -13.228 1.00 0.00 O ATOM 655 CB CYS A 42 6.951 4.824 -14.875 1.00 0.00 C ATOM 656 SG CYS A 42 6.589 6.513 -14.270 1.00 0.00 S ATOM 0 H CYS A 42 5.805 3.665 -11.985 1.00 0.00 H new ATOM 0 HA CYS A 42 6.669 2.796 -14.379 1.00 0.00 H new ATOM 0 HB2 CYS A 42 7.967 4.804 -15.268 1.00 0.00 H new ATOM 0 HB3 CYS A 42 6.283 4.600 -15.707 1.00 0.00 H new ATOM 662 N GLY A 43 7.945 2.787 -11.913 1.00 0.00 N ATOM 663 CA GLY A 43 9.054 2.577 -10.998 1.00 0.00 C ATOM 664 C GLY A 43 9.310 1.084 -10.780 1.00 0.00 C ATOM 665 O GLY A 43 8.587 0.243 -11.310 1.00 0.00 O ATOM 0 H GLY A 43 7.100 2.264 -11.686 1.00 0.00 H new ATOM 0 HA2 GLY A 43 9.952 3.049 -11.395 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.838 3.056 -10.043 1.00 0.00 H new ATOM 669 N TRP A 44 10.341 0.801 -9.998 1.00 0.00 N ATOM 670 CA TRP A 44 10.702 -0.575 -9.703 1.00 0.00 C ATOM 671 C TRP A 44 10.574 -0.784 -8.193 1.00 0.00 C ATOM 672 O TRP A 44 11.187 -0.061 -7.408 1.00 0.00 O ATOM 673 CB TRP A 44 12.098 -0.903 -10.236 1.00 0.00 C ATOM 674 CG TRP A 44 13.187 0.060 -9.760 1.00 0.00 C ATOM 675 CD1 TRP A 44 13.987 -0.061 -8.691 1.00 0.00 C ATOM 676 CD2 TRP A 44 13.568 1.305 -10.384 1.00 0.00 C ATOM 677 NE1 TRP A 44 14.850 1.010 -8.581 1.00 0.00 N ATOM 678 CE2 TRP A 44 14.587 1.867 -9.644 1.00 0.00 C ATOM 679 CE3 TRP A 44 13.066 1.935 -11.537 1.00 0.00 C ATOM 680 CZ2 TRP A 44 15.193 3.085 -9.973 1.00 0.00 C ATOM 681 CZ3 TRP A 44 13.682 3.152 -11.853 1.00 0.00 C ATOM 682 CH2 TRP A 44 14.710 3.731 -11.118 1.00 0.00 C ATOM 0 H TRP A 44 10.938 1.502 -9.559 1.00 0.00 H new ATOM 0 HA TRP A 44 10.028 -1.267 -10.209 1.00 0.00 H new ATOM 0 HB2 TRP A 44 12.364 -1.915 -9.931 1.00 0.00 H new ATOM 0 HB3 TRP A 44 12.071 -0.895 -11.326 1.00 0.00 H new ATOM 0 HD1 TRP A 44 13.959 -0.892 -8.002 1.00 0.00 H new ATOM 0 HE1 TRP A 44 15.552 1.148 -7.854 1.00 0.00 H new ATOM 0 HE3 TRP A 44 12.269 1.514 -12.131 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 15.990 3.504 -9.376 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 13.334 3.678 -12.730 1.00 0.00 H new ATOM 0 HH2 TRP A 44 15.134 4.674 -11.428 1.00 0.00 H new ATOM 693 N ALA A 45 9.774 -1.776 -7.830 1.00 0.00 N ATOM 694 CA ALA A 45 9.559 -2.090 -6.428 1.00 0.00 C ATOM 695 C ALA A 45 9.469 -3.607 -6.257 1.00 0.00 C ATOM 696 O ALA A 45 8.851 -4.292 -7.070 1.00 0.00 O ATOM 697 CB ALA A 45 8.302 -1.372 -5.932 1.00 0.00 C ATOM 0 H ALA A 45 9.267 -2.373 -8.483 1.00 0.00 H new ATOM 0 HA ALA A 45 10.396 -1.740 -5.823 1.00 0.00 H new ATOM 0 HB1 ALA A 45 8.140 -1.607 -4.880 1.00 0.00 H new ATOM 0 HB2 ALA A 45 8.428 -0.296 -6.048 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.441 -1.701 -6.514 1.00 0.00 H new ATOM 703 N GLU A 46 10.096 -4.089 -5.193 1.00 0.00 N ATOM 704 CA GLU A 46 10.095 -5.513 -4.905 1.00 0.00 C ATOM 705 C GLU A 46 9.898 -5.751 -3.406 1.00 0.00 C ATOM 706 O GLU A 46 10.118 -4.851 -2.597 1.00 0.00 O ATOM 707 CB GLU A 46 11.383 -6.174 -5.400 1.00 0.00 C ATOM 708 CG GLU A 46 11.465 -6.138 -6.927 1.00 0.00 C ATOM 709 CD GLU A 46 11.320 -7.542 -7.517 1.00 0.00 C ATOM 710 OE1 GLU A 46 12.005 -8.449 -6.997 1.00 0.00 O ATOM 711 OE2 GLU A 46 10.528 -7.677 -8.475 1.00 0.00 O ATOM 0 H GLU A 46 10.608 -3.518 -4.520 1.00 0.00 H new ATOM 0 HA GLU A 46 9.262 -5.971 -5.439 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.246 -5.662 -4.974 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.422 -7.207 -5.054 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.682 -5.491 -7.322 1.00 0.00 H new ATOM 0 HG3 GLU A 46 12.418 -5.707 -7.234 1.00 0.00 H new ATOM 719 N TYR A 47 9.485 -6.967 -3.082 1.00 0.00 N ATOM 720 CA TYR A 47 9.255 -7.335 -1.695 1.00 0.00 C ATOM 721 C TYR A 47 10.225 -8.432 -1.251 1.00 0.00 C ATOM 722 O TYR A 47 10.254 -9.514 -1.836 1.00 0.00 O ATOM 723 CB TYR A 47 7.827 -7.879 -1.633 1.00 0.00 C ATOM 724 CG TYR A 47 6.746 -6.797 -1.691 1.00 0.00 C ATOM 725 CD1 TYR A 47 6.646 -5.980 -2.799 1.00 0.00 C ATOM 726 CD2 TYR A 47 5.872 -6.637 -0.635 1.00 0.00 C ATOM 727 CE1 TYR A 47 5.629 -4.961 -2.853 1.00 0.00 C ATOM 728 CE2 TYR A 47 4.855 -5.619 -0.689 1.00 0.00 C ATOM 729 CZ TYR A 47 4.784 -4.831 -1.796 1.00 0.00 C ATOM 730 OH TYR A 47 3.824 -3.870 -1.847 1.00 0.00 O ATOM 0 H TYR A 47 9.304 -7.711 -3.756 1.00 0.00 H new ATOM 0 HA TYR A 47 9.403 -6.476 -1.041 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.677 -8.573 -2.460 1.00 0.00 H new ATOM 0 HB3 TYR A 47 7.706 -8.450 -0.712 1.00 0.00 H new ATOM 0 HD1 TYR A 47 7.330 -6.105 -3.625 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.951 -7.276 0.232 1.00 0.00 H new ATOM 0 HE1 TYR A 47 5.540 -4.315 -3.714 1.00 0.00 H new ATOM 0 HE2 TYR A 47 4.164 -5.484 0.130 1.00 0.00 H new ATOM 0 HH TYR A 47 3.293 -3.894 -1.024 1.00 0.00 H new ATOM 740 N THR A 48 10.996 -8.115 -0.221 1.00 0.00 N ATOM 741 CA THR A 48 11.964 -9.061 0.308 1.00 0.00 C ATOM 742 C THR A 48 11.541 -9.535 1.699 1.00 0.00 C ATOM 743 O THR A 48 11.215 -8.723 2.564 1.00 0.00 O ATOM 744 CB THR A 48 13.339 -8.390 0.287 1.00 0.00 C ATOM 745 OG1 THR A 48 13.558 -8.091 -1.089 1.00 0.00 O ATOM 746 CG2 THR A 48 14.469 -9.360 0.642 1.00 0.00 C ATOM 0 H THR A 48 10.970 -7.217 0.261 1.00 0.00 H new ATOM 0 HA THR A 48 12.015 -9.960 -0.306 1.00 0.00 H new ATOM 0 HB THR A 48 13.346 -7.553 0.986 1.00 0.00 H new ATOM 0 HG1 THR A 48 14.428 -7.652 -1.194 1.00 0.00 H new ATOM 0 HG21 THR A 48 15.423 -8.834 0.613 1.00 0.00 H new ATOM 0 HG22 THR A 48 14.305 -9.759 1.643 1.00 0.00 H new ATOM 0 HG23 THR A 48 14.484 -10.179 -0.077 1.00 0.00 H new ATOM 754 N PRO A 49 11.560 -10.883 1.877 1.00 0.00 N ATOM 755 CA PRO A 49 11.182 -11.476 3.149 1.00 0.00 C ATOM 756 C PRO A 49 12.287 -11.288 4.191 1.00 0.00 C ATOM 757 O PRO A 49 13.461 -11.514 3.903 1.00 0.00 O ATOM 758 CB PRO A 49 10.904 -12.937 2.835 1.00 0.00 C ATOM 759 CG PRO A 49 11.581 -13.213 1.502 1.00 0.00 C ATOM 760 CD PRO A 49 11.940 -11.876 0.876 1.00 0.00 C ATOM 0 HA PRO A 49 10.304 -11.003 3.589 1.00 0.00 H new ATOM 0 HB2 PRO A 49 11.300 -13.586 3.616 1.00 0.00 H new ATOM 0 HB3 PRO A 49 9.832 -13.127 2.775 1.00 0.00 H new ATOM 0 HG2 PRO A 49 12.475 -13.819 1.646 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.917 -13.776 0.846 1.00 0.00 H new ATOM 0 HD2 PRO A 49 13.004 -11.819 0.646 1.00 0.00 H new ATOM 0 HD3 PRO A 49 11.403 -11.720 -0.060 1.00 0.00 H new ATOM 768 N GLU A 50 11.870 -10.878 5.380 1.00 0.00 N ATOM 769 CA GLU A 50 12.810 -10.657 6.466 1.00 0.00 C ATOM 770 C GLU A 50 12.297 -11.309 7.752 1.00 0.00 C ATOM 771 O GLU A 50 12.319 -10.693 8.816 1.00 0.00 O ATOM 772 CB GLU A 50 13.067 -9.163 6.674 1.00 0.00 C ATOM 773 CG GLU A 50 14.562 -8.848 6.600 1.00 0.00 C ATOM 774 CD GLU A 50 15.020 -8.069 7.834 1.00 0.00 C ATOM 775 OE1 GLU A 50 15.974 -8.547 8.485 1.00 0.00 O ATOM 776 OE2 GLU A 50 14.406 -7.013 8.099 1.00 0.00 O ATOM 0 H GLU A 50 10.895 -10.693 5.615 1.00 0.00 H new ATOM 0 HA GLU A 50 13.759 -11.121 6.199 1.00 0.00 H new ATOM 0 HB2 GLU A 50 12.533 -8.590 5.916 1.00 0.00 H new ATOM 0 HB3 GLU A 50 12.674 -8.854 7.643 1.00 0.00 H new ATOM 0 HG2 GLU A 50 15.129 -9.775 6.520 1.00 0.00 H new ATOM 0 HG3 GLU A 50 14.771 -8.268 5.701 1.00 0.00 H new ATOM 784 N GLY A 51 11.848 -12.548 7.611 1.00 0.00 N ATOM 785 CA GLY A 51 11.331 -13.290 8.748 1.00 0.00 C ATOM 786 C GLY A 51 10.005 -12.699 9.231 1.00 0.00 C ATOM 787 O GLY A 51 9.984 -11.883 10.151 1.00 0.00 O ATOM 0 H GLY A 51 11.832 -13.056 6.727 1.00 0.00 H new ATOM 0 HA2 GLY A 51 11.188 -14.334 8.471 1.00 0.00 H new ATOM 0 HA3 GLY A 51 12.058 -13.272 9.560 1.00 0.00 H new ATOM 791 N LYS A 52 8.931 -13.135 8.590 1.00 0.00 N ATOM 792 CA LYS A 52 7.604 -12.659 8.943 1.00 0.00 C ATOM 793 C LYS A 52 7.336 -11.332 8.229 1.00 0.00 C ATOM 794 O LYS A 52 6.286 -11.156 7.613 1.00 0.00 O ATOM 795 CB LYS A 52 7.449 -12.582 10.463 1.00 0.00 C ATOM 796 CG LYS A 52 6.180 -13.301 10.922 1.00 0.00 C ATOM 797 CD LYS A 52 6.322 -13.799 12.362 1.00 0.00 C ATOM 798 CE LYS A 52 6.482 -15.320 12.403 1.00 0.00 C ATOM 799 NZ LYS A 52 5.168 -15.983 12.243 1.00 0.00 N ATOM 0 H LYS A 52 8.952 -13.813 7.828 1.00 0.00 H new ATOM 0 HA LYS A 52 6.844 -13.363 8.604 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.319 -13.030 10.944 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.413 -11.539 10.776 1.00 0.00 H new ATOM 0 HG2 LYS A 52 5.328 -12.625 10.850 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.975 -14.143 10.261 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.185 -13.326 12.831 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.445 -13.506 12.940 1.00 0.00 H new ATOM 0 HE2 LYS A 52 7.158 -15.642 11.611 1.00 0.00 H new ATOM 0 HE3 LYS A 52 6.934 -15.619 13.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.294 -17.015 12.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 4.535 -15.689 13.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 4.751 -15.712 11.330 1.00 0.00 H new ATOM 813 N SER A 53 8.303 -10.433 8.336 1.00 0.00 N ATOM 814 CA SER A 53 8.185 -9.128 7.709 1.00 0.00 C ATOM 815 C SER A 53 8.709 -9.188 6.273 1.00 0.00 C ATOM 816 O SER A 53 9.478 -10.083 5.926 1.00 0.00 O ATOM 817 CB SER A 53 8.942 -8.063 8.506 1.00 0.00 C ATOM 818 OG SER A 53 9.707 -8.632 9.565 1.00 0.00 O ATOM 0 H SER A 53 9.172 -10.583 8.848 1.00 0.00 H new ATOM 0 HA SER A 53 7.131 -8.851 7.693 1.00 0.00 H new ATOM 0 HB2 SER A 53 9.603 -7.511 7.837 1.00 0.00 H new ATOM 0 HB3 SER A 53 8.232 -7.345 8.917 1.00 0.00 H new ATOM 0 HG SER A 53 10.176 -7.920 10.049 1.00 0.00 H new ATOM 824 N VAL A 54 8.271 -8.224 5.476 1.00 0.00 N ATOM 825 CA VAL A 54 8.687 -8.156 4.085 1.00 0.00 C ATOM 826 C VAL A 54 9.086 -6.719 3.746 1.00 0.00 C ATOM 827 O VAL A 54 8.255 -5.813 3.791 1.00 0.00 O ATOM 828 CB VAL A 54 7.578 -8.698 3.181 1.00 0.00 C ATOM 829 CG1 VAL A 54 7.255 -10.154 3.522 1.00 0.00 C ATOM 830 CG2 VAL A 54 6.325 -7.824 3.266 1.00 0.00 C ATOM 0 H VAL A 54 7.632 -7.484 5.767 1.00 0.00 H new ATOM 0 HA VAL A 54 9.562 -8.784 3.916 1.00 0.00 H new ATOM 0 HB VAL A 54 7.939 -8.667 2.153 1.00 0.00 H new ATOM 0 HG11 VAL A 54 6.464 -10.515 2.865 1.00 0.00 H new ATOM 0 HG12 VAL A 54 8.147 -10.766 3.386 1.00 0.00 H new ATOM 0 HG13 VAL A 54 6.924 -10.220 4.558 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.552 -8.231 2.614 1.00 0.00 H new ATOM 0 HG22 VAL A 54 5.961 -7.808 4.293 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.567 -6.809 2.951 1.00 0.00 H new ATOM 840 N LYS A 55 10.358 -6.554 3.415 1.00 0.00 N ATOM 841 CA LYS A 55 10.877 -5.242 3.069 1.00 0.00 C ATOM 842 C LYS A 55 10.326 -4.824 1.704 1.00 0.00 C ATOM 843 O LYS A 55 10.094 -5.668 0.840 1.00 0.00 O ATOM 844 CB LYS A 55 12.406 -5.234 3.144 1.00 0.00 C ATOM 845 CG LYS A 55 12.902 -4.156 4.109 1.00 0.00 C ATOM 846 CD LYS A 55 13.641 -4.779 5.295 1.00 0.00 C ATOM 847 CE LYS A 55 14.754 -3.856 5.794 1.00 0.00 C ATOM 848 NZ LYS A 55 14.297 -3.084 6.972 1.00 0.00 N ATOM 0 H LYS A 55 11.045 -7.307 3.379 1.00 0.00 H new ATOM 0 HA LYS A 55 10.541 -4.497 3.790 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.763 -6.211 3.470 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.821 -5.058 2.152 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.565 -3.469 3.583 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.057 -3.569 4.470 1.00 0.00 H new ATOM 0 HD2 LYS A 55 12.937 -4.976 6.104 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.065 -5.739 5.000 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.633 -4.445 6.056 1.00 0.00 H new ATOM 0 HE3 LYS A 55 15.053 -3.174 4.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 15.064 -2.462 7.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 13.472 -2.508 6.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 14.034 -3.739 7.736 1.00 0.00 H new ATOM 862 N VAL A 56 10.132 -3.522 1.554 1.00 0.00 N ATOM 863 CA VAL A 56 9.612 -2.982 0.309 1.00 0.00 C ATOM 864 C VAL A 56 10.384 -1.712 -0.052 1.00 0.00 C ATOM 865 O VAL A 56 10.534 -0.815 0.776 1.00 0.00 O ATOM 866 CB VAL A 56 8.104 -2.752 0.427 1.00 0.00 C ATOM 867 CG1 VAL A 56 7.568 -1.993 -0.788 1.00 0.00 C ATOM 868 CG2 VAL A 56 7.361 -4.076 0.619 1.00 0.00 C ATOM 0 H VAL A 56 10.325 -2.825 2.274 1.00 0.00 H new ATOM 0 HA VAL A 56 9.756 -3.693 -0.505 1.00 0.00 H new ATOM 0 HB VAL A 56 7.927 -2.138 1.310 1.00 0.00 H new ATOM 0 HG11 VAL A 56 6.494 -1.843 -0.678 1.00 0.00 H new ATOM 0 HG12 VAL A 56 8.064 -1.025 -0.860 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.763 -2.569 -1.692 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.291 -3.884 0.700 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.549 -4.726 -0.235 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.713 -4.562 1.529 1.00 0.00 H new ATOM 878 N SER A 57 10.854 -1.675 -1.291 1.00 0.00 N ATOM 879 CA SER A 57 11.607 -0.529 -1.772 1.00 0.00 C ATOM 880 C SER A 57 10.976 0.009 -3.058 1.00 0.00 C ATOM 881 O SER A 57 10.907 -0.697 -4.062 1.00 0.00 O ATOM 882 CB SER A 57 13.073 -0.894 -2.013 1.00 0.00 C ATOM 883 OG SER A 57 13.207 -2.103 -2.754 1.00 0.00 O ATOM 0 H SER A 57 10.728 -2.420 -1.976 1.00 0.00 H new ATOM 0 HA SER A 57 11.575 0.246 -1.007 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.565 -0.083 -2.550 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.583 -0.997 -1.055 1.00 0.00 H new ATOM 0 HG SER A 57 12.517 -2.139 -3.449 1.00 0.00 H new ATOM 889 N ARG A 58 10.531 1.255 -2.985 1.00 0.00 N ATOM 890 CA ARG A 58 9.908 1.896 -4.131 1.00 0.00 C ATOM 891 C ARG A 58 10.748 3.089 -4.593 1.00 0.00 C ATOM 892 O ARG A 58 11.237 3.864 -3.772 1.00 0.00 O ATOM 893 CB ARG A 58 8.495 2.376 -3.793 1.00 0.00 C ATOM 894 CG ARG A 58 7.474 1.815 -4.785 1.00 0.00 C ATOM 895 CD ARG A 58 6.124 2.520 -4.639 1.00 0.00 C ATOM 896 NE ARG A 58 5.617 2.921 -5.971 1.00 0.00 N ATOM 897 CZ ARG A 58 5.113 2.067 -6.871 1.00 0.00 C ATOM 898 NH1 ARG A 58 5.045 0.759 -6.589 1.00 0.00 N ATOM 899 NH2 ARG A 58 4.676 2.521 -8.054 1.00 0.00 N ATOM 0 H ARG A 58 10.589 1.838 -2.150 1.00 0.00 H new ATOM 0 HA ARG A 58 9.847 1.158 -4.931 1.00 0.00 H new ATOM 0 HB2 ARG A 58 8.234 2.065 -2.782 1.00 0.00 H new ATOM 0 HB3 ARG A 58 8.463 3.465 -3.810 1.00 0.00 H new ATOM 0 HG2 ARG A 58 7.845 1.938 -5.803 1.00 0.00 H new ATOM 0 HG3 ARG A 58 7.350 0.745 -4.618 1.00 0.00 H new ATOM 0 HD2 ARG A 58 5.409 1.857 -4.153 1.00 0.00 H new ATOM 0 HD3 ARG A 58 6.230 3.398 -4.001 1.00 0.00 H new ATOM 0 HE ARG A 58 5.654 3.910 -6.219 1.00 0.00 H new ATOM 0 HH11 ARG A 58 5.377 0.413 -5.689 1.00 0.00 H new ATOM 0 HH12 ARG A 58 4.661 0.109 -7.275 1.00 0.00 H new ATOM 0 HH21 ARG A 58 4.727 3.517 -8.269 1.00 0.00 H new ATOM 0 HH22 ARG A 58 4.292 1.871 -8.740 1.00 0.00 H new ATOM 913 N TYR A 59 10.889 3.199 -5.906 1.00 0.00 N ATOM 914 CA TYR A 59 11.660 4.285 -6.487 1.00 0.00 C ATOM 915 C TYR A 59 11.170 4.611 -7.899 1.00 0.00 C ATOM 916 O TYR A 59 11.190 3.754 -8.781 1.00 0.00 O ATOM 917 CB TYR A 59 13.103 3.782 -6.564 1.00 0.00 C ATOM 918 CG TYR A 59 14.155 4.881 -6.401 1.00 0.00 C ATOM 919 CD1 TYR A 59 13.909 6.149 -6.889 1.00 0.00 C ATOM 920 CD2 TYR A 59 15.348 4.605 -5.765 1.00 0.00 C ATOM 921 CE1 TYR A 59 14.899 7.183 -6.735 1.00 0.00 C ATOM 922 CE2 TYR A 59 16.338 5.640 -5.612 1.00 0.00 C ATOM 923 CZ TYR A 59 16.065 6.878 -6.104 1.00 0.00 C ATOM 924 OH TYR A 59 16.999 7.855 -5.959 1.00 0.00 O ATOM 0 H TYR A 59 10.482 2.554 -6.584 1.00 0.00 H new ATOM 0 HA TYR A 59 11.563 5.189 -5.886 1.00 0.00 H new ATOM 0 HB2 TYR A 59 13.256 3.029 -5.791 1.00 0.00 H new ATOM 0 HB3 TYR A 59 13.254 3.288 -7.524 1.00 0.00 H new ATOM 0 HD1 TYR A 59 12.975 6.365 -7.386 1.00 0.00 H new ATOM 0 HD2 TYR A 59 15.539 3.613 -5.382 1.00 0.00 H new ATOM 0 HE1 TYR A 59 14.720 8.179 -7.112 1.00 0.00 H new ATOM 0 HE2 TYR A 59 17.276 5.437 -5.117 1.00 0.00 H new ATOM 0 HH TYR A 59 17.780 7.494 -5.489 1.00 0.00 H new ATOM 934 N ASP A 60 10.741 5.853 -8.069 1.00 0.00 N ATOM 935 CA ASP A 60 10.246 6.303 -9.359 1.00 0.00 C ATOM 936 C ASP A 60 10.202 7.832 -9.378 1.00 0.00 C ATOM 937 O ASP A 60 10.642 8.481 -8.430 1.00 0.00 O ATOM 938 CB ASP A 60 8.829 5.787 -9.617 1.00 0.00 C ATOM 939 CG ASP A 60 8.119 5.208 -8.391 1.00 0.00 C ATOM 940 OD1 ASP A 60 8.321 4.001 -8.136 1.00 0.00 O ATOM 941 OD2 ASP A 60 7.391 5.985 -7.737 1.00 0.00 O ATOM 0 H ASP A 60 10.726 6.561 -7.335 1.00 0.00 H new ATOM 0 HA ASP A 60 10.915 5.919 -10.129 1.00 0.00 H new ATOM 0 HB2 ASP A 60 8.227 6.605 -10.014 1.00 0.00 H new ATOM 0 HB3 ASP A 60 8.873 5.019 -10.389 1.00 0.00 H new ATOM 947 N VAL A 61 9.669 8.364 -10.468 1.00 0.00 N ATOM 948 CA VAL A 61 9.562 9.805 -10.623 1.00 0.00 C ATOM 949 C VAL A 61 8.098 10.223 -10.471 1.00 0.00 C ATOM 950 O VAL A 61 7.299 10.043 -11.388 1.00 0.00 O ATOM 951 CB VAL A 61 10.170 10.233 -11.960 1.00 0.00 C ATOM 952 CG1 VAL A 61 11.693 10.343 -11.860 1.00 0.00 C ATOM 953 CG2 VAL A 61 9.762 9.275 -13.081 1.00 0.00 C ATOM 0 H VAL A 61 9.306 7.823 -11.253 1.00 0.00 H new ATOM 0 HA VAL A 61 10.128 10.316 -9.844 1.00 0.00 H new ATOM 0 HB VAL A 61 9.778 11.220 -12.205 1.00 0.00 H new ATOM 0 HG11 VAL A 61 12.100 10.649 -12.824 1.00 0.00 H new ATOM 0 HG12 VAL A 61 11.955 11.083 -11.104 1.00 0.00 H new ATOM 0 HG13 VAL A 61 12.110 9.376 -11.581 1.00 0.00 H new ATOM 0 HG21 VAL A 61 10.208 9.603 -14.020 1.00 0.00 H new ATOM 0 HG22 VAL A 61 10.111 8.270 -12.845 1.00 0.00 H new ATOM 0 HG23 VAL A 61 8.676 9.269 -13.177 1.00 0.00 H new ATOM 963 N ILE A 62 7.791 10.772 -9.305 1.00 0.00 N ATOM 964 CA ILE A 62 6.438 11.217 -9.021 1.00 0.00 C ATOM 965 C ILE A 62 6.261 12.652 -9.522 1.00 0.00 C ATOM 966 O ILE A 62 7.076 13.523 -9.223 1.00 0.00 O ATOM 967 CB ILE A 62 6.117 11.041 -7.535 1.00 0.00 C ATOM 968 CG1 ILE A 62 6.033 9.559 -7.164 1.00 0.00 C ATOM 969 CG2 ILE A 62 4.844 11.800 -7.155 1.00 0.00 C ATOM 970 CD1 ILE A 62 6.189 9.362 -5.655 1.00 0.00 C ATOM 0 H ILE A 62 8.456 10.919 -8.546 1.00 0.00 H new ATOM 0 HA ILE A 62 5.715 10.601 -9.555 1.00 0.00 H new ATOM 0 HB ILE A 62 6.934 11.472 -6.956 1.00 0.00 H new ATOM 0 HG12 ILE A 62 5.076 9.152 -7.490 1.00 0.00 H new ATOM 0 HG13 ILE A 62 6.811 9.004 -7.689 1.00 0.00 H new ATOM 0 HG21 ILE A 62 4.639 11.658 -6.094 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.979 12.862 -7.360 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.006 11.421 -7.740 1.00 0.00 H new ATOM 0 HD11 ILE A 62 6.125 8.300 -5.418 1.00 0.00 H new ATOM 0 HD12 ILE A 62 7.157 9.748 -5.336 1.00 0.00 H new ATOM 0 HD13 ILE A 62 5.396 9.898 -5.134 1.00 0.00 H new ATOM 982 N HIS A 63 5.191 12.853 -10.277 1.00 0.00 N ATOM 983 CA HIS A 63 4.897 14.167 -10.823 1.00 0.00 C ATOM 984 C HIS A 63 6.196 14.838 -11.273 1.00 0.00 C ATOM 985 O HIS A 63 6.650 15.799 -10.653 1.00 0.00 O ATOM 986 CB HIS A 63 4.112 15.011 -9.816 1.00 0.00 C ATOM 987 CG HIS A 63 2.613 14.911 -9.967 1.00 0.00 C ATOM 988 ND1 HIS A 63 1.761 15.971 -9.712 1.00 0.00 N ATOM 989 CD2 HIS A 63 1.824 13.866 -10.351 1.00 0.00 C ATOM 990 CE1 HIS A 63 0.517 15.571 -9.934 1.00 0.00 C ATOM 991 NE2 HIS A 63 0.558 14.267 -10.329 1.00 0.00 N ATOM 0 H HIS A 63 4.517 12.128 -10.523 1.00 0.00 H new ATOM 0 HA HIS A 63 4.258 14.065 -11.700 1.00 0.00 H new ATOM 0 HB2 HIS A 63 4.387 14.703 -8.807 1.00 0.00 H new ATOM 0 HB3 HIS A 63 4.409 16.054 -9.923 1.00 0.00 H new ATOM 0 HD2 HIS A 63 2.170 12.881 -10.626 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -0.373 16.173 -9.822 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -0.251 13.693 -10.568 1.00 0.00 H new ATOM 999 N GLY A 64 6.757 14.306 -12.349 1.00 0.00 N ATOM 1000 CA GLY A 64 7.995 14.842 -12.890 1.00 0.00 C ATOM 1001 C GLY A 64 8.951 15.251 -11.768 1.00 0.00 C ATOM 1002 O GLY A 64 9.351 16.411 -11.681 1.00 0.00 O ATOM 0 H GLY A 64 6.377 13.510 -12.861 1.00 0.00 H new ATOM 0 HA2 GLY A 64 8.472 14.095 -13.525 1.00 0.00 H new ATOM 0 HA3 GLY A 64 7.778 15.705 -13.520 1.00 0.00 H new ATOM 1006 N LYS A 65 9.291 14.276 -10.938 1.00 0.00 N ATOM 1007 CA LYS A 65 10.193 14.520 -9.825 1.00 0.00 C ATOM 1008 C LYS A 65 10.695 13.183 -9.278 1.00 0.00 C ATOM 1009 O LYS A 65 9.899 12.300 -8.961 1.00 0.00 O ATOM 1010 CB LYS A 65 9.518 15.402 -8.772 1.00 0.00 C ATOM 1011 CG LYS A 65 10.546 15.966 -7.790 1.00 0.00 C ATOM 1012 CD LYS A 65 9.858 16.710 -6.643 1.00 0.00 C ATOM 1013 CE LYS A 65 9.404 15.738 -5.553 1.00 0.00 C ATOM 1014 NZ LYS A 65 9.320 16.427 -4.246 1.00 0.00 N ATOM 0 H LYS A 65 8.958 13.315 -11.014 1.00 0.00 H new ATOM 0 HA LYS A 65 11.069 15.076 -10.159 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.990 16.220 -9.262 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.772 14.821 -8.230 1.00 0.00 H new ATOM 0 HG2 LYS A 65 11.154 15.155 -7.389 1.00 0.00 H new ATOM 0 HG3 LYS A 65 11.221 16.642 -8.314 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.543 17.444 -6.218 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.998 17.260 -7.026 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.432 15.319 -5.813 1.00 0.00 H new ATOM 0 HE3 LYS A 65 10.103 14.904 -5.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.010 15.753 -3.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.255 16.806 -3.992 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.636 17.208 -4.308 1.00 0.00 H new ATOM 1028 N GLU A 66 12.012 13.075 -9.183 1.00 0.00 N ATOM 1029 CA GLU A 66 12.629 11.860 -8.680 1.00 0.00 C ATOM 1030 C GLU A 66 12.188 11.599 -7.238 1.00 0.00 C ATOM 1031 O GLU A 66 12.539 12.353 -6.332 1.00 0.00 O ATOM 1032 CB GLU A 66 14.154 11.936 -8.782 1.00 0.00 C ATOM 1033 CG GLU A 66 14.606 11.935 -10.243 1.00 0.00 C ATOM 1034 CD GLU A 66 15.674 10.867 -10.486 1.00 0.00 C ATOM 1035 OE1 GLU A 66 15.313 9.831 -11.085 1.00 0.00 O ATOM 1036 OE2 GLU A 66 16.826 11.110 -10.067 1.00 0.00 O ATOM 0 H GLU A 66 12.669 13.810 -9.446 1.00 0.00 H new ATOM 0 HA GLU A 66 12.298 11.025 -9.298 1.00 0.00 H new ATOM 0 HB2 GLU A 66 14.511 12.840 -8.288 1.00 0.00 H new ATOM 0 HB3 GLU A 66 14.600 11.090 -8.259 1.00 0.00 H new ATOM 0 HG2 GLU A 66 13.750 11.752 -10.892 1.00 0.00 H new ATOM 0 HG3 GLU A 66 15.001 12.916 -10.506 1.00 0.00 H new ATOM 1044 N TYR A 67 11.427 10.528 -7.070 1.00 0.00 N ATOM 1045 CA TYR A 67 10.935 10.158 -5.754 1.00 0.00 C ATOM 1046 C TYR A 67 11.399 8.751 -5.371 1.00 0.00 C ATOM 1047 O TYR A 67 11.757 7.954 -6.236 1.00 0.00 O ATOM 1048 CB TYR A 67 9.408 10.169 -5.856 1.00 0.00 C ATOM 1049 CG TYR A 67 8.707 10.770 -4.637 1.00 0.00 C ATOM 1050 CD1 TYR A 67 8.356 9.963 -3.574 1.00 0.00 C ATOM 1051 CD2 TYR A 67 8.426 12.121 -4.599 1.00 0.00 C ATOM 1052 CE1 TYR A 67 7.697 10.529 -2.426 1.00 0.00 C ATOM 1053 CE2 TYR A 67 7.766 12.687 -3.451 1.00 0.00 C ATOM 1054 CZ TYR A 67 7.434 11.863 -2.421 1.00 0.00 C ATOM 1055 OH TYR A 67 6.811 12.398 -1.337 1.00 0.00 O ATOM 0 H TYR A 67 11.139 9.904 -7.824 1.00 0.00 H new ATOM 0 HA TYR A 67 11.308 10.848 -4.997 1.00 0.00 H new ATOM 0 HB2 TYR A 67 9.118 10.732 -6.743 1.00 0.00 H new ATOM 0 HB3 TYR A 67 9.056 9.147 -5.997 1.00 0.00 H new ATOM 0 HD1 TYR A 67 8.576 8.906 -3.603 1.00 0.00 H new ATOM 0 HD2 TYR A 67 8.701 12.753 -5.430 1.00 0.00 H new ATOM 0 HE1 TYR A 67 7.418 9.908 -1.588 1.00 0.00 H new ATOM 0 HE2 TYR A 67 7.540 13.742 -3.409 1.00 0.00 H new ATOM 0 HH TYR A 67 6.689 13.361 -1.472 1.00 0.00 H new ATOM 1065 N PHE A 68 11.376 8.489 -4.072 1.00 0.00 N ATOM 1066 CA PHE A 68 11.790 7.192 -3.563 1.00 0.00 C ATOM 1067 C PHE A 68 11.340 7.003 -2.113 1.00 0.00 C ATOM 1068 O PHE A 68 11.471 7.913 -1.295 1.00 0.00 O ATOM 1069 CB PHE A 68 13.318 7.156 -3.620 1.00 0.00 C ATOM 1070 CG PHE A 68 13.954 6.168 -2.640 1.00 0.00 C ATOM 1071 CD1 PHE A 68 14.052 4.852 -2.968 1.00 0.00 C ATOM 1072 CD2 PHE A 68 14.421 6.606 -1.440 1.00 0.00 C ATOM 1073 CE1 PHE A 68 14.643 3.936 -2.058 1.00 0.00 C ATOM 1074 CE2 PHE A 68 15.011 5.690 -0.530 1.00 0.00 C ATOM 1075 CZ PHE A 68 15.110 4.374 -0.859 1.00 0.00 C ATOM 0 H PHE A 68 11.077 9.152 -3.357 1.00 0.00 H new ATOM 0 HA PHE A 68 11.342 6.398 -4.160 1.00 0.00 H new ATOM 0 HB2 PHE A 68 13.628 6.898 -4.633 1.00 0.00 H new ATOM 0 HB3 PHE A 68 13.703 8.155 -3.414 1.00 0.00 H new ATOM 0 HD1 PHE A 68 13.680 4.504 -3.920 1.00 0.00 H new ATOM 0 HD2 PHE A 68 14.343 7.651 -1.179 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.721 2.891 -2.319 1.00 0.00 H new ATOM 0 HE2 PHE A 68 15.381 6.038 0.423 1.00 0.00 H new ATOM 0 HZ PHE A 68 15.560 3.677 -0.167 1.00 0.00 H new ATOM 1085 N MET A 69 10.820 5.816 -1.838 1.00 0.00 N ATOM 1086 CA MET A 69 10.350 5.496 -0.501 1.00 0.00 C ATOM 1087 C MET A 69 10.480 3.998 -0.218 1.00 0.00 C ATOM 1088 O MET A 69 10.404 3.181 -1.134 1.00 0.00 O ATOM 1089 CB MET A 69 8.886 5.918 -0.359 1.00 0.00 C ATOM 1090 CG MET A 69 8.045 5.375 -1.516 1.00 0.00 C ATOM 1091 SD MET A 69 7.416 6.725 -2.500 1.00 0.00 S ATOM 1092 CE MET A 69 8.348 6.474 -4.002 1.00 0.00 C ATOM 0 H MET A 69 10.714 5.064 -2.519 1.00 0.00 H new ATOM 0 HA MET A 69 10.964 6.037 0.219 1.00 0.00 H new ATOM 0 HB2 MET A 69 8.488 5.552 0.588 1.00 0.00 H new ATOM 0 HB3 MET A 69 8.818 7.006 -0.334 1.00 0.00 H new ATOM 0 HG2 MET A 69 8.649 4.713 -2.136 1.00 0.00 H new ATOM 0 HG3 MET A 69 7.218 4.781 -1.128 1.00 0.00 H new ATOM 0 HE1 MET A 69 8.897 7.384 -4.246 1.00 0.00 H new ATOM 0 HE2 MET A 69 9.051 5.653 -3.861 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.666 6.232 -4.817 1.00 0.00 H new ATOM 1102 N GLU A 70 10.672 3.683 1.054 1.00 0.00 N ATOM 1103 CA GLU A 70 10.813 2.298 1.469 1.00 0.00 C ATOM 1104 C GLU A 70 10.088 2.065 2.796 1.00 0.00 C ATOM 1105 O GLU A 70 9.756 3.017 3.502 1.00 0.00 O ATOM 1106 CB GLU A 70 12.288 1.904 1.574 1.00 0.00 C ATOM 1107 CG GLU A 70 13.006 2.106 0.238 1.00 0.00 C ATOM 1108 CD GLU A 70 14.144 1.097 0.069 1.00 0.00 C ATOM 1109 OE1 GLU A 70 15.025 1.372 -0.773 1.00 0.00 O ATOM 1110 OE2 GLU A 70 14.106 0.074 0.786 1.00 0.00 O ATOM 0 H GLU A 70 10.733 4.363 1.811 1.00 0.00 H new ATOM 0 HA GLU A 70 10.355 1.664 0.710 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.774 2.501 2.346 1.00 0.00 H new ATOM 0 HB3 GLU A 70 12.369 0.861 1.880 1.00 0.00 H new ATOM 0 HG2 GLU A 70 12.295 1.998 -0.581 1.00 0.00 H new ATOM 0 HG3 GLU A 70 13.403 3.120 0.184 1.00 0.00 H new ATOM 1118 N GLY A 71 9.862 0.794 3.096 1.00 0.00 N ATOM 1119 CA GLY A 71 9.182 0.424 4.325 1.00 0.00 C ATOM 1120 C GLY A 71 8.792 -1.055 4.312 1.00 0.00 C ATOM 1121 O GLY A 71 8.175 -1.530 3.360 1.00 0.00 O ATOM 0 H GLY A 71 10.138 0.007 2.508 1.00 0.00 H new ATOM 0 HA2 GLY A 71 9.830 0.625 5.178 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.290 1.038 4.450 1.00 0.00 H new ATOM 1125 N THR A 72 9.167 -1.742 5.381 1.00 0.00 N ATOM 1126 CA THR A 72 8.864 -3.158 5.505 1.00 0.00 C ATOM 1127 C THR A 72 7.428 -3.355 5.992 1.00 0.00 C ATOM 1128 O THR A 72 6.811 -2.426 6.512 1.00 0.00 O ATOM 1129 CB THR A 72 9.911 -3.787 6.427 1.00 0.00 C ATOM 1130 OG1 THR A 72 9.627 -5.182 6.373 1.00 0.00 O ATOM 1131 CG2 THR A 72 9.693 -3.419 7.896 1.00 0.00 C ATOM 0 H THR A 72 9.678 -1.345 6.169 1.00 0.00 H new ATOM 0 HA THR A 72 8.918 -3.660 4.539 1.00 0.00 H new ATOM 0 HB THR A 72 10.906 -3.469 6.117 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.350 -5.680 6.808 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.462 -3.891 8.507 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.750 -2.337 8.012 1.00 0.00 H new ATOM 0 HG23 THR A 72 8.711 -3.767 8.216 1.00 0.00 H new ATOM 1139 N ALA A 73 6.935 -4.571 5.807 1.00 0.00 N ATOM 1140 CA ALA A 73 5.583 -4.903 6.221 1.00 0.00 C ATOM 1141 C ALA A 73 5.637 -5.949 7.336 1.00 0.00 C ATOM 1142 O ALA A 73 6.033 -7.090 7.103 1.00 0.00 O ATOM 1143 CB ALA A 73 4.781 -5.382 5.010 1.00 0.00 C ATOM 0 H ALA A 73 7.449 -5.339 5.375 1.00 0.00 H new ATOM 0 HA ALA A 73 5.077 -4.023 6.619 1.00 0.00 H new ATOM 0 HB1 ALA A 73 3.766 -5.631 5.321 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.747 -4.591 4.260 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.257 -6.265 4.584 1.00 0.00 H new ATOM 1149 N TYR A 74 5.234 -5.523 8.524 1.00 0.00 N ATOM 1150 CA TYR A 74 5.232 -6.409 9.676 1.00 0.00 C ATOM 1151 C TYR A 74 3.857 -6.432 10.347 1.00 0.00 C ATOM 1152 O TYR A 74 3.132 -5.439 10.319 1.00 0.00 O ATOM 1153 CB TYR A 74 6.255 -5.830 10.655 1.00 0.00 C ATOM 1154 CG TYR A 74 6.346 -6.588 11.981 1.00 0.00 C ATOM 1155 CD1 TYR A 74 5.472 -6.291 13.007 1.00 0.00 C ATOM 1156 CD2 TYR A 74 7.301 -7.570 12.150 1.00 0.00 C ATOM 1157 CE1 TYR A 74 5.558 -7.004 14.255 1.00 0.00 C ATOM 1158 CE2 TYR A 74 7.386 -8.284 13.398 1.00 0.00 C ATOM 1159 CZ TYR A 74 6.510 -7.966 14.389 1.00 0.00 C ATOM 1160 OH TYR A 74 6.591 -8.640 15.567 1.00 0.00 O ATOM 0 H TYR A 74 4.907 -4.576 8.714 1.00 0.00 H new ATOM 0 HA TYR A 74 5.472 -7.429 9.376 1.00 0.00 H new ATOM 0 HB2 TYR A 74 7.236 -5.829 10.181 1.00 0.00 H new ATOM 0 HB3 TYR A 74 5.999 -4.790 10.859 1.00 0.00 H new ATOM 0 HD1 TYR A 74 4.724 -5.524 12.874 1.00 0.00 H new ATOM 0 HD2 TYR A 74 7.984 -7.803 11.347 1.00 0.00 H new ATOM 0 HE1 TYR A 74 4.882 -6.780 15.067 1.00 0.00 H new ATOM 0 HE2 TYR A 74 8.129 -9.055 13.544 1.00 0.00 H new ATOM 0 HH TYR A 74 7.316 -9.298 15.518 1.00 0.00 H new ATOM 1170 N PRO A 75 3.532 -7.606 10.951 1.00 0.00 N ATOM 1171 CA PRO A 75 2.258 -7.772 11.629 1.00 0.00 C ATOM 1172 C PRO A 75 2.252 -7.039 12.972 1.00 0.00 C ATOM 1173 O PRO A 75 3.076 -7.321 13.841 1.00 0.00 O ATOM 1174 CB PRO A 75 2.080 -9.274 11.771 1.00 0.00 C ATOM 1175 CG PRO A 75 3.464 -9.877 11.590 1.00 0.00 C ATOM 1176 CD PRO A 75 4.367 -8.803 11.005 1.00 0.00 C ATOM 0 HA PRO A 75 1.427 -7.337 11.074 1.00 0.00 H new ATOM 0 HB2 PRO A 75 1.668 -9.528 12.748 1.00 0.00 H new ATOM 0 HB3 PRO A 75 1.386 -9.657 11.023 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.856 -10.227 12.545 1.00 0.00 H new ATOM 0 HG3 PRO A 75 3.420 -10.741 10.928 1.00 0.00 H new ATOM 0 HD2 PRO A 75 5.248 -8.644 11.627 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.724 -9.082 10.014 1.00 0.00 H new ATOM 1184 N VAL A 76 1.313 -6.113 13.101 1.00 0.00 N ATOM 1185 CA VAL A 76 1.189 -5.337 14.323 1.00 0.00 C ATOM 1186 C VAL A 76 0.853 -6.275 15.485 1.00 0.00 C ATOM 1187 O VAL A 76 1.511 -6.243 16.523 1.00 0.00 O ATOM 1188 CB VAL A 76 0.156 -4.225 14.135 1.00 0.00 C ATOM 1189 CG1 VAL A 76 -0.809 -4.167 15.321 1.00 0.00 C ATOM 1190 CG2 VAL A 76 0.840 -2.873 13.917 1.00 0.00 C ATOM 0 H VAL A 76 0.631 -5.883 12.379 1.00 0.00 H new ATOM 0 HA VAL A 76 2.133 -4.847 14.562 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.425 -4.454 13.242 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.533 -3.368 15.162 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.333 -5.119 15.411 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.250 -3.973 16.236 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.083 -2.099 13.786 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.457 -2.634 14.783 1.00 0.00 H new ATOM 0 HG23 VAL A 76 1.467 -2.922 13.027 1.00 0.00 H new ATOM 1200 N GLY A 77 -0.171 -7.088 15.270 1.00 0.00 N ATOM 1201 CA GLY A 77 -0.603 -8.033 16.285 1.00 0.00 C ATOM 1202 C GLY A 77 -0.421 -9.474 15.806 1.00 0.00 C ATOM 1203 O GLY A 77 0.662 -9.854 15.365 1.00 0.00 O ATOM 0 H GLY A 77 -0.714 -7.111 14.407 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.032 -7.875 17.200 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -1.651 -7.857 16.529 1.00 0.00 H new ATOM 1207 N ASP A 78 -1.499 -10.238 15.908 1.00 0.00 N ATOM 1208 CA ASP A 78 -1.472 -11.630 15.490 1.00 0.00 C ATOM 1209 C ASP A 78 -0.781 -11.736 14.130 1.00 0.00 C ATOM 1210 O ASP A 78 -1.324 -11.297 13.117 1.00 0.00 O ATOM 1211 CB ASP A 78 -2.889 -12.188 15.346 1.00 0.00 C ATOM 1212 CG ASP A 78 -3.115 -13.555 15.996 1.00 0.00 C ATOM 1213 OD1 ASP A 78 -2.935 -14.562 15.279 1.00 0.00 O ATOM 1214 OD2 ASP A 78 -3.464 -13.560 17.197 1.00 0.00 O ATOM 0 H ASP A 78 -2.396 -9.920 16.274 1.00 0.00 H new ATOM 0 HA ASP A 78 -0.935 -12.200 16.248 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -3.590 -11.475 15.781 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.128 -12.263 14.285 1.00 0.00 H new ATOM 1220 N SER A 79 0.407 -12.322 14.150 1.00 0.00 N ATOM 1221 CA SER A 79 1.179 -12.491 12.930 1.00 0.00 C ATOM 1222 C SER A 79 0.255 -12.894 11.779 1.00 0.00 C ATOM 1223 O SER A 79 0.312 -12.307 10.699 1.00 0.00 O ATOM 1224 CB SER A 79 2.281 -13.535 13.117 1.00 0.00 C ATOM 1225 OG SER A 79 1.757 -14.801 13.509 1.00 0.00 O ATOM 0 H SER A 79 0.854 -12.686 14.992 1.00 0.00 H new ATOM 0 HA SER A 79 1.654 -11.540 12.690 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.837 -13.646 12.186 1.00 0.00 H new ATOM 0 HB3 SER A 79 2.987 -13.186 13.871 1.00 0.00 H new ATOM 0 HG SER A 79 2.492 -15.440 13.616 1.00 0.00 H new ATOM 1231 N LYS A 80 -0.573 -13.892 12.048 1.00 0.00 N ATOM 1232 CA LYS A 80 -1.507 -14.380 11.048 1.00 0.00 C ATOM 1233 C LYS A 80 -2.363 -13.216 10.545 1.00 0.00 C ATOM 1234 O LYS A 80 -2.182 -12.749 9.422 1.00 0.00 O ATOM 1235 CB LYS A 80 -2.324 -15.549 11.603 1.00 0.00 C ATOM 1236 CG LYS A 80 -1.654 -16.887 11.282 1.00 0.00 C ATOM 1237 CD LYS A 80 -2.332 -18.034 12.034 1.00 0.00 C ATOM 1238 CE LYS A 80 -1.749 -19.385 11.614 1.00 0.00 C ATOM 1239 NZ LYS A 80 -1.461 -20.217 12.804 1.00 0.00 N ATOM 0 H LYS A 80 -0.617 -14.376 12.945 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.970 -14.777 10.187 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -2.432 -15.442 12.682 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -3.328 -15.530 11.179 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -1.701 -17.073 10.209 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -0.599 -16.844 11.552 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.203 -17.896 13.108 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -3.404 -18.019 11.837 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.451 -19.904 10.961 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.835 -19.231 11.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.066 -21.130 12.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.774 -19.727 13.412 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.340 -20.379 13.335 1.00 0.00 H new ATOM 1253 N ILE A 81 -3.277 -12.782 11.401 1.00 0.00 N ATOM 1254 CA ILE A 81 -4.161 -11.682 11.057 1.00 0.00 C ATOM 1255 C ILE A 81 -3.368 -10.612 10.303 1.00 0.00 C ATOM 1256 O ILE A 81 -2.140 -10.583 10.369 1.00 0.00 O ATOM 1257 CB ILE A 81 -4.871 -11.155 12.305 1.00 0.00 C ATOM 1258 CG1 ILE A 81 -5.776 -12.228 12.915 1.00 0.00 C ATOM 1259 CG2 ILE A 81 -5.637 -9.867 11.998 1.00 0.00 C ATOM 1260 CD1 ILE A 81 -6.812 -12.714 11.900 1.00 0.00 C ATOM 0 H ILE A 81 -3.424 -13.173 12.332 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.951 -12.024 10.389 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.114 -10.910 13.050 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -5.171 -13.069 13.254 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -6.282 -11.826 13.792 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -6.132 -9.514 12.902 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.942 -9.106 11.644 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -6.383 -10.062 11.228 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.442 -13.476 12.359 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -7.431 -11.875 11.582 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.303 -13.138 11.035 1.00 0.00 H new ATOM 1272 N GLY A 82 -4.102 -9.759 9.605 1.00 0.00 N ATOM 1273 CA GLY A 82 -3.483 -8.690 8.840 1.00 0.00 C ATOM 1274 C GLY A 82 -2.725 -7.727 9.757 1.00 0.00 C ATOM 1275 O GLY A 82 -1.640 -8.048 10.238 1.00 0.00 O ATOM 0 H GLY A 82 -5.120 -9.786 9.553 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.798 -9.113 8.105 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.247 -8.145 8.286 1.00 0.00 H new ATOM 1279 N LYS A 83 -3.327 -6.567 9.970 1.00 0.00 N ATOM 1280 CA LYS A 83 -2.723 -5.555 10.820 1.00 0.00 C ATOM 1281 C LYS A 83 -1.224 -5.475 10.524 1.00 0.00 C ATOM 1282 O LYS A 83 -0.401 -5.606 11.429 1.00 0.00 O ATOM 1283 CB LYS A 83 -3.045 -5.829 12.290 1.00 0.00 C ATOM 1284 CG LYS A 83 -3.444 -4.541 13.013 1.00 0.00 C ATOM 1285 CD LYS A 83 -4.913 -4.584 13.441 1.00 0.00 C ATOM 1286 CE LYS A 83 -5.051 -5.097 14.876 1.00 0.00 C ATOM 1287 NZ LYS A 83 -6.106 -4.348 15.595 1.00 0.00 N ATOM 0 H LYS A 83 -4.227 -6.305 9.569 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.144 -4.574 10.602 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.855 -6.555 12.359 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.178 -6.271 12.780 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -2.810 -4.400 13.889 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.277 -3.686 12.358 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.347 -3.587 13.364 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -5.474 -5.229 12.765 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -5.293 -6.160 14.867 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -4.101 -4.991 15.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -6.187 -4.709 16.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -5.859 -3.338 15.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -7.015 -4.470 15.104 1.00 0.00 H new ATOM 1301 N ILE A 84 -0.915 -5.261 9.253 1.00 0.00 N ATOM 1302 CA ILE A 84 0.471 -5.163 8.827 1.00 0.00 C ATOM 1303 C ILE A 84 0.843 -3.689 8.655 1.00 0.00 C ATOM 1304 O ILE A 84 0.403 -3.039 7.708 1.00 0.00 O ATOM 1305 CB ILE A 84 0.706 -6.006 7.572 1.00 0.00 C ATOM 1306 CG1 ILE A 84 -0.354 -7.102 7.441 1.00 0.00 C ATOM 1307 CG2 ILE A 84 2.126 -6.577 7.554 1.00 0.00 C ATOM 1308 CD1 ILE A 84 -1.586 -6.586 6.696 1.00 0.00 C ATOM 0 H ILE A 84 -1.600 -5.153 8.505 1.00 0.00 H new ATOM 0 HA ILE A 84 1.134 -5.574 9.588 1.00 0.00 H new ATOM 0 HB ILE A 84 0.608 -5.358 6.701 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.065 -7.957 6.910 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.644 -7.453 8.431 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.267 -7.172 6.652 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.847 -5.760 7.566 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.276 -7.206 8.431 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.324 -7.384 6.616 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.017 -5.747 7.242 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.297 -6.259 5.697 1.00 0.00 H new ATOM 1320 N TYR A 85 1.651 -3.204 9.587 1.00 0.00 N ATOM 1321 CA TYR A 85 2.088 -1.818 9.551 1.00 0.00 C ATOM 1322 C TYR A 85 3.334 -1.659 8.676 1.00 0.00 C ATOM 1323 O TYR A 85 4.226 -2.506 8.700 1.00 0.00 O ATOM 1324 CB TYR A 85 2.442 -1.450 10.993 1.00 0.00 C ATOM 1325 CG TYR A 85 3.907 -1.699 11.358 1.00 0.00 C ATOM 1326 CD1 TYR A 85 4.877 -0.798 10.970 1.00 0.00 C ATOM 1327 CD2 TYR A 85 4.257 -2.825 12.075 1.00 0.00 C ATOM 1328 CE1 TYR A 85 6.256 -1.032 11.313 1.00 0.00 C ATOM 1329 CE2 TYR A 85 5.636 -3.059 12.418 1.00 0.00 C ATOM 1330 CZ TYR A 85 6.567 -2.151 12.020 1.00 0.00 C ATOM 1331 OH TYR A 85 7.869 -2.373 12.345 1.00 0.00 O ATOM 0 H TYR A 85 2.014 -3.746 10.371 1.00 0.00 H new ATOM 0 HA TYR A 85 1.308 -1.180 9.136 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.212 -0.397 11.155 1.00 0.00 H new ATOM 0 HB3 TYR A 85 1.807 -2.023 11.669 1.00 0.00 H new ATOM 0 HD1 TYR A 85 4.602 0.083 10.409 1.00 0.00 H new ATOM 0 HD2 TYR A 85 3.497 -3.530 12.379 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.025 -0.335 11.016 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.924 -3.936 12.979 1.00 0.00 H new ATOM 0 HH TYR A 85 7.942 -3.209 12.851 1.00 0.00 H new ATOM 1341 N HIS A 86 3.355 -0.567 7.926 1.00 0.00 N ATOM 1342 CA HIS A 86 4.476 -0.286 7.046 1.00 0.00 C ATOM 1343 C HIS A 86 5.341 0.821 7.654 1.00 0.00 C ATOM 1344 O HIS A 86 4.888 1.954 7.807 1.00 0.00 O ATOM 1345 CB HIS A 86 3.988 0.051 5.635 1.00 0.00 C ATOM 1346 CG HIS A 86 4.914 0.963 4.866 1.00 0.00 C ATOM 1347 ND1 HIS A 86 5.237 2.274 5.060 1.00 0.00 N flip ATOM 1348 CD2 HIS A 86 5.625 0.546 3.755 1.00 0.00 C flip ATOM 1349 CE1 HIS A 86 6.099 2.638 4.119 1.00 0.00 C flip ATOM 1350 NE2 HIS A 86 6.341 1.568 3.308 1.00 0.00 N flip ATOM 0 H HIS A 86 2.614 0.133 7.910 1.00 0.00 H new ATOM 0 HA HIS A 86 5.099 -1.175 6.950 1.00 0.00 H new ATOM 0 HB2 HIS A 86 3.860 -0.875 5.075 1.00 0.00 H new ATOM 0 HB3 HIS A 86 3.007 0.521 5.704 1.00 0.00 H new ATOM 0 HD1 HIS A 86 4.877 2.873 5.803 1.00 0.00 H new ATOM 0 HD2 HIS A 86 5.601 -0.444 3.325 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.537 3.620 4.013 1.00 0.00 H new ATOM 1358 N SER A 87 6.570 0.453 7.983 1.00 0.00 N ATOM 1359 CA SER A 87 7.502 1.400 8.571 1.00 0.00 C ATOM 1360 C SER A 87 8.124 2.270 7.477 1.00 0.00 C ATOM 1361 O SER A 87 8.992 1.815 6.735 1.00 0.00 O ATOM 1362 CB SER A 87 8.597 0.678 9.360 1.00 0.00 C ATOM 1363 OG SER A 87 8.694 1.157 10.699 1.00 0.00 O ATOM 0 H SER A 87 6.942 -0.488 7.854 1.00 0.00 H new ATOM 0 HA SER A 87 6.951 2.036 9.264 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.390 -0.392 9.372 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.555 0.812 8.857 1.00 0.00 H new ATOM 0 HG SER A 87 9.402 0.670 11.170 1.00 0.00 H new ATOM 1369 N ARG A 88 7.654 3.507 7.412 1.00 0.00 N ATOM 1370 CA ARG A 88 8.152 4.446 6.421 1.00 0.00 C ATOM 1371 C ARG A 88 9.174 5.393 7.053 1.00 0.00 C ATOM 1372 O ARG A 88 8.856 6.114 7.998 1.00 0.00 O ATOM 1373 CB ARG A 88 7.011 5.267 5.817 1.00 0.00 C ATOM 1374 CG ARG A 88 7.352 5.716 4.394 1.00 0.00 C ATOM 1375 CD ARG A 88 6.086 6.088 3.619 1.00 0.00 C ATOM 1376 NE ARG A 88 5.903 7.556 3.624 1.00 0.00 N ATOM 1377 CZ ARG A 88 6.506 8.391 2.767 1.00 0.00 C ATOM 1378 NH1 ARG A 88 7.334 7.908 1.832 1.00 0.00 N ATOM 1379 NH2 ARG A 88 6.280 9.710 2.846 1.00 0.00 N ATOM 0 H ARG A 88 6.933 3.881 8.030 1.00 0.00 H new ATOM 0 HA ARG A 88 8.628 3.869 5.628 1.00 0.00 H new ATOM 0 HB2 ARG A 88 6.097 4.673 5.806 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.816 6.139 6.441 1.00 0.00 H new ATOM 0 HG2 ARG A 88 8.025 6.572 4.430 1.00 0.00 H new ATOM 0 HG3 ARG A 88 7.880 4.917 3.873 1.00 0.00 H new ATOM 0 HD2 ARG A 88 6.158 5.726 2.593 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.219 5.604 4.068 1.00 0.00 H new ATOM 0 HE ARG A 88 5.279 7.958 4.324 1.00 0.00 H new ATOM 0 HH11 ARG A 88 7.506 6.904 1.772 1.00 0.00 H new ATOM 0 HH12 ARG A 88 7.793 8.544 1.180 1.00 0.00 H new ATOM 0 HH21 ARG A 88 5.649 10.078 3.558 1.00 0.00 H new ATOM 0 HH22 ARG A 88 6.739 10.346 2.194 1.00 0.00 H new ATOM 1393 N THR A 89 10.381 5.360 6.507 1.00 0.00 N ATOM 1394 CA THR A 89 11.451 6.207 7.006 1.00 0.00 C ATOM 1395 C THR A 89 11.492 7.527 6.234 1.00 0.00 C ATOM 1396 O THR A 89 11.144 7.571 5.054 1.00 0.00 O ATOM 1397 CB THR A 89 12.757 5.415 6.925 1.00 0.00 C ATOM 1398 OG1 THR A 89 12.657 4.705 5.694 1.00 0.00 O ATOM 1399 CG2 THR A 89 12.841 4.314 7.984 1.00 0.00 C ATOM 0 H THR A 89 10.641 4.760 5.724 1.00 0.00 H new ATOM 0 HA THR A 89 11.284 6.482 8.048 1.00 0.00 H new ATOM 0 HB THR A 89 13.601 6.095 7.041 1.00 0.00 H new ATOM 0 HG1 THR A 89 13.464 4.166 5.561 1.00 0.00 H new ATOM 0 HG21 THR A 89 13.787 3.783 7.882 1.00 0.00 H new ATOM 0 HG22 THR A 89 12.780 4.759 8.977 1.00 0.00 H new ATOM 0 HG23 THR A 89 12.016 3.615 7.848 1.00 0.00 H new ATOM 1407 N VAL A 90 11.920 8.570 6.929 1.00 0.00 N ATOM 1408 CA VAL A 90 12.010 9.888 6.323 1.00 0.00 C ATOM 1409 C VAL A 90 13.219 10.627 6.899 1.00 0.00 C ATOM 1410 O VAL A 90 13.115 11.285 7.933 1.00 0.00 O ATOM 1411 CB VAL A 90 10.696 10.646 6.521 1.00 0.00 C ATOM 1412 CG1 VAL A 90 10.847 12.116 6.124 1.00 0.00 C ATOM 1413 CG2 VAL A 90 9.558 9.982 5.743 1.00 0.00 C ATOM 0 H VAL A 90 12.209 8.530 7.907 1.00 0.00 H new ATOM 0 HA VAL A 90 12.162 9.804 5.247 1.00 0.00 H new ATOM 0 HB VAL A 90 10.443 10.609 7.581 1.00 0.00 H new ATOM 0 HG11 VAL A 90 9.899 12.633 6.274 1.00 0.00 H new ATOM 0 HG12 VAL A 90 11.616 12.582 6.740 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.134 12.182 5.074 1.00 0.00 H new ATOM 0 HG21 VAL A 90 8.635 10.540 5.901 1.00 0.00 H new ATOM 0 HG22 VAL A 90 9.800 9.974 4.680 1.00 0.00 H new ATOM 0 HG23 VAL A 90 9.427 8.958 6.093 1.00 0.00 H new ATOM 1423 N GLY A 91 14.340 10.494 6.204 1.00 0.00 N ATOM 1424 CA GLY A 91 15.568 11.142 6.634 1.00 0.00 C ATOM 1425 C GLY A 91 15.722 11.071 8.154 1.00 0.00 C ATOM 1426 O GLY A 91 15.831 12.100 8.819 1.00 0.00 O ATOM 0 H GLY A 91 14.423 9.947 5.347 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.423 10.664 6.156 1.00 0.00 H new ATOM 0 HA3 GLY A 91 15.565 12.184 6.313 1.00 0.00 H new ATOM 1430 N GLY A 92 15.726 9.847 8.660 1.00 0.00 N ATOM 1431 CA GLY A 92 15.865 9.629 10.090 1.00 0.00 C ATOM 1432 C GLY A 92 14.496 9.560 10.770 1.00 0.00 C ATOM 1433 O GLY A 92 14.312 8.813 11.730 1.00 0.00 O ATOM 0 H GLY A 92 15.635 8.996 8.106 1.00 0.00 H new ATOM 0 HA2 GLY A 92 16.411 8.703 10.269 1.00 0.00 H new ATOM 0 HA3 GLY A 92 16.453 10.435 10.529 1.00 0.00 H new ATOM 1437 N TYR A 93 13.570 10.350 10.246 1.00 0.00 N ATOM 1438 CA TYR A 93 12.223 10.388 10.790 1.00 0.00 C ATOM 1439 C TYR A 93 11.421 9.160 10.355 1.00 0.00 C ATOM 1440 O TYR A 93 10.827 9.151 9.278 1.00 0.00 O ATOM 1441 CB TYR A 93 11.569 11.643 10.208 1.00 0.00 C ATOM 1442 CG TYR A 93 10.755 12.448 11.222 1.00 0.00 C ATOM 1443 CD1 TYR A 93 11.372 13.418 11.987 1.00 0.00 C ATOM 1444 CD2 TYR A 93 9.405 12.205 11.373 1.00 0.00 C ATOM 1445 CE1 TYR A 93 10.606 14.176 12.942 1.00 0.00 C ATOM 1446 CE2 TYR A 93 8.640 12.964 12.329 1.00 0.00 C ATOM 1447 CZ TYR A 93 9.278 13.912 13.066 1.00 0.00 C ATOM 1448 OH TYR A 93 8.555 14.628 13.968 1.00 0.00 O ATOM 0 H TYR A 93 13.726 10.969 9.450 1.00 0.00 H new ATOM 0 HA TYR A 93 12.249 10.397 11.880 1.00 0.00 H new ATOM 0 HB2 TYR A 93 12.345 12.284 9.790 1.00 0.00 H new ATOM 0 HB3 TYR A 93 10.918 11.352 9.384 1.00 0.00 H new ATOM 0 HD1 TYR A 93 12.429 13.608 11.869 1.00 0.00 H new ATOM 0 HD2 TYR A 93 8.922 11.446 10.775 1.00 0.00 H new ATOM 0 HE1 TYR A 93 11.076 14.938 13.547 1.00 0.00 H new ATOM 0 HE2 TYR A 93 7.583 12.784 12.458 1.00 0.00 H new ATOM 0 HH TYR A 93 7.621 14.332 13.947 1.00 0.00 H new ATOM 1458 N THR A 94 11.429 8.153 11.216 1.00 0.00 N ATOM 1459 CA THR A 94 10.710 6.922 10.934 1.00 0.00 C ATOM 1460 C THR A 94 9.329 6.949 11.594 1.00 0.00 C ATOM 1461 O THR A 94 9.201 7.322 12.759 1.00 0.00 O ATOM 1462 CB THR A 94 11.580 5.750 11.393 1.00 0.00 C ATOM 1463 OG1 THR A 94 12.582 5.646 10.386 1.00 0.00 O ATOM 1464 CG2 THR A 94 10.842 4.411 11.325 1.00 0.00 C ATOM 0 H THR A 94 11.922 8.164 12.109 1.00 0.00 H new ATOM 0 HA THR A 94 10.524 6.808 9.866 1.00 0.00 H new ATOM 0 HB THR A 94 11.917 5.927 12.414 1.00 0.00 H new ATOM 0 HG1 THR A 94 13.191 4.911 10.606 1.00 0.00 H new ATOM 0 HG21 THR A 94 11.504 3.613 11.661 1.00 0.00 H new ATOM 0 HG22 THR A 94 9.962 4.447 11.967 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.533 4.217 10.298 1.00 0.00 H new ATOM 1472 N LYS A 95 8.332 6.548 10.820 1.00 0.00 N ATOM 1473 CA LYS A 95 6.965 6.521 11.314 1.00 0.00 C ATOM 1474 C LYS A 95 6.388 5.116 11.129 1.00 0.00 C ATOM 1475 O LYS A 95 6.601 4.485 10.095 1.00 0.00 O ATOM 1476 CB LYS A 95 6.134 7.620 10.650 1.00 0.00 C ATOM 1477 CG LYS A 95 6.219 7.526 9.125 1.00 0.00 C ATOM 1478 CD LYS A 95 7.146 8.605 8.561 1.00 0.00 C ATOM 1479 CE LYS A 95 6.454 9.969 8.544 1.00 0.00 C ATOM 1480 NZ LYS A 95 7.450 11.057 8.666 1.00 0.00 N ATOM 0 H LYS A 95 8.443 6.239 9.854 1.00 0.00 H new ATOM 0 HA LYS A 95 6.941 6.737 12.382 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.094 7.536 10.966 1.00 0.00 H new ATOM 0 HB3 LYS A 95 6.488 8.597 10.978 1.00 0.00 H new ATOM 0 HG2 LYS A 95 6.585 6.540 8.837 1.00 0.00 H new ATOM 0 HG3 LYS A 95 5.224 7.635 8.694 1.00 0.00 H new ATOM 0 HD2 LYS A 95 8.053 8.661 9.163 1.00 0.00 H new ATOM 0 HD3 LYS A 95 7.451 8.335 7.550 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.890 10.086 7.618 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.738 10.030 9.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 7.291 11.575 9.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 8.408 10.652 8.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.352 11.709 7.862 1.00 0.00 H new ATOM 1494 N LYS A 96 5.668 4.668 12.147 1.00 0.00 N ATOM 1495 CA LYS A 96 5.059 3.349 12.109 1.00 0.00 C ATOM 1496 C LYS A 96 3.610 3.476 11.635 1.00 0.00 C ATOM 1497 O LYS A 96 2.727 3.833 12.414 1.00 0.00 O ATOM 1498 CB LYS A 96 5.204 2.653 13.464 1.00 0.00 C ATOM 1499 CG LYS A 96 6.652 2.707 13.955 1.00 0.00 C ATOM 1500 CD LYS A 96 7.092 1.353 14.516 1.00 0.00 C ATOM 1501 CE LYS A 96 6.487 1.110 15.900 1.00 0.00 C ATOM 1502 NZ LYS A 96 6.499 -0.334 16.225 1.00 0.00 N ATOM 0 H LYS A 96 5.493 5.195 13.003 1.00 0.00 H new ATOM 0 HA LYS A 96 5.575 2.711 11.392 1.00 0.00 H new ATOM 0 HB2 LYS A 96 4.550 3.131 14.194 1.00 0.00 H new ATOM 0 HB3 LYS A 96 4.883 1.615 13.380 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.308 2.995 13.133 1.00 0.00 H new ATOM 0 HG3 LYS A 96 6.750 3.473 14.724 1.00 0.00 H new ATOM 0 HD2 LYS A 96 6.786 0.557 13.837 1.00 0.00 H new ATOM 0 HD3 LYS A 96 8.180 1.318 14.579 1.00 0.00 H new ATOM 0 HE2 LYS A 96 7.051 1.663 16.652 1.00 0.00 H new ATOM 0 HE3 LYS A 96 5.464 1.486 15.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.085 -0.481 17.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 5.942 -0.854 15.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.479 -0.683 16.219 1.00 0.00 H new ATOM 1516 N THR A 97 3.409 3.175 10.360 1.00 0.00 N ATOM 1517 CA THR A 97 2.082 3.250 9.773 1.00 0.00 C ATOM 1518 C THR A 97 1.405 1.879 9.807 1.00 0.00 C ATOM 1519 O THR A 97 2.000 0.879 9.406 1.00 0.00 O ATOM 1520 CB THR A 97 2.221 3.825 8.362 1.00 0.00 C ATOM 1521 OG1 THR A 97 2.984 5.014 8.545 1.00 0.00 O ATOM 1522 CG2 THR A 97 0.888 4.319 7.797 1.00 0.00 C ATOM 0 H THR A 97 4.143 2.879 9.717 1.00 0.00 H new ATOM 0 HA THR A 97 1.433 3.912 10.346 1.00 0.00 H new ATOM 0 HB THR A 97 2.636 3.065 7.700 1.00 0.00 H new ATOM 0 HG1 THR A 97 3.123 5.450 7.678 1.00 0.00 H new ATOM 0 HG21 THR A 97 1.043 4.717 6.794 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.182 3.490 7.753 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.488 5.103 8.441 1.00 0.00 H new ATOM 1530 N VAL A 98 0.171 1.875 10.290 1.00 0.00 N ATOM 1531 CA VAL A 98 -0.593 0.642 10.381 1.00 0.00 C ATOM 1532 C VAL A 98 -1.524 0.534 9.172 1.00 0.00 C ATOM 1533 O VAL A 98 -2.358 1.408 8.946 1.00 0.00 O ATOM 1534 CB VAL A 98 -1.338 0.587 11.716 1.00 0.00 C ATOM 1535 CG1 VAL A 98 -2.207 -0.669 11.807 1.00 0.00 C ATOM 1536 CG2 VAL A 98 -0.363 0.665 12.892 1.00 0.00 C ATOM 0 H VAL A 98 -0.319 2.706 10.622 1.00 0.00 H new ATOM 0 HA VAL A 98 0.071 -0.222 10.358 1.00 0.00 H new ATOM 0 HB VAL A 98 -1.996 1.455 11.768 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.726 -0.684 12.766 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.938 -0.665 10.999 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.577 -1.554 11.722 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -0.919 0.624 13.829 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.332 -0.174 12.845 1.00 0.00 H new ATOM 0 HG23 VAL A 98 0.194 1.601 12.841 1.00 0.00 H new ATOM 1546 N PHE A 99 -1.349 -0.548 8.426 1.00 0.00 N ATOM 1547 CA PHE A 99 -2.163 -0.782 7.245 1.00 0.00 C ATOM 1548 C PHE A 99 -2.871 -2.136 7.328 1.00 0.00 C ATOM 1549 O PHE A 99 -2.233 -3.182 7.226 1.00 0.00 O ATOM 1550 CB PHE A 99 -1.216 -0.788 6.043 1.00 0.00 C ATOM 1551 CG PHE A 99 -1.901 -1.110 4.714 1.00 0.00 C ATOM 1552 CD1 PHE A 99 -2.587 -0.142 4.050 1.00 0.00 C ATOM 1553 CD2 PHE A 99 -1.823 -2.365 4.196 1.00 0.00 C ATOM 1554 CE1 PHE A 99 -3.222 -0.441 2.816 1.00 0.00 C ATOM 1555 CE2 PHE A 99 -2.459 -2.665 2.962 1.00 0.00 C ATOM 1556 CZ PHE A 99 -3.145 -1.696 2.297 1.00 0.00 C ATOM 0 H PHE A 99 -0.656 -1.272 8.617 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.925 -0.008 7.158 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.737 0.188 5.966 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.426 -1.518 6.219 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -2.649 0.855 4.461 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -1.277 -3.134 4.723 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -3.767 0.328 2.289 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.398 -3.662 2.551 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.628 -1.923 1.358 1.00 0.00 H new ATOM 1566 N ASN A 100 -4.182 -2.071 7.512 1.00 0.00 N ATOM 1567 CA ASN A 100 -4.984 -3.279 7.609 1.00 0.00 C ATOM 1568 C ASN A 100 -5.409 -3.718 6.207 1.00 0.00 C ATOM 1569 O ASN A 100 -6.005 -2.941 5.463 1.00 0.00 O ATOM 1570 CB ASN A 100 -6.251 -3.034 8.432 1.00 0.00 C ATOM 1571 CG ASN A 100 -5.914 -2.830 9.910 1.00 0.00 C ATOM 1572 OD1 ASN A 100 -6.098 -3.704 10.741 1.00 0.00 O ATOM 1573 ND2 ASN A 100 -5.411 -1.631 10.190 1.00 0.00 N ATOM 0 H ASN A 100 -4.708 -1.201 7.596 1.00 0.00 H new ATOM 0 HA ASN A 100 -4.381 -4.046 8.095 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.773 -2.157 8.050 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.929 -3.881 8.323 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.153 -1.397 11.149 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.283 -0.945 9.446 1.00 0.00 H new ATOM 1580 N VAL A 101 -5.084 -4.963 5.888 1.00 0.00 N ATOM 1581 CA VAL A 101 -5.425 -5.515 4.587 1.00 0.00 C ATOM 1582 C VAL A 101 -6.779 -6.221 4.677 1.00 0.00 C ATOM 1583 O VAL A 101 -6.854 -7.377 5.090 1.00 0.00 O ATOM 1584 CB VAL A 101 -4.303 -6.434 4.099 1.00 0.00 C ATOM 1585 CG1 VAL A 101 -4.739 -7.222 2.863 1.00 0.00 C ATOM 1586 CG2 VAL A 101 -3.026 -5.638 3.819 1.00 0.00 C ATOM 0 H VAL A 101 -4.589 -5.604 6.507 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.521 -4.720 3.847 1.00 0.00 H new ATOM 0 HB VAL A 101 -4.086 -7.149 4.893 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.923 -7.867 2.537 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.608 -7.832 3.108 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.996 -6.529 2.062 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.244 -6.314 3.474 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -3.224 -4.890 3.051 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.699 -5.142 4.733 1.00 0.00 H new ATOM 1596 N LEU A 102 -7.816 -5.496 4.282 1.00 0.00 N ATOM 1597 CA LEU A 102 -9.163 -6.039 4.312 1.00 0.00 C ATOM 1598 C LEU A 102 -9.109 -7.543 4.035 1.00 0.00 C ATOM 1599 O LEU A 102 -9.061 -8.348 4.963 1.00 0.00 O ATOM 1600 CB LEU A 102 -10.073 -5.269 3.353 1.00 0.00 C ATOM 1601 CG LEU A 102 -11.077 -4.314 4.001 1.00 0.00 C ATOM 1602 CD1 LEU A 102 -11.974 -3.662 2.947 1.00 0.00 C ATOM 1603 CD2 LEU A 102 -11.889 -5.026 5.085 1.00 0.00 C ATOM 0 H LEU A 102 -7.750 -4.537 3.940 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.602 -5.913 5.302 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.446 -4.696 2.670 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.625 -5.990 2.750 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.521 -3.513 4.489 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.678 -2.988 3.435 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -11.360 -3.099 2.245 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -12.524 -4.434 2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.595 -4.325 5.530 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.435 -5.859 4.642 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -11.216 -5.402 5.856 1.00 0.00 H new ATOM 1615 N SER A 103 -9.119 -7.876 2.752 1.00 0.00 N ATOM 1616 CA SER A 103 -9.072 -9.269 2.341 1.00 0.00 C ATOM 1617 C SER A 103 -8.651 -9.367 0.873 1.00 0.00 C ATOM 1618 O SER A 103 -9.394 -8.957 -0.018 1.00 0.00 O ATOM 1619 CB SER A 103 -10.425 -9.952 2.552 1.00 0.00 C ATOM 1620 OG SER A 103 -10.280 -11.318 2.929 1.00 0.00 O ATOM 0 H SER A 103 -9.159 -7.206 1.984 1.00 0.00 H new ATOM 0 HA SER A 103 -8.336 -9.783 2.959 1.00 0.00 H new ATOM 0 HB2 SER A 103 -10.983 -9.420 3.323 1.00 0.00 H new ATOM 0 HB3 SER A 103 -11.010 -9.889 1.634 1.00 0.00 H new ATOM 0 HG SER A 103 -11.166 -11.718 3.056 1.00 0.00 H new ATOM 1626 N THR A 104 -7.462 -9.912 0.667 1.00 0.00 N ATOM 1627 CA THR A 104 -6.934 -10.069 -0.678 1.00 0.00 C ATOM 1628 C THR A 104 -7.027 -11.531 -1.120 1.00 0.00 C ATOM 1629 O THR A 104 -6.964 -12.439 -0.293 1.00 0.00 O ATOM 1630 CB THR A 104 -5.505 -9.521 -0.692 1.00 0.00 C ATOM 1631 OG1 THR A 104 -5.005 -9.887 -1.975 1.00 0.00 O ATOM 1632 CG2 THR A 104 -4.587 -10.253 0.289 1.00 0.00 C ATOM 0 H THR A 104 -6.849 -10.251 1.408 1.00 0.00 H new ATOM 0 HA THR A 104 -7.522 -9.504 -1.402 1.00 0.00 H new ATOM 0 HB THR A 104 -5.522 -8.459 -0.449 1.00 0.00 H new ATOM 0 HG1 THR A 104 -5.687 -9.707 -2.655 1.00 0.00 H new ATOM 0 HG21 THR A 104 -3.586 -9.825 0.239 1.00 0.00 H new ATOM 0 HG22 THR A 104 -4.977 -10.146 1.301 1.00 0.00 H new ATOM 0 HG23 THR A 104 -4.543 -11.310 0.027 1.00 0.00 H new ATOM 1640 N ASP A 105 -7.177 -11.713 -2.424 1.00 0.00 N ATOM 1641 CA ASP A 105 -7.280 -13.049 -2.987 1.00 0.00 C ATOM 1642 C ASP A 105 -5.880 -13.653 -3.114 1.00 0.00 C ATOM 1643 O ASP A 105 -5.732 -14.805 -3.518 1.00 0.00 O ATOM 1644 CB ASP A 105 -7.907 -13.012 -4.381 1.00 0.00 C ATOM 1645 CG ASP A 105 -8.993 -14.060 -4.630 1.00 0.00 C ATOM 1646 OD1 ASP A 105 -8.794 -14.876 -5.556 1.00 0.00 O ATOM 1647 OD2 ASP A 105 -9.999 -14.023 -3.887 1.00 0.00 O ATOM 0 H ASP A 105 -7.230 -10.957 -3.107 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.907 -13.647 -2.325 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -8.334 -12.023 -4.545 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -7.118 -13.145 -5.121 1.00 0.00 H new ATOM 1653 N ASN A 106 -4.888 -12.848 -2.761 1.00 0.00 N ATOM 1654 CA ASN A 106 -3.506 -13.290 -2.830 1.00 0.00 C ATOM 1655 C ASN A 106 -3.309 -14.139 -4.088 1.00 0.00 C ATOM 1656 O ASN A 106 -2.760 -15.238 -4.019 1.00 0.00 O ATOM 1657 CB ASN A 106 -3.140 -14.148 -1.618 1.00 0.00 C ATOM 1658 CG ASN A 106 -4.148 -15.283 -1.425 1.00 0.00 C ATOM 1659 OD1 ASN A 106 -5.092 -15.021 -0.525 1.00 0.00 O flip ATOM 1660 ND2 ASN A 106 -4.074 -16.327 -2.052 1.00 0.00 N flip ATOM 0 H ASN A 106 -5.014 -11.893 -2.427 1.00 0.00 H new ATOM 0 HA ASN A 106 -2.870 -12.405 -2.850 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -2.141 -14.563 -1.750 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -3.111 -13.526 -0.723 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -3.323 -16.463 -2.729 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -4.763 -17.063 -1.899 1.00 0.00 H new ATOM 1667 N LYS A 107 -3.767 -13.597 -5.207 1.00 0.00 N ATOM 1668 CA LYS A 107 -3.647 -14.292 -6.478 1.00 0.00 C ATOM 1669 C LYS A 107 -3.017 -13.354 -7.509 1.00 0.00 C ATOM 1670 O LYS A 107 -1.901 -13.591 -7.969 1.00 0.00 O ATOM 1671 CB LYS A 107 -5.002 -14.858 -6.908 1.00 0.00 C ATOM 1672 CG LYS A 107 -4.853 -16.278 -7.458 1.00 0.00 C ATOM 1673 CD LYS A 107 -5.511 -17.299 -6.528 1.00 0.00 C ATOM 1674 CE LYS A 107 -4.666 -18.569 -6.423 1.00 0.00 C ATOM 1675 NZ LYS A 107 -5.534 -19.762 -6.307 1.00 0.00 N ATOM 0 H LYS A 107 -4.221 -12.685 -5.260 1.00 0.00 H new ATOM 0 HA LYS A 107 -2.984 -15.152 -6.382 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.684 -14.863 -6.058 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -5.444 -14.214 -7.668 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -5.306 -16.338 -8.448 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -3.796 -16.517 -7.576 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -5.643 -16.863 -5.538 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -6.504 -17.549 -6.901 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -4.027 -18.661 -7.301 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -4.009 -18.505 -5.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -4.944 -20.615 -6.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -6.126 -19.679 -5.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -6.143 -19.831 -7.147 1.00 0.00 H new ATOM 1689 N ASN A 108 -3.760 -12.308 -7.842 1.00 0.00 N ATOM 1690 CA ASN A 108 -3.288 -11.333 -8.811 1.00 0.00 C ATOM 1691 C ASN A 108 -3.509 -9.924 -8.259 1.00 0.00 C ATOM 1692 O ASN A 108 -2.623 -9.075 -8.339 1.00 0.00 O ATOM 1693 CB ASN A 108 -4.055 -11.451 -10.130 1.00 0.00 C ATOM 1694 CG ASN A 108 -4.592 -12.870 -10.327 1.00 0.00 C ATOM 1695 OD1 ASN A 108 -3.956 -13.855 -9.989 1.00 0.00 O ATOM 1696 ND2 ASN A 108 -5.796 -12.919 -10.890 1.00 0.00 N ATOM 0 H ASN A 108 -4.685 -12.115 -7.458 1.00 0.00 H new ATOM 0 HA ASN A 108 -2.230 -11.522 -8.992 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -4.882 -10.741 -10.139 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.400 -11.188 -10.960 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -6.242 -13.820 -11.063 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -6.274 -12.056 -11.149 1.00 0.00 H new ATOM 1703 N TYR A 109 -4.698 -9.717 -7.711 1.00 0.00 N ATOM 1704 CA TYR A 109 -5.048 -8.425 -7.146 1.00 0.00 C ATOM 1705 C TYR A 109 -4.897 -8.434 -5.624 1.00 0.00 C ATOM 1706 O TYR A 109 -4.868 -9.496 -5.005 1.00 0.00 O ATOM 1707 CB TYR A 109 -6.518 -8.194 -7.500 1.00 0.00 C ATOM 1708 CG TYR A 109 -7.452 -8.162 -6.289 1.00 0.00 C ATOM 1709 CD1 TYR A 109 -7.792 -9.336 -5.648 1.00 0.00 C ATOM 1710 CD2 TYR A 109 -7.954 -6.959 -5.836 1.00 0.00 C ATOM 1711 CE1 TYR A 109 -8.671 -9.306 -4.508 1.00 0.00 C ATOM 1712 CE2 TYR A 109 -8.833 -6.928 -4.696 1.00 0.00 C ATOM 1713 CZ TYR A 109 -9.148 -8.103 -4.088 1.00 0.00 C ATOM 1714 OH TYR A 109 -9.978 -8.075 -3.011 1.00 0.00 O ATOM 0 H TYR A 109 -5.431 -10.423 -7.646 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.396 -7.645 -7.539 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -6.607 -7.251 -8.040 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.846 -8.982 -8.178 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.399 -10.278 -6.002 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -7.687 -6.040 -6.337 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -8.945 -10.218 -3.998 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.233 -5.993 -4.332 1.00 0.00 H new ATOM 0 HH TYR A 109 -9.504 -8.415 -2.224 1.00 0.00 H new ATOM 1724 N ILE A 110 -4.805 -7.237 -5.063 1.00 0.00 N ATOM 1725 CA ILE A 110 -4.658 -7.093 -3.625 1.00 0.00 C ATOM 1726 C ILE A 110 -5.428 -5.856 -3.159 1.00 0.00 C ATOM 1727 O ILE A 110 -5.386 -4.812 -3.809 1.00 0.00 O ATOM 1728 CB ILE A 110 -3.178 -7.078 -3.236 1.00 0.00 C ATOM 1729 CG1 ILE A 110 -2.707 -8.473 -2.819 1.00 0.00 C ATOM 1730 CG2 ILE A 110 -2.906 -6.033 -2.152 1.00 0.00 C ATOM 1731 CD1 ILE A 110 -1.288 -8.745 -3.322 1.00 0.00 C ATOM 0 H ILE A 110 -4.829 -6.358 -5.579 1.00 0.00 H new ATOM 0 HA ILE A 110 -5.091 -7.951 -3.111 1.00 0.00 H new ATOM 0 HB ILE A 110 -2.597 -6.790 -4.112 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -2.735 -8.561 -1.733 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -3.388 -9.225 -3.217 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -1.847 -6.043 -1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -3.180 -5.045 -2.522 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.497 -6.265 -1.266 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.977 -9.743 -3.012 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -1.269 -8.680 -4.410 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.605 -8.006 -2.903 1.00 0.00 H new ATOM 1743 N ILE A 111 -6.115 -6.013 -2.037 1.00 0.00 N ATOM 1744 CA ILE A 111 -6.893 -4.922 -1.477 1.00 0.00 C ATOM 1745 C ILE A 111 -6.382 -4.606 -0.069 1.00 0.00 C ATOM 1746 O ILE A 111 -5.583 -5.357 0.487 1.00 0.00 O ATOM 1747 CB ILE A 111 -8.387 -5.247 -1.530 1.00 0.00 C ATOM 1748 CG1 ILE A 111 -9.214 -3.986 -1.785 1.00 0.00 C ATOM 1749 CG2 ILE A 111 -8.834 -5.979 -0.263 1.00 0.00 C ATOM 1750 CD1 ILE A 111 -9.661 -3.910 -3.247 1.00 0.00 C ATOM 0 H ILE A 111 -6.149 -6.880 -1.501 1.00 0.00 H new ATOM 0 HA ILE A 111 -6.765 -4.018 -2.073 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.560 -5.921 -2.369 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -10.088 -3.982 -1.133 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -8.625 -3.104 -1.535 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -9.900 -6.198 -0.326 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -8.277 -6.911 -0.166 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -8.644 -5.350 0.607 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -10.247 -3.004 -3.402 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -8.785 -3.890 -3.895 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -10.270 -4.782 -3.487 1.00 0.00 H new ATOM 1762 N GLY A 112 -6.865 -3.494 0.465 1.00 0.00 N ATOM 1763 CA GLY A 112 -6.467 -3.070 1.797 1.00 0.00 C ATOM 1764 C GLY A 112 -7.205 -1.795 2.210 1.00 0.00 C ATOM 1765 O GLY A 112 -7.845 -1.149 1.382 1.00 0.00 O ATOM 0 H GLY A 112 -7.528 -2.874 -0.000 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -6.677 -3.864 2.513 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -5.391 -2.896 1.821 1.00 0.00 H new ATOM 1769 N TYR A 113 -7.089 -1.471 3.489 1.00 0.00 N ATOM 1770 CA TYR A 113 -7.737 -0.284 4.022 1.00 0.00 C ATOM 1771 C TYR A 113 -7.020 0.216 5.277 1.00 0.00 C ATOM 1772 O TYR A 113 -6.947 -0.494 6.279 1.00 0.00 O ATOM 1773 CB TYR A 113 -9.158 -0.712 4.397 1.00 0.00 C ATOM 1774 CG TYR A 113 -10.162 0.441 4.445 1.00 0.00 C ATOM 1775 CD1 TYR A 113 -10.257 1.227 5.575 1.00 0.00 C ATOM 1776 CD2 TYR A 113 -10.974 0.694 3.358 1.00 0.00 C ATOM 1777 CE1 TYR A 113 -11.203 2.312 5.620 1.00 0.00 C ATOM 1778 CE2 TYR A 113 -11.920 1.779 3.403 1.00 0.00 C ATOM 1779 CZ TYR A 113 -11.988 2.534 4.532 1.00 0.00 C ATOM 1780 OH TYR A 113 -12.881 3.559 4.575 1.00 0.00 O ATOM 0 H TYR A 113 -6.556 -2.009 4.172 1.00 0.00 H new ATOM 0 HA TYR A 113 -7.723 0.523 3.289 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -9.505 -1.453 3.677 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -9.134 -1.201 5.371 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -9.622 1.029 6.426 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -10.900 0.078 2.474 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -11.287 2.935 6.498 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -12.561 1.988 2.559 1.00 0.00 H new ATOM 0 HH TYR A 113 -13.373 3.600 3.728 1.00 0.00 H new ATOM 1790 N SER A 114 -6.508 1.434 5.182 1.00 0.00 N ATOM 1791 CA SER A 114 -5.798 2.037 6.297 1.00 0.00 C ATOM 1792 C SER A 114 -6.105 3.535 6.364 1.00 0.00 C ATOM 1793 O SER A 114 -6.397 4.158 5.345 1.00 0.00 O ATOM 1794 CB SER A 114 -4.290 1.809 6.179 1.00 0.00 C ATOM 1795 OG SER A 114 -3.677 2.742 5.293 1.00 0.00 O ATOM 0 H SER A 114 -6.571 2.020 4.350 1.00 0.00 H new ATOM 0 HA SER A 114 -6.139 1.561 7.217 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.833 1.891 7.165 1.00 0.00 H new ATOM 0 HB3 SER A 114 -4.103 0.795 5.824 1.00 0.00 H new ATOM 0 HG SER A 114 -2.702 2.671 5.366 1.00 0.00 H new ATOM 1801 N CYS A 115 -6.028 4.068 7.574 1.00 0.00 N ATOM 1802 CA CYS A 115 -6.294 5.481 7.788 1.00 0.00 C ATOM 1803 C CYS A 115 -5.575 5.917 9.065 1.00 0.00 C ATOM 1804 O CYS A 115 -5.443 5.136 10.006 1.00 0.00 O ATOM 1805 CB CYS A 115 -7.795 5.770 7.851 1.00 0.00 C ATOM 1806 SG CYS A 115 -8.551 5.548 9.502 1.00 0.00 S ATOM 0 H CYS A 115 -5.785 3.547 8.417 1.00 0.00 H new ATOM 0 HA CYS A 115 -5.915 6.057 6.944 1.00 0.00 H new ATOM 0 HB2 CYS A 115 -7.967 6.795 7.523 1.00 0.00 H new ATOM 0 HB3 CYS A 115 -8.306 5.118 7.142 1.00 0.00 H new ATOM 1812 N ARG A 116 -5.128 7.165 9.058 1.00 0.00 N ATOM 1813 CA ARG A 116 -4.425 7.715 10.204 1.00 0.00 C ATOM 1814 C ARG A 116 -5.215 8.880 10.803 1.00 0.00 C ATOM 1815 O ARG A 116 -5.798 9.679 10.072 1.00 0.00 O ATOM 1816 CB ARG A 116 -3.028 8.202 9.813 1.00 0.00 C ATOM 1817 CG ARG A 116 -2.447 9.121 10.889 1.00 0.00 C ATOM 1818 CD ARG A 116 -1.140 9.761 10.415 1.00 0.00 C ATOM 1819 NE ARG A 116 -0.199 9.890 11.550 1.00 0.00 N ATOM 1820 CZ ARG A 116 1.077 10.279 11.427 1.00 0.00 C ATOM 1821 NH1 ARG A 116 1.573 10.579 10.219 1.00 0.00 N ATOM 1822 NH2 ARG A 116 1.858 10.367 12.513 1.00 0.00 N ATOM 0 H ARG A 116 -5.239 7.811 8.276 1.00 0.00 H new ATOM 0 HA ARG A 116 -4.326 6.921 10.944 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -2.369 7.347 9.666 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -3.077 8.734 8.863 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -3.169 9.899 11.136 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -2.268 8.551 11.801 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -0.693 9.154 9.628 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -1.341 10.742 9.985 1.00 0.00 H new ATOM 0 HE ARG A 116 -0.544 9.669 12.484 1.00 0.00 H new ATOM 0 HH11 ARG A 116 0.979 10.511 9.393 1.00 0.00 H new ATOM 0 HH12 ARG A 116 2.545 10.875 10.126 1.00 0.00 H new ATOM 0 HH21 ARG A 116 1.481 10.138 13.432 1.00 0.00 H new ATOM 0 HH22 ARG A 116 2.830 10.663 12.420 1.00 0.00 H new ATOM 1836 N TYR A 117 -5.209 8.939 12.126 1.00 0.00 N ATOM 1837 CA TYR A 117 -5.919 9.994 12.831 1.00 0.00 C ATOM 1838 C TYR A 117 -5.230 11.346 12.632 1.00 0.00 C ATOM 1839 O TYR A 117 -4.179 11.603 13.216 1.00 0.00 O ATOM 1840 CB TYR A 117 -5.864 9.620 14.314 1.00 0.00 C ATOM 1841 CG TYR A 117 -6.966 10.263 15.158 1.00 0.00 C ATOM 1842 CD1 TYR A 117 -6.772 11.512 15.712 1.00 0.00 C ATOM 1843 CD2 TYR A 117 -8.155 9.594 15.366 1.00 0.00 C ATOM 1844 CE1 TYR A 117 -7.809 12.117 16.507 1.00 0.00 C ATOM 1845 CE2 TYR A 117 -9.193 10.199 16.161 1.00 0.00 C ATOM 1846 CZ TYR A 117 -8.968 11.431 16.692 1.00 0.00 C ATOM 1847 OH TYR A 117 -9.948 12.002 17.442 1.00 0.00 O ATOM 0 H TYR A 117 -4.724 8.274 12.729 1.00 0.00 H new ATOM 0 HA TYR A 117 -6.940 10.085 12.460 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -5.934 8.536 14.408 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -4.894 9.913 14.717 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -5.842 12.036 15.549 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -8.307 8.617 14.933 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -7.669 13.094 16.946 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -10.128 9.686 16.331 1.00 0.00 H new ATOM 0 HH TYR A 117 -10.719 11.398 17.488 1.00 0.00 H new ATOM 1857 N ASP A 118 -5.852 12.174 11.806 1.00 0.00 N ATOM 1858 CA ASP A 118 -5.312 13.493 11.522 1.00 0.00 C ATOM 1859 C ASP A 118 -6.291 14.558 12.021 1.00 0.00 C ATOM 1860 O ASP A 118 -7.287 14.848 11.361 1.00 0.00 O ATOM 1861 CB ASP A 118 -5.117 13.697 10.019 1.00 0.00 C ATOM 1862 CG ASP A 118 -4.420 12.544 9.294 1.00 0.00 C ATOM 1863 OD1 ASP A 118 -4.885 12.207 8.184 1.00 0.00 O ATOM 1864 OD2 ASP A 118 -3.438 12.025 9.868 1.00 0.00 O ATOM 0 H ASP A 118 -6.725 11.957 11.324 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.349 13.578 12.025 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -6.092 13.858 9.560 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.538 14.607 9.863 1.00 0.00 H new ATOM 1870 N GLU A 119 -5.973 15.111 13.183 1.00 0.00 N ATOM 1871 CA GLU A 119 -6.812 16.137 13.778 1.00 0.00 C ATOM 1872 C GLU A 119 -6.625 17.467 13.044 1.00 0.00 C ATOM 1873 O GLU A 119 -6.305 18.481 13.662 1.00 0.00 O ATOM 1874 CB GLU A 119 -6.518 16.288 15.271 1.00 0.00 C ATOM 1875 CG GLU A 119 -7.814 16.382 16.079 1.00 0.00 C ATOM 1876 CD GLU A 119 -7.700 17.441 17.177 1.00 0.00 C ATOM 1877 OE1 GLU A 119 -6.610 17.514 17.785 1.00 0.00 O ATOM 1878 OE2 GLU A 119 -8.706 18.154 17.384 1.00 0.00 O ATOM 0 H GLU A 119 -5.146 14.868 13.728 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.853 15.832 13.676 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -5.930 15.438 15.617 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -5.916 17.181 15.438 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.643 16.629 15.416 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -8.040 15.413 16.525 1.00 0.00 H new ATOM 1886 N ASP A 120 -6.833 17.419 11.736 1.00 0.00 N ATOM 1887 CA ASP A 120 -6.692 18.607 10.912 1.00 0.00 C ATOM 1888 C ASP A 120 -7.999 19.401 10.940 1.00 0.00 C ATOM 1889 O ASP A 120 -8.015 20.564 11.341 1.00 0.00 O ATOM 1890 CB ASP A 120 -6.395 18.237 9.458 1.00 0.00 C ATOM 1891 CG ASP A 120 -5.157 18.908 8.859 1.00 0.00 C ATOM 1892 OD1 ASP A 120 -4.419 18.200 8.141 1.00 0.00 O ATOM 1893 OD2 ASP A 120 -4.978 20.115 9.133 1.00 0.00 O ATOM 0 H ASP A 120 -7.098 16.576 11.227 1.00 0.00 H new ATOM 0 HA ASP A 120 -5.866 19.197 11.310 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -6.271 17.156 9.392 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -7.261 18.497 8.849 1.00 0.00 H new ATOM 1899 N LYS A 121 -9.064 18.741 10.510 1.00 0.00 N ATOM 1900 CA LYS A 121 -10.374 19.370 10.481 1.00 0.00 C ATOM 1901 C LYS A 121 -11.301 18.656 11.466 1.00 0.00 C ATOM 1902 O LYS A 121 -12.520 18.801 11.393 1.00 0.00 O ATOM 1903 CB LYS A 121 -10.914 19.416 9.050 1.00 0.00 C ATOM 1904 CG LYS A 121 -11.514 20.788 8.734 1.00 0.00 C ATOM 1905 CD LYS A 121 -10.421 21.853 8.629 1.00 0.00 C ATOM 1906 CE LYS A 121 -10.678 23.000 9.609 1.00 0.00 C ATOM 1907 NZ LYS A 121 -10.740 24.292 8.890 1.00 0.00 N ATOM 0 H LYS A 121 -9.047 17.776 10.179 1.00 0.00 H new ATOM 0 HA LYS A 121 -10.305 20.408 10.805 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -10.111 19.196 8.347 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -11.673 18.644 8.919 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -12.070 20.739 7.798 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -12.224 21.066 9.512 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -9.450 21.404 8.836 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -10.383 22.241 7.611 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -11.613 22.828 10.142 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -9.886 23.031 10.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -10.915 25.059 9.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -9.838 24.461 8.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -11.511 24.265 8.193 1.00 0.00 H new ATOM 1921 N LYS A 122 -10.687 17.899 12.364 1.00 0.00 N ATOM 1922 CA LYS A 122 -11.442 17.162 13.363 1.00 0.00 C ATOM 1923 C LYS A 122 -11.989 15.878 12.736 1.00 0.00 C ATOM 1924 O LYS A 122 -13.113 15.857 12.236 1.00 0.00 O ATOM 1925 CB LYS A 122 -12.520 18.051 13.984 1.00 0.00 C ATOM 1926 CG LYS A 122 -12.379 18.102 15.507 1.00 0.00 C ATOM 1927 CD LYS A 122 -13.426 17.215 16.184 1.00 0.00 C ATOM 1928 CE LYS A 122 -13.278 17.258 17.706 1.00 0.00 C ATOM 1929 NZ LYS A 122 -13.703 18.574 18.232 1.00 0.00 N ATOM 0 H LYS A 122 -9.675 17.780 12.420 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.794 16.864 14.188 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.446 19.058 13.574 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.507 17.671 13.719 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.380 17.775 15.795 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -12.490 19.130 15.852 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -14.426 17.546 15.903 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -13.320 16.188 15.833 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -13.878 16.468 18.158 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -12.241 17.067 17.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -13.742 18.537 19.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.022 19.302 17.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -14.645 18.809 17.859 1.00 0.00 H new ATOM 1943 N GLY A 123 -11.170 14.838 12.783 1.00 0.00 N ATOM 1944 CA GLY A 123 -11.558 13.553 12.226 1.00 0.00 C ATOM 1945 C GLY A 123 -10.333 12.771 11.747 1.00 0.00 C ATOM 1946 O GLY A 123 -9.345 12.655 12.470 1.00 0.00 O ATOM 0 H GLY A 123 -10.239 14.859 13.198 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -12.093 12.973 12.978 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -12.245 13.706 11.393 1.00 0.00 H new ATOM 1950 N HIS A 124 -10.439 12.255 10.531 1.00 0.00 N ATOM 1951 CA HIS A 124 -9.353 11.487 9.947 1.00 0.00 C ATOM 1952 C HIS A 124 -9.558 11.376 8.435 1.00 0.00 C ATOM 1953 O HIS A 124 -10.540 11.887 7.899 1.00 0.00 O ATOM 1954 CB HIS A 124 -9.222 10.124 10.630 1.00 0.00 C ATOM 1955 CG HIS A 124 -10.003 9.022 9.954 1.00 0.00 C ATOM 1956 ND1 HIS A 124 -11.224 8.572 10.425 1.00 0.00 N ATOM 1957 CD2 HIS A 124 -9.724 8.286 8.840 1.00 0.00 C ATOM 1958 CE1 HIS A 124 -11.651 7.607 9.623 1.00 0.00 C ATOM 1959 NE2 HIS A 124 -10.720 7.432 8.642 1.00 0.00 N ATOM 0 H HIS A 124 -11.260 12.354 9.934 1.00 0.00 H new ATOM 0 HA HIS A 124 -8.408 12.003 10.113 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -8.169 9.844 10.660 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -9.558 10.213 11.663 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -8.842 8.382 8.224 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -12.574 7.056 9.728 1.00 0.00 H new ATOM 0 HE2 HIS A 124 -10.780 6.756 7.881 1.00 0.00 H new ATOM 1967 N TRP A 125 -8.616 10.705 7.790 1.00 0.00 N ATOM 1968 CA TRP A 125 -8.681 10.519 6.350 1.00 0.00 C ATOM 1969 C TRP A 125 -8.194 9.104 6.033 1.00 0.00 C ATOM 1970 O TRP A 125 -7.208 8.641 6.604 1.00 0.00 O ATOM 1971 CB TRP A 125 -7.884 11.603 5.621 1.00 0.00 C ATOM 1972 CG TRP A 125 -8.035 13.000 6.227 1.00 0.00 C ATOM 1973 CD1 TRP A 125 -7.566 13.445 7.401 1.00 0.00 C ATOM 1974 CD2 TRP A 125 -8.724 14.123 5.638 1.00 0.00 C ATOM 1975 NE1 TRP A 125 -7.900 14.768 7.611 1.00 0.00 N ATOM 1976 CE2 TRP A 125 -8.627 15.193 6.505 1.00 0.00 C ATOM 1977 CE3 TRP A 125 -9.406 14.232 4.414 1.00 0.00 C ATOM 1978 CZ2 TRP A 125 -9.189 16.447 6.240 1.00 0.00 C ATOM 1979 CZ3 TRP A 125 -9.962 15.492 4.164 1.00 0.00 C ATOM 1980 CH2 TRP A 125 -9.874 16.579 5.025 1.00 0.00 C ATOM 0 H TRP A 125 -7.803 10.283 8.238 1.00 0.00 H new ATOM 0 HA TRP A 125 -9.706 10.622 5.994 1.00 0.00 H new ATOM 0 HB2 TRP A 125 -6.829 11.329 5.625 1.00 0.00 H new ATOM 0 HB3 TRP A 125 -8.201 11.634 4.579 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -6.998 12.844 8.096 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -7.658 15.330 8.427 1.00 0.00 H new ATOM 0 HE3 TRP A 125 -9.494 13.408 3.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -9.099 17.269 6.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 -10.497 15.629 3.236 1.00 0.00 H new ATOM 0 HH2 TRP A 125 -10.331 17.521 4.759 1.00 0.00 H new ATOM 1991 N ASP A 126 -8.908 8.457 5.123 1.00 0.00 N ATOM 1992 CA ASP A 126 -8.560 7.104 4.723 1.00 0.00 C ATOM 1993 C ASP A 126 -7.762 7.152 3.418 1.00 0.00 C ATOM 1994 O ASP A 126 -7.961 8.046 2.597 1.00 0.00 O ATOM 1995 CB ASP A 126 -9.815 6.263 4.480 1.00 0.00 C ATOM 1996 CG ASP A 126 -9.551 4.822 4.038 1.00 0.00 C ATOM 1997 OD1 ASP A 126 -8.927 4.089 4.836 1.00 0.00 O ATOM 1998 OD2 ASP A 126 -9.980 4.485 2.913 1.00 0.00 O ATOM 0 H ASP A 126 -9.725 8.845 4.652 1.00 0.00 H new ATOM 0 HA ASP A 126 -7.974 6.655 5.525 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -10.405 6.244 5.397 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -10.422 6.755 3.720 1.00 0.00 H new ATOM 2004 N HIS A 127 -6.876 6.178 3.268 1.00 0.00 N ATOM 2005 CA HIS A 127 -6.048 6.098 2.077 1.00 0.00 C ATOM 2006 C HIS A 127 -5.517 4.672 1.917 1.00 0.00 C ATOM 2007 O HIS A 127 -4.578 4.274 2.604 1.00 0.00 O ATOM 2008 CB HIS A 127 -4.932 7.144 2.120 1.00 0.00 C ATOM 2009 CG HIS A 127 -5.428 8.567 2.216 1.00 0.00 C ATOM 2010 ND1 HIS A 127 -5.943 9.256 1.132 1.00 0.00 N ATOM 2011 CD2 HIS A 127 -5.483 9.422 3.277 1.00 0.00 C ATOM 2012 CE1 HIS A 127 -6.289 10.470 1.534 1.00 0.00 C ATOM 2013 NE2 HIS A 127 -6.003 10.571 2.863 1.00 0.00 N ATOM 0 H HIS A 127 -6.714 5.438 3.951 1.00 0.00 H new ATOM 0 HA HIS A 127 -6.648 6.327 1.196 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -4.286 6.937 2.973 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -4.319 7.043 1.224 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -5.159 9.202 4.283 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -6.722 11.244 0.917 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -6.162 11.394 3.444 1.00 0.00 H new ATOM 2021 N VAL A 128 -6.142 3.941 1.005 1.00 0.00 N ATOM 2022 CA VAL A 128 -5.745 2.568 0.746 1.00 0.00 C ATOM 2023 C VAL A 128 -4.957 2.508 -0.565 1.00 0.00 C ATOM 2024 O VAL A 128 -4.690 3.539 -1.180 1.00 0.00 O ATOM 2025 CB VAL A 128 -6.975 1.658 0.746 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -8.073 2.222 1.650 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -7.494 1.438 -0.676 1.00 0.00 C ATOM 0 H VAL A 128 -6.921 4.274 0.436 1.00 0.00 H new ATOM 0 HA VAL A 128 -5.089 2.205 1.537 1.00 0.00 H new ATOM 0 HB VAL A 128 -6.676 0.689 1.146 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -8.936 1.557 1.632 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -7.698 2.303 2.670 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -8.368 3.208 1.292 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -8.368 0.788 -0.648 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -7.769 2.397 -1.115 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -6.715 0.972 -1.280 1.00 0.00 H new ATOM 2037 N TRP A 129 -4.608 1.291 -0.953 1.00 0.00 N ATOM 2038 CA TRP A 129 -3.857 1.083 -2.180 1.00 0.00 C ATOM 2039 C TRP A 129 -4.202 -0.307 -2.716 1.00 0.00 C ATOM 2040 O TRP A 129 -4.353 -1.254 -1.945 1.00 0.00 O ATOM 2041 CB TRP A 129 -2.358 1.278 -1.944 1.00 0.00 C ATOM 2042 CG TRP A 129 -1.789 0.418 -0.813 1.00 0.00 C ATOM 2043 CD1 TRP A 129 -1.657 -0.915 -0.777 1.00 0.00 C ATOM 2044 CD2 TRP A 129 -1.277 0.890 0.451 1.00 0.00 C ATOM 2045 NE1 TRP A 129 -1.100 -1.335 0.413 1.00 0.00 N ATOM 2046 CE2 TRP A 129 -0.861 -0.203 1.184 1.00 0.00 C ATOM 2047 CE3 TRP A 129 -1.168 2.196 0.958 1.00 0.00 C ATOM 2048 CZ2 TRP A 129 -0.309 -0.101 2.466 1.00 0.00 C ATOM 2049 CZ3 TRP A 129 -0.614 2.281 2.241 1.00 0.00 C ATOM 2050 CH2 TRP A 129 -0.191 1.191 2.992 1.00 0.00 C ATOM 0 H TRP A 129 -4.831 0.438 -0.440 1.00 0.00 H new ATOM 0 HA TRP A 129 -4.132 1.823 -2.931 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -1.823 1.049 -2.865 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -2.170 2.328 -1.719 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -1.950 -1.577 -1.579 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -0.900 -2.299 0.679 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -1.486 3.065 0.402 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 0.009 -0.972 3.020 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -0.508 3.263 2.678 1.00 0.00 H new ATOM 0 HH2 TRP A 129 0.227 1.340 3.977 1.00 0.00 H new ATOM 2061 N VAL A 130 -4.317 -0.387 -4.034 1.00 0.00 N ATOM 2062 CA VAL A 130 -4.641 -1.646 -4.682 1.00 0.00 C ATOM 2063 C VAL A 130 -3.486 -2.055 -5.599 1.00 0.00 C ATOM 2064 O VAL A 130 -2.979 -1.238 -6.366 1.00 0.00 O ATOM 2065 CB VAL A 130 -5.976 -1.526 -5.419 1.00 0.00 C ATOM 2066 CG1 VAL A 130 -6.355 -2.850 -6.086 1.00 0.00 C ATOM 2067 CG2 VAL A 130 -7.083 -1.051 -4.476 1.00 0.00 C ATOM 0 H VAL A 130 -4.191 0.400 -4.670 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.763 -2.437 -3.942 1.00 0.00 H new ATOM 0 HB VAL A 130 -5.859 -0.777 -6.202 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.308 -2.737 -6.603 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.584 -3.130 -6.804 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.444 -3.627 -5.327 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.021 -0.974 -5.026 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -7.198 -1.765 -3.661 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.820 -0.075 -4.069 1.00 0.00 H new ATOM 2077 N LEU A 131 -3.105 -3.319 -5.489 1.00 0.00 N ATOM 2078 CA LEU A 131 -2.020 -3.846 -6.299 1.00 0.00 C ATOM 2079 C LEU A 131 -2.550 -4.980 -7.179 1.00 0.00 C ATOM 2080 O LEU A 131 -3.446 -5.718 -6.773 1.00 0.00 O ATOM 2081 CB LEU A 131 -0.840 -4.254 -5.414 1.00 0.00 C ATOM 2082 CG LEU A 131 -0.761 -3.574 -4.046 1.00 0.00 C ATOM 2083 CD1 LEU A 131 0.606 -3.801 -3.399 1.00 0.00 C ATOM 2084 CD2 LEU A 131 -1.104 -2.086 -4.153 1.00 0.00 C ATOM 0 H LEU A 131 -3.528 -3.993 -4.851 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.636 -3.076 -6.968 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -0.883 -5.332 -5.260 1.00 0.00 H new ATOM 0 HB3 LEU A 131 0.083 -4.046 -5.955 1.00 0.00 H new ATOM 0 HG LEU A 131 -1.506 -4.031 -3.394 1.00 0.00 H new ATOM 0 HD11 LEU A 131 0.635 -3.307 -2.428 1.00 0.00 H new ATOM 0 HD12 LEU A 131 0.773 -4.870 -3.268 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.385 -3.388 -4.040 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -1.040 -1.626 -3.167 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.400 -1.598 -4.827 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -2.116 -1.973 -4.541 1.00 0.00 H new ATOM 2096 N SER A 132 -1.973 -5.083 -8.367 1.00 0.00 N ATOM 2097 CA SER A 132 -2.377 -6.114 -9.308 1.00 0.00 C ATOM 2098 C SER A 132 -1.190 -6.514 -10.187 1.00 0.00 C ATOM 2099 O SER A 132 -0.239 -5.748 -10.339 1.00 0.00 O ATOM 2100 CB SER A 132 -3.544 -5.642 -10.176 1.00 0.00 C ATOM 2101 OG SER A 132 -3.847 -6.570 -11.215 1.00 0.00 O ATOM 0 H SER A 132 -1.229 -4.470 -8.700 1.00 0.00 H new ATOM 0 HA SER A 132 -2.710 -6.983 -8.740 1.00 0.00 H new ATOM 0 HB2 SER A 132 -4.425 -5.497 -9.551 1.00 0.00 H new ATOM 0 HB3 SER A 132 -3.301 -4.674 -10.614 1.00 0.00 H new ATOM 0 HG SER A 132 -4.212 -6.089 -11.987 1.00 0.00 H new ATOM 2107 N ARG A 133 -1.283 -7.713 -10.742 1.00 0.00 N ATOM 2108 CA ARG A 133 -0.229 -8.224 -11.602 1.00 0.00 C ATOM 2109 C ARG A 133 0.188 -7.160 -12.620 1.00 0.00 C ATOM 2110 O ARG A 133 1.333 -7.142 -13.069 1.00 0.00 O ATOM 2111 CB ARG A 133 -0.685 -9.481 -12.346 1.00 0.00 C ATOM 2112 CG ARG A 133 0.480 -10.452 -12.547 1.00 0.00 C ATOM 2113 CD ARG A 133 1.201 -10.177 -13.868 1.00 0.00 C ATOM 2114 NE ARG A 133 2.666 -10.209 -13.660 1.00 0.00 N ATOM 2115 CZ ARG A 133 3.552 -10.547 -14.607 1.00 0.00 C ATOM 2116 NH1 ARG A 133 3.127 -10.884 -15.832 1.00 0.00 N ATOM 2117 NH2 ARG A 133 4.863 -10.548 -14.329 1.00 0.00 N ATOM 0 H ARG A 133 -2.072 -8.346 -10.613 1.00 0.00 H new ATOM 0 HA ARG A 133 0.621 -8.479 -10.969 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -1.480 -9.972 -11.784 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -1.103 -9.204 -13.314 1.00 0.00 H new ATOM 0 HG2 ARG A 133 1.183 -10.359 -11.719 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.110 -11.477 -12.537 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.914 -10.922 -14.610 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.902 -9.205 -14.260 1.00 0.00 H new ATOM 0 HE ARG A 133 3.024 -9.958 -12.738 1.00 0.00 H new ATOM 0 HH11 ARG A 133 2.129 -10.883 -16.044 1.00 0.00 H new ATOM 0 HH12 ARG A 133 3.801 -11.141 -16.553 1.00 0.00 H new ATOM 0 HH21 ARG A 133 5.187 -10.291 -13.396 1.00 0.00 H new ATOM 0 HH22 ARG A 133 5.537 -10.805 -15.050 1.00 0.00 H new ATOM 2131 N SER A 134 -0.763 -6.301 -12.953 1.00 0.00 N ATOM 2132 CA SER A 134 -0.509 -5.237 -13.909 1.00 0.00 C ATOM 2133 C SER A 134 -1.102 -3.922 -13.399 1.00 0.00 C ATOM 2134 O SER A 134 -1.783 -3.900 -12.375 1.00 0.00 O ATOM 2135 CB SER A 134 -1.086 -5.581 -15.283 1.00 0.00 C ATOM 2136 OG SER A 134 -1.485 -6.947 -15.368 1.00 0.00 O ATOM 0 H SER A 134 -1.711 -6.320 -12.578 1.00 0.00 H new ATOM 0 HA SER A 134 0.570 -5.125 -14.016 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.943 -4.940 -15.487 1.00 0.00 H new ATOM 0 HB3 SER A 134 -0.342 -5.372 -16.051 1.00 0.00 H new ATOM 0 HG SER A 134 -1.850 -7.126 -16.260 1.00 0.00 H new ATOM 2142 N MET A 135 -0.820 -2.857 -14.136 1.00 0.00 N ATOM 2143 CA MET A 135 -1.317 -1.542 -13.771 1.00 0.00 C ATOM 2144 C MET A 135 -2.845 -1.495 -13.835 1.00 0.00 C ATOM 2145 O MET A 135 -3.469 -0.624 -13.231 1.00 0.00 O ATOM 2146 CB MET A 135 -0.734 -0.494 -14.721 1.00 0.00 C ATOM 2147 CG MET A 135 -1.207 -0.732 -16.156 1.00 0.00 C ATOM 2148 SD MET A 135 -0.832 0.691 -17.167 1.00 0.00 S ATOM 2149 CE MET A 135 0.480 0.018 -18.173 1.00 0.00 C ATOM 0 H MET A 135 -0.254 -2.879 -14.984 1.00 0.00 H new ATOM 0 HA MET A 135 -1.009 -1.330 -12.747 1.00 0.00 H new ATOM 0 HB2 MET A 135 -1.033 0.503 -14.396 1.00 0.00 H new ATOM 0 HB3 MET A 135 0.355 -0.529 -14.683 1.00 0.00 H new ATOM 0 HG2 MET A 135 -0.721 -1.618 -16.566 1.00 0.00 H new ATOM 0 HG3 MET A 135 -2.280 -0.923 -16.167 1.00 0.00 H new ATOM 0 HE1 MET A 135 0.834 0.780 -18.867 1.00 0.00 H new ATOM 0 HE2 MET A 135 1.303 -0.300 -17.533 1.00 0.00 H new ATOM 0 HE3 MET A 135 0.105 -0.838 -18.734 1.00 0.00 H new ATOM 2159 N VAL A 136 -3.404 -2.444 -14.571 1.00 0.00 N ATOM 2160 CA VAL A 136 -4.847 -2.523 -14.722 1.00 0.00 C ATOM 2161 C VAL A 136 -5.332 -3.892 -14.242 1.00 0.00 C ATOM 2162 O VAL A 136 -4.683 -4.907 -14.492 1.00 0.00 O ATOM 2163 CB VAL A 136 -5.239 -2.225 -16.171 1.00 0.00 C ATOM 2164 CG1 VAL A 136 -6.275 -3.230 -16.676 1.00 0.00 C ATOM 2165 CG2 VAL A 136 -5.750 -0.790 -16.316 1.00 0.00 C ATOM 0 H VAL A 136 -2.883 -3.165 -15.070 1.00 0.00 H new ATOM 0 HA VAL A 136 -5.337 -1.770 -14.105 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.346 -2.327 -16.788 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.536 -2.996 -17.708 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -5.860 -4.237 -16.626 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.168 -3.175 -16.054 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -6.022 -0.604 -17.355 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -6.625 -0.649 -15.681 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -4.968 -0.093 -16.015 1.00 0.00 H new ATOM 2175 N LEU A 137 -6.468 -3.876 -13.560 1.00 0.00 N ATOM 2176 CA LEU A 137 -7.047 -5.104 -13.042 1.00 0.00 C ATOM 2177 C LEU A 137 -7.617 -5.923 -14.202 1.00 0.00 C ATOM 2178 O LEU A 137 -8.144 -5.363 -15.162 1.00 0.00 O ATOM 2179 CB LEU A 137 -8.070 -4.794 -11.947 1.00 0.00 C ATOM 2180 CG LEU A 137 -7.584 -4.969 -10.507 1.00 0.00 C ATOM 2181 CD1 LEU A 137 -8.398 -4.101 -9.545 1.00 0.00 C ATOM 2182 CD2 LEU A 137 -7.596 -6.443 -10.099 1.00 0.00 C ATOM 0 H LEU A 137 -7.003 -3.032 -13.354 1.00 0.00 H new ATOM 0 HA LEU A 137 -6.280 -5.715 -12.566 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -8.407 -3.765 -12.073 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -8.939 -5.435 -12.097 1.00 0.00 H new ATOM 0 HG LEU A 137 -6.550 -4.629 -10.452 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -8.033 -4.244 -8.528 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -8.294 -3.053 -9.824 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -9.448 -4.387 -9.597 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -7.246 -6.539 -9.071 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -8.611 -6.833 -10.175 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -6.940 -7.009 -10.760 1.00 0.00 H new ATOM 2194 N THR A 138 -7.492 -7.236 -14.075 1.00 0.00 N ATOM 2195 CA THR A 138 -7.988 -8.138 -15.101 1.00 0.00 C ATOM 2196 C THR A 138 -8.308 -9.507 -14.498 1.00 0.00 C ATOM 2197 O THR A 138 -8.272 -9.677 -13.280 1.00 0.00 O ATOM 2198 CB THR A 138 -6.950 -8.195 -16.223 1.00 0.00 C ATOM 2199 OG1 THR A 138 -6.012 -9.172 -15.779 1.00 0.00 O ATOM 2200 CG2 THR A 138 -6.127 -6.909 -16.325 1.00 0.00 C ATOM 0 H THR A 138 -7.054 -7.697 -13.277 1.00 0.00 H new ATOM 0 HA THR A 138 -8.925 -7.778 -15.525 1.00 0.00 H new ATOM 0 HB THR A 138 -7.452 -8.382 -17.172 1.00 0.00 H new ATOM 0 HG1 THR A 138 -5.304 -9.274 -16.449 1.00 0.00 H new ATOM 0 HG21 THR A 138 -5.405 -7.002 -17.137 1.00 0.00 H new ATOM 0 HG22 THR A 138 -6.790 -6.067 -16.524 1.00 0.00 H new ATOM 0 HG23 THR A 138 -5.598 -6.740 -15.387 1.00 0.00 H new ATOM 2208 N GLY A 139 -8.613 -10.449 -15.379 1.00 0.00 N ATOM 2209 CA GLY A 139 -8.938 -11.798 -14.949 1.00 0.00 C ATOM 2210 C GLY A 139 -9.687 -11.783 -13.615 1.00 0.00 C ATOM 2211 O GLY A 139 -10.381 -10.817 -13.299 1.00 0.00 O ATOM 0 H GLY A 139 -8.642 -10.304 -16.388 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -9.549 -12.288 -15.707 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.023 -12.382 -14.850 1.00 0.00 H new ATOM 2215 N GLU A 140 -9.522 -12.864 -12.867 1.00 0.00 N ATOM 2216 CA GLU A 140 -10.174 -12.987 -11.575 1.00 0.00 C ATOM 2217 C GLU A 140 -9.891 -11.752 -10.718 1.00 0.00 C ATOM 2218 O GLU A 140 -10.672 -11.417 -9.829 1.00 0.00 O ATOM 2219 CB GLU A 140 -9.734 -14.265 -10.858 1.00 0.00 C ATOM 2220 CG GLU A 140 -10.514 -14.460 -9.556 1.00 0.00 C ATOM 2221 CD GLU A 140 -11.123 -15.862 -9.487 1.00 0.00 C ATOM 2222 OE1 GLU A 140 -11.663 -16.298 -10.527 1.00 0.00 O ATOM 2223 OE2 GLU A 140 -11.036 -16.466 -8.396 1.00 0.00 O ATOM 0 H GLU A 140 -8.946 -13.663 -13.132 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.250 -13.053 -11.738 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -9.889 -15.124 -11.511 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -8.667 -14.216 -10.643 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -9.852 -14.305 -8.704 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -11.304 -13.712 -9.486 1.00 0.00 H new ATOM 2231 N ALA A 141 -8.771 -11.109 -11.015 1.00 0.00 N ATOM 2232 CA ALA A 141 -8.375 -9.918 -10.283 1.00 0.00 C ATOM 2233 C ALA A 141 -9.525 -8.909 -10.298 1.00 0.00 C ATOM 2234 O ALA A 141 -9.811 -8.272 -9.285 1.00 0.00 O ATOM 2235 CB ALA A 141 -7.092 -9.348 -10.890 1.00 0.00 C ATOM 0 H ALA A 141 -8.125 -11.391 -11.753 1.00 0.00 H new ATOM 0 HA ALA A 141 -8.163 -10.161 -9.242 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -6.795 -8.455 -10.341 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -6.298 -10.092 -10.828 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -7.267 -9.090 -11.935 1.00 0.00 H new ATOM 2241 N LYS A 142 -10.155 -8.796 -11.458 1.00 0.00 N ATOM 2242 CA LYS A 142 -11.268 -7.875 -11.619 1.00 0.00 C ATOM 2243 C LYS A 142 -12.446 -8.353 -10.768 1.00 0.00 C ATOM 2244 O LYS A 142 -13.130 -7.546 -10.139 1.00 0.00 O ATOM 2245 CB LYS A 142 -11.609 -7.701 -13.100 1.00 0.00 C ATOM 2246 CG LYS A 142 -10.926 -6.460 -13.678 1.00 0.00 C ATOM 2247 CD LYS A 142 -11.805 -5.792 -14.737 1.00 0.00 C ATOM 2248 CE LYS A 142 -12.254 -4.403 -14.281 1.00 0.00 C ATOM 2249 NZ LYS A 142 -12.816 -3.641 -15.419 1.00 0.00 N ATOM 0 H LYS A 142 -9.916 -9.327 -12.296 1.00 0.00 H new ATOM 0 HA LYS A 142 -10.997 -6.882 -11.260 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -11.295 -8.585 -13.655 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -12.689 -7.615 -13.221 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -10.714 -5.752 -12.877 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -9.969 -6.739 -14.119 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -11.253 -5.710 -15.674 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -12.678 -6.414 -14.935 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -13.002 -4.496 -13.493 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -11.409 -3.862 -13.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -13.116 -2.700 -15.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -12.092 -3.536 -16.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -13.635 -4.150 -15.807 1.00 0.00 H new ATOM 2263 N THR A 143 -12.648 -9.662 -10.776 1.00 0.00 N ATOM 2264 CA THR A 143 -13.732 -10.257 -10.013 1.00 0.00 C ATOM 2265 C THR A 143 -13.537 -9.998 -8.518 1.00 0.00 C ATOM 2266 O THR A 143 -14.465 -9.571 -7.832 1.00 0.00 O ATOM 2267 CB THR A 143 -13.800 -11.744 -10.368 1.00 0.00 C ATOM 2268 OG1 THR A 143 -14.014 -11.755 -11.777 1.00 0.00 O ATOM 2269 CG2 THR A 143 -15.045 -12.426 -9.798 1.00 0.00 C ATOM 0 H THR A 143 -12.079 -10.328 -11.299 1.00 0.00 H new ATOM 0 HA THR A 143 -14.690 -9.803 -10.267 1.00 0.00 H new ATOM 0 HB THR A 143 -12.908 -12.247 -9.995 1.00 0.00 H new ATOM 0 HG1 THR A 143 -14.069 -12.681 -12.092 1.00 0.00 H new ATOM 0 HG21 THR A 143 -15.044 -13.479 -10.079 1.00 0.00 H new ATOM 0 HG22 THR A 143 -15.041 -12.341 -8.711 1.00 0.00 H new ATOM 0 HG23 THR A 143 -15.938 -11.945 -10.197 1.00 0.00 H new ATOM 2277 N ALA A 144 -12.324 -10.266 -8.057 1.00 0.00 N ATOM 2278 CA ALA A 144 -11.995 -10.067 -6.656 1.00 0.00 C ATOM 2279 C ALA A 144 -12.319 -8.625 -6.260 1.00 0.00 C ATOM 2280 O ALA A 144 -12.913 -8.384 -5.211 1.00 0.00 O ATOM 2281 CB ALA A 144 -10.525 -10.421 -6.421 1.00 0.00 C ATOM 0 H ALA A 144 -11.557 -10.619 -8.629 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.593 -10.724 -6.024 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -10.278 -10.272 -5.370 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -10.354 -11.464 -6.689 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -9.894 -9.780 -7.036 1.00 0.00 H new ATOM 2287 N VAL A 145 -11.913 -7.704 -7.122 1.00 0.00 N ATOM 2288 CA VAL A 145 -12.152 -6.292 -6.875 1.00 0.00 C ATOM 2289 C VAL A 145 -13.640 -5.991 -7.065 1.00 0.00 C ATOM 2290 O VAL A 145 -14.232 -5.252 -6.279 1.00 0.00 O ATOM 2291 CB VAL A 145 -11.251 -5.444 -7.775 1.00 0.00 C ATOM 2292 CG1 VAL A 145 -12.082 -4.582 -8.728 1.00 0.00 C ATOM 2293 CG2 VAL A 145 -10.301 -4.581 -6.943 1.00 0.00 C ATOM 0 H VAL A 145 -11.420 -7.908 -7.992 1.00 0.00 H new ATOM 0 HA VAL A 145 -11.897 -6.035 -5.847 1.00 0.00 H new ATOM 0 HB VAL A 145 -10.647 -6.122 -8.378 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -11.417 -3.989 -9.356 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -12.698 -5.225 -9.357 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -12.724 -3.917 -8.151 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -9.672 -3.988 -7.607 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -10.880 -3.916 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -9.673 -5.223 -6.325 1.00 0.00 H new ATOM 2303 N GLU A 146 -14.201 -6.577 -8.112 1.00 0.00 N ATOM 2304 CA GLU A 146 -15.609 -6.381 -8.414 1.00 0.00 C ATOM 2305 C GLU A 146 -16.474 -6.854 -7.245 1.00 0.00 C ATOM 2306 O GLU A 146 -17.259 -6.082 -6.696 1.00 0.00 O ATOM 2307 CB GLU A 146 -15.997 -7.098 -9.709 1.00 0.00 C ATOM 2308 CG GLU A 146 -15.730 -6.212 -10.927 1.00 0.00 C ATOM 2309 CD GLU A 146 -16.901 -5.260 -11.180 1.00 0.00 C ATOM 2310 OE1 GLU A 146 -17.218 -4.491 -10.247 1.00 0.00 O ATOM 2311 OE2 GLU A 146 -17.452 -5.323 -12.300 1.00 0.00 O ATOM 0 H GLU A 146 -13.706 -7.188 -8.762 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.784 -5.315 -8.561 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.432 -8.026 -9.799 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -17.052 -7.369 -9.677 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.817 -5.638 -10.770 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.567 -6.836 -11.806 1.00 0.00 H new ATOM 2319 N ASN A 147 -16.303 -8.121 -6.898 1.00 0.00 N ATOM 2320 CA ASN A 147 -17.058 -8.707 -5.804 1.00 0.00 C ATOM 2321 C ASN A 147 -16.906 -7.831 -4.559 1.00 0.00 C ATOM 2322 O ASN A 147 -17.899 -7.417 -3.962 1.00 0.00 O ATOM 2323 CB ASN A 147 -16.540 -10.106 -5.463 1.00 0.00 C ATOM 2324 CG ASN A 147 -17.639 -11.155 -5.641 1.00 0.00 C ATOM 2325 OD1 ASN A 147 -18.808 -10.917 -5.389 1.00 0.00 O ATOM 2326 ND2 ASN A 147 -17.199 -12.328 -6.090 1.00 0.00 N ATOM 0 H ASN A 147 -15.652 -8.759 -7.356 1.00 0.00 H new ATOM 0 HA ASN A 147 -18.101 -8.774 -6.113 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -15.692 -10.350 -6.103 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -16.179 -10.123 -4.435 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -17.855 -13.094 -6.243 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -16.206 -12.461 -6.281 1.00 0.00 H new ATOM 2333 N TYR A 148 -15.656 -7.574 -4.204 1.00 0.00 N ATOM 2334 CA TYR A 148 -15.362 -6.754 -3.041 1.00 0.00 C ATOM 2335 C TYR A 148 -16.034 -5.384 -3.151 1.00 0.00 C ATOM 2336 O TYR A 148 -16.715 -4.946 -2.224 1.00 0.00 O ATOM 2337 CB TYR A 148 -13.844 -6.564 -3.032 1.00 0.00 C ATOM 2338 CG TYR A 148 -13.375 -5.335 -2.251 1.00 0.00 C ATOM 2339 CD1 TYR A 148 -13.526 -5.288 -0.880 1.00 0.00 C ATOM 2340 CD2 TYR A 148 -12.800 -4.272 -2.919 1.00 0.00 C ATOM 2341 CE1 TYR A 148 -13.085 -4.131 -0.146 1.00 0.00 C ATOM 2342 CE2 TYR A 148 -12.359 -3.115 -2.184 1.00 0.00 C ATOM 2343 CZ TYR A 148 -12.523 -3.101 -0.834 1.00 0.00 C ATOM 2344 OH TYR A 148 -12.106 -2.008 -0.140 1.00 0.00 O ATOM 0 H TYR A 148 -14.835 -7.919 -4.701 1.00 0.00 H new ATOM 0 HA TYR A 148 -15.730 -7.231 -2.133 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -13.380 -7.452 -2.604 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -13.492 -6.484 -4.061 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -13.975 -6.120 -0.358 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -12.681 -4.308 -3.992 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -13.198 -4.082 0.927 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -11.908 -2.277 -2.694 1.00 0.00 H new ATOM 0 HH TYR A 148 -11.187 -1.788 -0.398 1.00 0.00 H new ATOM 2354 N LEU A 149 -15.820 -4.745 -4.292 1.00 0.00 N ATOM 2355 CA LEU A 149 -16.397 -3.434 -4.535 1.00 0.00 C ATOM 2356 C LEU A 149 -17.914 -3.507 -4.351 1.00 0.00 C ATOM 2357 O LEU A 149 -18.480 -2.779 -3.537 1.00 0.00 O ATOM 2358 CB LEU A 149 -15.968 -2.906 -5.905 1.00 0.00 C ATOM 2359 CG LEU A 149 -14.543 -2.355 -5.996 1.00 0.00 C ATOM 2360 CD1 LEU A 149 -14.178 -2.015 -7.442 1.00 0.00 C ATOM 2361 CD2 LEU A 149 -14.358 -1.158 -5.061 1.00 0.00 C ATOM 0 H LEU A 149 -15.255 -5.111 -5.058 1.00 0.00 H new ATOM 0 HA LEU A 149 -16.022 -2.712 -3.809 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -16.072 -3.712 -6.632 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -16.660 -2.118 -6.202 1.00 0.00 H new ATOM 0 HG LEU A 149 -13.854 -3.132 -5.665 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -13.161 -1.626 -7.479 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -14.245 -2.914 -8.055 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.868 -1.263 -7.824 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -13.337 -0.785 -5.145 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -15.056 -0.368 -5.338 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -14.548 -1.466 -4.033 1.00 0.00 H new ATOM 2373 N ILE A 150 -18.529 -4.392 -5.122 1.00 0.00 N ATOM 2374 CA ILE A 150 -19.970 -4.570 -5.054 1.00 0.00 C ATOM 2375 C ILE A 150 -20.421 -4.492 -3.595 1.00 0.00 C ATOM 2376 O ILE A 150 -21.356 -3.763 -3.268 1.00 0.00 O ATOM 2377 CB ILE A 150 -20.384 -5.864 -5.758 1.00 0.00 C ATOM 2378 CG1 ILE A 150 -20.174 -5.757 -7.270 1.00 0.00 C ATOM 2379 CG2 ILE A 150 -21.822 -6.245 -5.404 1.00 0.00 C ATOM 2380 CD1 ILE A 150 -20.370 -7.114 -7.948 1.00 0.00 C ATOM 0 H ILE A 150 -18.056 -4.993 -5.797 1.00 0.00 H new ATOM 0 HA ILE A 150 -20.479 -3.767 -5.588 1.00 0.00 H new ATOM 0 HB ILE A 150 -19.741 -6.668 -5.400 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -20.874 -5.033 -7.688 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -19.170 -5.385 -7.476 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -22.091 -7.168 -5.918 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -21.905 -6.392 -4.327 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -22.497 -5.447 -5.715 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -20.215 -7.010 -9.022 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -19.652 -7.829 -7.545 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -21.382 -7.472 -7.760 1.00 0.00 H new ATOM 2392 N GLY A 151 -19.736 -5.255 -2.755 1.00 0.00 N ATOM 2393 CA GLY A 151 -20.054 -5.282 -1.338 1.00 0.00 C ATOM 2394 C GLY A 151 -19.123 -4.359 -0.549 1.00 0.00 C ATOM 2395 O GLY A 151 -18.673 -4.709 0.540 1.00 0.00 O ATOM 0 H GLY A 151 -18.962 -5.859 -3.030 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -21.089 -4.975 -1.188 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -19.966 -6.301 -0.961 1.00 0.00 H new ATOM 2399 N SER A 152 -18.863 -3.196 -1.130 1.00 0.00 N ATOM 2400 CA SER A 152 -17.994 -2.220 -0.495 1.00 0.00 C ATOM 2401 C SER A 152 -18.673 -1.647 0.750 1.00 0.00 C ATOM 2402 O SER A 152 -19.680 -0.948 0.647 1.00 0.00 O ATOM 2403 CB SER A 152 -17.627 -1.096 -1.465 1.00 0.00 C ATOM 2404 OG SER A 152 -18.712 -0.758 -2.325 1.00 0.00 O ATOM 0 H SER A 152 -19.239 -2.908 -2.033 1.00 0.00 H new ATOM 0 HA SER A 152 -17.073 -2.723 -0.200 1.00 0.00 H new ATOM 0 HB2 SER A 152 -17.324 -0.214 -0.900 1.00 0.00 H new ATOM 0 HB3 SER A 152 -16.770 -1.401 -2.065 1.00 0.00 H new ATOM 0 HG SER A 152 -18.618 -1.238 -3.174 1.00 0.00 H new ATOM 2410 N PRO A 153 -18.079 -1.972 1.930 1.00 0.00 N ATOM 2411 CA PRO A 153 -18.616 -1.496 3.194 1.00 0.00 C ATOM 2412 C PRO A 153 -18.298 -0.014 3.402 1.00 0.00 C ATOM 2413 O PRO A 153 -18.927 0.649 4.225 1.00 0.00 O ATOM 2414 CB PRO A 153 -17.989 -2.392 4.249 1.00 0.00 C ATOM 2415 CG PRO A 153 -16.776 -3.028 3.590 1.00 0.00 C ATOM 2416 CD PRO A 153 -16.885 -2.797 2.091 1.00 0.00 C ATOM 0 HA PRO A 153 -19.704 -1.553 3.237 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -17.699 -1.816 5.128 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.694 -3.152 4.585 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -15.857 -2.589 3.978 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -16.738 -4.095 3.810 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -16.000 -2.293 1.702 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -16.979 -3.739 1.551 1.00 0.00 H new ATOM 2424 N VAL A 154 -17.323 0.461 2.642 1.00 0.00 N ATOM 2425 CA VAL A 154 -16.914 1.853 2.732 1.00 0.00 C ATOM 2426 C VAL A 154 -16.134 2.234 1.473 1.00 0.00 C ATOM 2427 O VAL A 154 -16.320 3.320 0.927 1.00 0.00 O ATOM 2428 CB VAL A 154 -16.120 2.082 4.020 1.00 0.00 C ATOM 2429 CG1 VAL A 154 -17.045 2.107 5.238 1.00 0.00 C ATOM 2430 CG2 VAL A 154 -15.026 1.025 4.185 1.00 0.00 C ATOM 0 H VAL A 154 -16.804 -0.093 1.961 1.00 0.00 H new ATOM 0 HA VAL A 154 -17.786 2.505 2.783 1.00 0.00 H new ATOM 0 HB VAL A 154 -15.637 3.056 3.946 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -16.455 2.271 6.140 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -17.771 2.913 5.127 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -17.570 1.155 5.316 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -14.477 1.211 5.108 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -15.480 0.035 4.226 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -14.341 1.075 3.339 1.00 0.00 H new ATOM 2440 N VAL A 155 -15.276 1.318 1.047 1.00 0.00 N ATOM 2441 CA VAL A 155 -14.466 1.544 -0.138 1.00 0.00 C ATOM 2442 C VAL A 155 -15.376 1.934 -1.305 1.00 0.00 C ATOM 2443 O VAL A 155 -15.908 1.067 -1.997 1.00 0.00 O ATOM 2444 CB VAL A 155 -13.612 0.309 -0.432 1.00 0.00 C ATOM 2445 CG1 VAL A 155 -14.453 -0.967 -0.368 1.00 0.00 C ATOM 2446 CG2 VAL A 155 -12.911 0.437 -1.786 1.00 0.00 C ATOM 0 H VAL A 155 -15.124 0.418 1.502 1.00 0.00 H new ATOM 0 HA VAL A 155 -13.773 2.370 0.024 1.00 0.00 H new ATOM 0 HB VAL A 155 -12.843 0.242 0.338 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -13.822 -1.830 -0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -14.884 -1.069 0.628 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -15.254 -0.912 -1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -12.311 -0.454 -1.971 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -13.657 0.541 -2.574 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -12.265 1.315 -1.780 1.00 0.00 H new ATOM 2456 N ASP A 156 -15.526 3.237 -1.487 1.00 0.00 N ATOM 2457 CA ASP A 156 -16.363 3.752 -2.558 1.00 0.00 C ATOM 2458 C ASP A 156 -15.604 3.654 -3.883 1.00 0.00 C ATOM 2459 O ASP A 156 -14.611 4.351 -4.087 1.00 0.00 O ATOM 2460 CB ASP A 156 -16.716 5.222 -2.323 1.00 0.00 C ATOM 2461 CG ASP A 156 -15.626 6.048 -1.639 1.00 0.00 C ATOM 2462 OD1 ASP A 156 -15.968 6.732 -0.651 1.00 0.00 O ATOM 2463 OD2 ASP A 156 -14.474 5.977 -2.120 1.00 0.00 O ATOM 0 H ASP A 156 -15.082 3.952 -0.911 1.00 0.00 H new ATOM 0 HA ASP A 156 -17.279 3.161 -2.585 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -16.950 5.682 -3.283 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -17.621 5.270 -1.717 1.00 0.00 H new ATOM 2469 N SER A 157 -16.100 2.783 -4.750 1.00 0.00 N ATOM 2470 CA SER A 157 -15.482 2.585 -6.049 1.00 0.00 C ATOM 2471 C SER A 157 -15.651 3.842 -6.906 1.00 0.00 C ATOM 2472 O SER A 157 -14.703 4.291 -7.548 1.00 0.00 O ATOM 2473 CB SER A 157 -16.079 1.371 -6.764 1.00 0.00 C ATOM 2474 OG SER A 157 -17.260 1.705 -7.488 1.00 0.00 O ATOM 0 H SER A 157 -16.923 2.206 -4.577 1.00 0.00 H new ATOM 0 HA SER A 157 -14.419 2.397 -5.897 1.00 0.00 H new ATOM 0 HB2 SER A 157 -15.340 0.954 -7.448 1.00 0.00 H new ATOM 0 HB3 SER A 157 -16.309 0.596 -6.032 1.00 0.00 H new ATOM 0 HG SER A 157 -17.609 0.904 -7.931 1.00 0.00 H new ATOM 2480 N GLN A 158 -16.864 4.373 -6.888 1.00 0.00 N ATOM 2481 CA GLN A 158 -17.169 5.568 -7.656 1.00 0.00 C ATOM 2482 C GLN A 158 -16.161 6.674 -7.339 1.00 0.00 C ATOM 2483 O GLN A 158 -15.808 7.466 -8.211 1.00 0.00 O ATOM 2484 CB GLN A 158 -18.601 6.039 -7.391 1.00 0.00 C ATOM 2485 CG GLN A 158 -19.569 5.457 -8.422 1.00 0.00 C ATOM 2486 CD GLN A 158 -20.787 6.366 -8.604 1.00 0.00 C ATOM 2487 OE1 GLN A 158 -20.887 7.436 -8.028 1.00 0.00 O ATOM 2488 NE2 GLN A 158 -21.704 5.880 -9.436 1.00 0.00 N ATOM 0 H GLN A 158 -17.648 3.998 -6.354 1.00 0.00 H new ATOM 0 HA GLN A 158 -17.091 5.325 -8.716 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -18.907 5.738 -6.389 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -18.641 7.128 -7.423 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -19.058 5.332 -9.377 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -19.894 4.467 -8.103 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -21.557 4.976 -9.885 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -22.554 6.411 -9.625 1.00 0.00 H new ATOM 2497 N LYS A 159 -15.724 6.692 -6.088 1.00 0.00 N ATOM 2498 CA LYS A 159 -14.763 7.688 -5.645 1.00 0.00 C ATOM 2499 C LYS A 159 -13.351 7.222 -6.005 1.00 0.00 C ATOM 2500 O LYS A 159 -12.517 8.024 -6.424 1.00 0.00 O ATOM 2501 CB LYS A 159 -14.951 7.989 -4.157 1.00 0.00 C ATOM 2502 CG LYS A 159 -15.598 9.361 -3.952 1.00 0.00 C ATOM 2503 CD LYS A 159 -16.794 9.267 -3.003 1.00 0.00 C ATOM 2504 CE LYS A 159 -17.946 8.493 -3.647 1.00 0.00 C ATOM 2505 NZ LYS A 159 -19.206 9.263 -3.548 1.00 0.00 N ATOM 0 H LYS A 159 -16.018 6.033 -5.367 1.00 0.00 H new ATOM 0 HA LYS A 159 -14.928 8.634 -6.161 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -15.573 7.218 -3.702 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -13.986 7.959 -3.652 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -14.863 10.057 -3.548 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -15.922 9.761 -4.913 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -16.492 8.774 -2.079 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -17.129 10.269 -2.735 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -17.717 8.292 -4.694 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -18.063 7.527 -3.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -19.978 8.724 -3.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -19.431 9.433 -2.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -19.096 10.174 -4.038 1.00 0.00 H new ATOM 2519 N LEU A 160 -13.126 5.929 -5.828 1.00 0.00 N ATOM 2520 CA LEU A 160 -11.829 5.347 -6.128 1.00 0.00 C ATOM 2521 C LEU A 160 -11.355 5.847 -7.494 1.00 0.00 C ATOM 2522 O LEU A 160 -12.109 6.494 -8.219 1.00 0.00 O ATOM 2523 CB LEU A 160 -11.887 3.822 -6.018 1.00 0.00 C ATOM 2524 CG LEU A 160 -11.640 3.241 -4.624 1.00 0.00 C ATOM 2525 CD1 LEU A 160 -12.487 1.987 -4.395 1.00 0.00 C ATOM 2526 CD2 LEU A 160 -10.150 2.975 -4.397 1.00 0.00 C ATOM 0 H LEU A 160 -13.820 5.267 -5.480 1.00 0.00 H new ATOM 0 HA LEU A 160 -11.089 5.668 -5.395 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -12.867 3.490 -6.360 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -11.151 3.400 -6.702 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.952 3.980 -3.886 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -12.293 1.594 -3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -13.543 2.240 -4.486 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -12.229 1.233 -5.139 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -10.002 2.562 -3.399 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -9.790 2.264 -5.141 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -9.595 3.909 -4.489 1.00 0.00 H new ATOM 2538 N VAL A 161 -10.107 5.528 -7.805 1.00 0.00 N ATOM 2539 CA VAL A 161 -9.523 5.936 -9.072 1.00 0.00 C ATOM 2540 C VAL A 161 -8.565 4.848 -9.562 1.00 0.00 C ATOM 2541 O VAL A 161 -7.903 4.192 -8.759 1.00 0.00 O ATOM 2542 CB VAL A 161 -8.850 7.302 -8.921 1.00 0.00 C ATOM 2543 CG1 VAL A 161 -7.825 7.534 -10.033 1.00 0.00 C ATOM 2544 CG2 VAL A 161 -9.888 8.425 -8.890 1.00 0.00 C ATOM 0 H VAL A 161 -9.484 4.992 -7.201 1.00 0.00 H new ATOM 0 HA VAL A 161 -10.297 6.052 -9.830 1.00 0.00 H new ATOM 0 HB VAL A 161 -8.320 7.310 -7.969 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -7.361 8.512 -9.902 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -7.059 6.760 -9.989 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -8.324 7.496 -11.001 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -9.383 9.385 -8.782 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -10.459 8.418 -9.818 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -10.563 8.274 -8.048 1.00 0.00 H new ATOM 2554 N TYR A 162 -8.523 4.691 -10.876 1.00 0.00 N ATOM 2555 CA TYR A 162 -7.657 3.693 -11.483 1.00 0.00 C ATOM 2556 C TYR A 162 -6.384 4.336 -12.037 1.00 0.00 C ATOM 2557 O TYR A 162 -6.331 5.550 -12.231 1.00 0.00 O ATOM 2558 CB TYR A 162 -8.455 3.090 -12.641 1.00 0.00 C ATOM 2559 CG TYR A 162 -9.070 1.724 -12.328 1.00 0.00 C ATOM 2560 CD1 TYR A 162 -8.341 0.573 -12.547 1.00 0.00 C ATOM 2561 CD2 TYR A 162 -10.353 1.644 -11.827 1.00 0.00 C ATOM 2562 CE1 TYR A 162 -8.919 -0.712 -12.253 1.00 0.00 C ATOM 2563 CE2 TYR A 162 -10.932 0.358 -11.533 1.00 0.00 C ATOM 2564 CZ TYR A 162 -10.186 -0.756 -11.760 1.00 0.00 C ATOM 2565 OH TYR A 162 -10.732 -1.970 -11.482 1.00 0.00 O ATOM 0 H TYR A 162 -9.074 5.237 -11.538 1.00 0.00 H new ATOM 0 HA TYR A 162 -7.358 2.946 -10.748 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -9.251 3.781 -12.918 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -7.801 2.993 -13.508 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -7.337 0.636 -12.939 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -10.923 2.545 -11.655 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -8.359 -1.621 -12.420 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -11.935 0.280 -11.141 1.00 0.00 H new ATOM 0 HH TYR A 162 -11.641 -1.848 -11.136 1.00 0.00 H new ATOM 2575 N SER A 163 -5.390 3.494 -12.276 1.00 0.00 N ATOM 2576 CA SER A 163 -4.121 3.965 -12.804 1.00 0.00 C ATOM 2577 C SER A 163 -4.358 5.106 -13.796 1.00 0.00 C ATOM 2578 O SER A 163 -5.421 5.190 -14.407 1.00 0.00 O ATOM 2579 CB SER A 163 -3.349 2.828 -13.477 1.00 0.00 C ATOM 2580 OG SER A 163 -2.723 1.972 -12.525 1.00 0.00 O ATOM 0 H SER A 163 -5.438 2.488 -12.114 1.00 0.00 H new ATOM 0 HA SER A 163 -3.520 4.334 -11.973 1.00 0.00 H new ATOM 0 HB2 SER A 163 -4.030 2.245 -14.097 1.00 0.00 H new ATOM 0 HB3 SER A 163 -2.593 3.246 -14.141 1.00 0.00 H new ATOM 0 HG SER A 163 -2.952 1.040 -12.723 1.00 0.00 H new ATOM 2586 N ASP A 164 -3.348 5.954 -13.924 1.00 0.00 N ATOM 2587 CA ASP A 164 -3.433 7.086 -14.831 1.00 0.00 C ATOM 2588 C ASP A 164 -2.350 8.105 -14.471 1.00 0.00 C ATOM 2589 O ASP A 164 -2.592 9.026 -13.693 1.00 0.00 O ATOM 2590 CB ASP A 164 -4.792 7.781 -14.719 1.00 0.00 C ATOM 2591 CG ASP A 164 -5.725 7.574 -15.913 1.00 0.00 C ATOM 2592 OD1 ASP A 164 -6.737 8.306 -15.976 1.00 0.00 O ATOM 2593 OD2 ASP A 164 -5.406 6.689 -16.736 1.00 0.00 O ATOM 0 H ASP A 164 -2.467 5.880 -13.415 1.00 0.00 H new ATOM 0 HA ASP A 164 -3.301 6.714 -15.847 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -5.293 7.423 -13.820 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -4.626 8.850 -14.588 1.00 0.00 H new ATOM 2599 N PHE A 165 -1.177 7.905 -15.055 1.00 0.00 N ATOM 2600 CA PHE A 165 -0.056 8.795 -14.806 1.00 0.00 C ATOM 2601 C PHE A 165 0.334 9.554 -16.076 1.00 0.00 C ATOM 2602 O PHE A 165 0.487 10.774 -16.052 1.00 0.00 O ATOM 2603 CB PHE A 165 1.120 7.920 -14.367 1.00 0.00 C ATOM 2604 CG PHE A 165 1.652 6.996 -15.465 1.00 0.00 C ATOM 2605 CD1 PHE A 165 1.001 5.837 -15.753 1.00 0.00 C ATOM 2606 CD2 PHE A 165 2.776 7.334 -16.152 1.00 0.00 C ATOM 2607 CE1 PHE A 165 1.495 4.980 -16.772 1.00 0.00 C ATOM 2608 CE2 PHE A 165 3.270 6.477 -17.171 1.00 0.00 C ATOM 2609 CZ PHE A 165 2.619 5.318 -17.459 1.00 0.00 C ATOM 0 H PHE A 165 -0.979 7.140 -15.700 1.00 0.00 H new ATOM 0 HA PHE A 165 -0.324 9.528 -14.045 1.00 0.00 H new ATOM 0 HB2 PHE A 165 1.930 8.563 -14.024 1.00 0.00 H new ATOM 0 HB3 PHE A 165 0.811 7.315 -13.515 1.00 0.00 H new ATOM 0 HD1 PHE A 165 0.109 5.569 -15.207 1.00 0.00 H new ATOM 0 HD2 PHE A 165 3.293 8.254 -15.923 1.00 0.00 H new ATOM 0 HE1 PHE A 165 0.978 4.060 -17.001 1.00 0.00 H new ATOM 0 HE2 PHE A 165 4.162 6.745 -17.717 1.00 0.00 H new ATOM 0 HZ PHE A 165 2.995 4.666 -18.234 1.00 0.00 H new ATOM 2619 N SER A 166 0.484 8.800 -17.155 1.00 0.00 N ATOM 2620 CA SER A 166 0.854 9.386 -18.432 1.00 0.00 C ATOM 2621 C SER A 166 2.361 9.649 -18.471 1.00 0.00 C ATOM 2622 O SER A 166 2.951 10.047 -17.468 1.00 0.00 O ATOM 2623 CB SER A 166 0.083 10.683 -18.687 1.00 0.00 C ATOM 2624 OG SER A 166 -0.553 10.685 -19.962 1.00 0.00 O ATOM 0 H SER A 166 0.356 7.788 -17.171 1.00 0.00 H new ATOM 0 HA SER A 166 0.594 8.679 -19.220 1.00 0.00 H new ATOM 0 HB2 SER A 166 -0.667 10.818 -17.908 1.00 0.00 H new ATOM 0 HB3 SER A 166 0.766 11.530 -18.622 1.00 0.00 H new ATOM 0 HG SER A 166 -1.036 11.529 -20.085 1.00 0.00 H new ATOM 2630 N GLU A 167 2.940 9.415 -19.640 1.00 0.00 N ATOM 2631 CA GLU A 167 4.366 9.622 -19.822 1.00 0.00 C ATOM 2632 C GLU A 167 4.797 10.944 -19.186 1.00 0.00 C ATOM 2633 O GLU A 167 5.906 11.054 -18.664 1.00 0.00 O ATOM 2634 CB GLU A 167 4.741 9.580 -21.305 1.00 0.00 C ATOM 2635 CG GLU A 167 5.691 8.416 -21.598 1.00 0.00 C ATOM 2636 CD GLU A 167 4.956 7.271 -22.297 1.00 0.00 C ATOM 2637 OE1 GLU A 167 4.891 7.316 -23.544 1.00 0.00 O ATOM 2638 OE2 GLU A 167 4.476 6.376 -21.568 1.00 0.00 O ATOM 0 H GLU A 167 2.447 9.084 -20.470 1.00 0.00 H new ATOM 0 HA GLU A 167 4.897 8.811 -19.323 1.00 0.00 H new ATOM 0 HB2 GLU A 167 3.839 9.479 -21.909 1.00 0.00 H new ATOM 0 HB3 GLU A 167 5.213 10.520 -21.591 1.00 0.00 H new ATOM 0 HG2 GLU A 167 6.513 8.762 -22.225 1.00 0.00 H new ATOM 0 HG3 GLU A 167 6.130 8.057 -20.667 1.00 0.00 H new ATOM 2646 N ALA A 168 3.898 11.916 -19.249 1.00 0.00 N ATOM 2647 CA ALA A 168 4.172 13.227 -18.685 1.00 0.00 C ATOM 2648 C ALA A 168 4.587 13.071 -17.221 1.00 0.00 C ATOM 2649 O ALA A 168 5.459 13.791 -16.739 1.00 0.00 O ATOM 2650 CB ALA A 168 2.941 14.120 -18.851 1.00 0.00 C ATOM 0 H ALA A 168 2.979 11.822 -19.682 1.00 0.00 H new ATOM 0 HA ALA A 168 4.997 13.707 -19.211 1.00 0.00 H new ATOM 0 HB1 ALA A 168 3.145 15.104 -18.428 1.00 0.00 H new ATOM 0 HB2 ALA A 168 2.706 14.222 -19.910 1.00 0.00 H new ATOM 0 HB3 ALA A 168 2.094 13.671 -18.333 1.00 0.00 H new ATOM 2656 N ALA A 169 3.941 12.125 -16.554 1.00 0.00 N ATOM 2657 CA ALA A 169 4.232 11.865 -15.154 1.00 0.00 C ATOM 2658 C ALA A 169 5.696 11.443 -15.012 1.00 0.00 C ATOM 2659 O ALA A 169 6.461 12.077 -14.288 1.00 0.00 O ATOM 2660 CB ALA A 169 3.265 10.807 -14.619 1.00 0.00 C ATOM 0 H ALA A 169 3.218 11.530 -16.957 1.00 0.00 H new ATOM 0 HA ALA A 169 4.090 12.767 -14.558 1.00 0.00 H new ATOM 0 HB1 ALA A 169 3.483 10.612 -13.569 1.00 0.00 H new ATOM 0 HB2 ALA A 169 2.241 11.168 -14.716 1.00 0.00 H new ATOM 0 HB3 ALA A 169 3.381 9.886 -15.191 1.00 0.00 H new ATOM 2666 N CYS A 170 6.041 10.373 -15.714 1.00 0.00 N ATOM 2667 CA CYS A 170 7.399 9.858 -15.675 1.00 0.00 C ATOM 2668 C CYS A 170 8.338 10.940 -16.213 1.00 0.00 C ATOM 2669 O CYS A 170 9.332 11.279 -15.572 1.00 0.00 O ATOM 2670 CB CYS A 170 7.530 8.549 -16.455 1.00 0.00 C ATOM 2671 SG CYS A 170 6.170 7.354 -16.184 1.00 0.00 S ATOM 0 H CYS A 170 5.403 9.849 -16.313 1.00 0.00 H new ATOM 0 HA CYS A 170 7.671 9.620 -14.647 1.00 0.00 H new ATOM 0 HB2 CYS A 170 7.585 8.780 -17.519 1.00 0.00 H new ATOM 0 HB3 CYS A 170 8.472 8.073 -16.183 1.00 0.00 H new ATOM 2677 N LYS A 171 7.991 11.451 -17.384 1.00 0.00 N ATOM 2678 CA LYS A 171 8.790 12.487 -18.016 1.00 0.00 C ATOM 2679 C LYS A 171 9.064 13.602 -17.004 1.00 0.00 C ATOM 2680 O LYS A 171 8.145 14.304 -16.584 1.00 0.00 O ATOM 2681 CB LYS A 171 8.118 12.975 -19.301 1.00 0.00 C ATOM 2682 CG LYS A 171 9.072 13.842 -20.124 1.00 0.00 C ATOM 2683 CD LYS A 171 8.410 14.307 -21.422 1.00 0.00 C ATOM 2684 CE LYS A 171 8.953 15.669 -21.858 1.00 0.00 C ATOM 2685 NZ LYS A 171 7.840 16.598 -22.158 1.00 0.00 N ATOM 0 H LYS A 171 7.166 11.167 -17.913 1.00 0.00 H new ATOM 0 HA LYS A 171 9.757 12.088 -18.322 1.00 0.00 H new ATOM 0 HB2 LYS A 171 7.795 12.119 -19.894 1.00 0.00 H new ATOM 0 HB3 LYS A 171 7.224 13.547 -19.053 1.00 0.00 H new ATOM 0 HG2 LYS A 171 9.379 14.708 -19.538 1.00 0.00 H new ATOM 0 HG3 LYS A 171 9.975 13.277 -20.355 1.00 0.00 H new ATOM 0 HD2 LYS A 171 8.587 13.573 -22.208 1.00 0.00 H new ATOM 0 HD3 LYS A 171 7.331 14.370 -21.282 1.00 0.00 H new ATOM 0 HE2 LYS A 171 9.581 16.086 -21.070 1.00 0.00 H new ATOM 0 HE3 LYS A 171 9.584 15.551 -22.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 8.225 17.518 -22.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 7.257 16.205 -22.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 7.254 16.724 -21.308 1.00 0.00 H new ATOM 2699 N VAL A 172 10.332 13.730 -16.641 1.00 0.00 N ATOM 2700 CA VAL A 172 10.738 14.747 -15.686 1.00 0.00 C ATOM 2701 C VAL A 172 11.319 15.945 -16.440 1.00 0.00 C ATOM 2702 O VAL A 172 11.899 15.785 -17.514 1.00 0.00 O ATOM 2703 CB VAL A 172 11.713 14.150 -14.669 1.00 0.00 C ATOM 2704 CG1 VAL A 172 12.201 15.217 -13.687 1.00 0.00 C ATOM 2705 CG2 VAL A 172 11.078 12.972 -13.927 1.00 0.00 C ATOM 0 H VAL A 172 11.092 13.146 -16.991 1.00 0.00 H new ATOM 0 HA VAL A 172 9.878 15.105 -15.120 1.00 0.00 H new ATOM 0 HB VAL A 172 12.579 13.775 -15.215 1.00 0.00 H new ATOM 0 HG11 VAL A 172 12.893 14.767 -12.975 1.00 0.00 H new ATOM 0 HG12 VAL A 172 12.710 16.010 -14.235 1.00 0.00 H new ATOM 0 HG13 VAL A 172 11.349 15.635 -13.151 1.00 0.00 H new ATOM 0 HG21 VAL A 172 11.792 12.566 -13.210 1.00 0.00 H new ATOM 0 HG22 VAL A 172 10.187 13.312 -13.399 1.00 0.00 H new ATOM 0 HG23 VAL A 172 10.802 12.197 -14.643 1.00 0.00 H new