USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1198 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 117 ASN : amide:sc= -4.18 K(o=-6.4,f=-18!) USER MOD Set 1.2: A 134 GLN : amide:sc= -2.25 K(o=-6.4,f=-16!) USER MOD Set 2.1: A 115 ASN :FLIP amide:sc= -3.9! F(o=-8.1,f=-7.5!) USER MOD Set 2.2: A 131 GLN : amide:sc= -3.57 K(o=-7.5,f=-8.1!) USER MOD Set 3.1: A 47 HIS : no HE2:sc= -9.76! C(o=-19!,f=-19!) USER MOD Set 3.2: A 78 ASN : amide:sc= -4.67! C(o=-19!,f=-21!) USER MOD Set 3.3: A 126 TYR OH : rot -60:sc= -4.39! USER MOD Set 4.1: A 71 SER OG : rot -125:sc= -0.121 USER MOD Set 4.2: A 73 ASN :FLIP amide:sc= -5.39! C(o=-24!,f=-20!) USER MOD Set 4.3: A 76 MET CE :methyl 141:sc= -6.74! (180deg=-17.3!) USER MOD Set 4.4: A 136 MET CE :methyl 161:sc= -7.45! (180deg=-8.68!) USER MOD Set 5.1: A 24 HIS : no HE2:sc= -9.74! C(o=-22!,f=-24!) USER MOD Set 5.2: A 43 MET CE :methyl 158:sc= -12.5! (180deg=-11!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc=-0.00316 X(o=-0.0032,f=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.753 K(o=-0.75,f=-1.6) USER MOD Single : A 5 HIS :FLIP no HD1:sc= -0.0453 F(o=-1.1,f=-0.045) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 MET CE :methyl -172:sc= 0 (180deg=-0.0967) USER MOD Single : A 9 SER OG : rot 180:sc= 0.00538 USER MOD Single : A 12 HIS : no HD1:sc= -0.123 X(o=-0.12,f=-0.3) USER MOD Single : A 13 ASN : amide:sc=-0.00844 X(o=-0.0084,f=-0.34) USER MOD Single : A 17 LYS NZ :NH3+ 161:sc= 0.0208 (180deg=-0.0188) USER MOD Single : A 22 HIS :FLIP no HD1:sc= -0.878 F(o=-1.6,f=-0.88) USER MOD Single : A 27 THR OG1 : rot 96:sc= 0.115 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 168:sc= -0.225 (180deg=-0.433) USER MOD Single : A 49 SER OG : rot -140:sc= -1.4 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -123:sc= -7.4! (180deg=-13.1!) USER MOD Single : A 64 SER OG : rot 167:sc= 1.48 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0975 USER MOD Single : A 68 SER OG : rot 180:sc= -0.645 USER MOD Single : A 72 HIS : no HD1:sc= -0.286 X(o=-0.29,f=0.044) USER MOD Single : A 86 LYS NZ :NH3+ -165:sc=0.000116 (180deg=0) USER MOD Single : A 91 SER OG : rot -160:sc= -1.01 USER MOD Single : A 96 TYR OH : rot 167:sc= -3.63! USER MOD Single : A 106 SER OG : rot 53:sc= 1.24 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS :FLIP no HE2:sc= 0.0491 F(o=-0.52,f=0.049) USER MOD Single : A 119 ASN : amide:sc= -0.294 X(o=-0.29,f=-0.29) USER MOD Single : A 121 SER OG : rot 64:sc= 0.0672 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot -14:sc= -1.12 USER MOD Single : A 128 SER OG : rot 180:sc= -0.109 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -4.12! C(o=-4.1!,f=-5.3!) USER MOD Single : A 144 THR OG1 : rot 7:sc= 1.02 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HD1:sc= -0.229 K(o=-0.23,f=-0.9) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -30.236 5.833 -6.981 1.00 0.00 N ATOM 2 CA MET A 1 -31.485 5.467 -7.700 1.00 0.00 C ATOM 3 C MET A 1 -32.315 4.474 -6.892 1.00 0.00 C ATOM 4 O MET A 1 -31.789 3.766 -6.033 1.00 0.00 O ATOM 5 CB MET A 1 -31.108 4.863 -9.054 1.00 0.00 C ATOM 6 CG MET A 1 -32.125 5.143 -10.149 1.00 0.00 C ATOM 7 SD MET A 1 -31.751 6.643 -11.077 1.00 0.00 S ATOM 8 CE MET A 1 -33.229 7.606 -10.772 1.00 0.00 C ATOM 0 H1 MET A 1 -29.691 6.509 -7.553 1.00 0.00 H new ATOM 0 H2 MET A 1 -30.476 6.267 -6.067 1.00 0.00 H new ATOM 0 H3 MET A 1 -29.666 4.979 -6.819 1.00 0.00 H new ATOM 0 HA MET A 1 -32.092 6.361 -7.843 1.00 0.00 H new ATOM 0 HB2 MET A 1 -30.139 5.256 -9.361 1.00 0.00 H new ATOM 0 HB3 MET A 1 -30.994 3.785 -8.943 1.00 0.00 H new ATOM 0 HG2 MET A 1 -32.158 4.296 -10.834 1.00 0.00 H new ATOM 0 HG3 MET A 1 -33.116 5.233 -9.705 1.00 0.00 H new ATOM 0 HE1 MET A 1 -33.149 8.566 -11.282 1.00 0.00 H new ATOM 0 HE2 MET A 1 -34.099 7.067 -11.147 1.00 0.00 H new ATOM 0 HE3 MET A 1 -33.340 7.773 -9.701 1.00 0.00 H new ATOM 20 N HIS A 2 -33.612 4.428 -7.179 1.00 0.00 N ATOM 21 CA HIS A 2 -34.522 3.522 -6.483 1.00 0.00 C ATOM 22 C HIS A 2 -34.598 3.859 -4.995 1.00 0.00 C ATOM 23 O HIS A 2 -35.550 4.495 -4.543 1.00 0.00 O ATOM 24 CB HIS A 2 -34.077 2.069 -6.672 1.00 0.00 C ATOM 25 CG HIS A 2 -34.208 1.583 -8.081 1.00 0.00 C ATOM 26 ND1 HIS A 2 -35.310 0.893 -8.540 1.00 0.00 N ATOM 27 CD2 HIS A 2 -33.366 1.689 -9.137 1.00 0.00 C ATOM 28 CE1 HIS A 2 -35.139 0.595 -9.817 1.00 0.00 C ATOM 29 NE2 HIS A 2 -33.969 1.067 -10.203 1.00 0.00 N ATOM 0 H HIS A 2 -34.058 5.008 -7.890 1.00 0.00 H new ATOM 0 HA HIS A 2 -35.516 3.646 -6.913 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -33.038 1.972 -6.358 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -34.669 1.428 -6.019 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -32.400 2.173 -9.140 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -35.839 0.056 -10.439 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -33.576 0.984 -11.141 1.00 0.00 H new ATOM 38 N HIS A 3 -33.593 3.427 -4.240 1.00 0.00 N ATOM 39 CA HIS A 3 -33.551 3.686 -2.806 1.00 0.00 C ATOM 40 C HIS A 3 -32.119 3.925 -2.338 1.00 0.00 C ATOM 41 O HIS A 3 -31.162 3.568 -3.026 1.00 0.00 O ATOM 42 CB HIS A 3 -34.164 2.513 -2.037 1.00 0.00 C ATOM 43 CG HIS A 3 -35.200 2.926 -1.039 1.00 0.00 C ATOM 44 ND1 HIS A 3 -36.539 2.626 -1.177 1.00 0.00 N ATOM 45 CD2 HIS A 3 -35.088 3.621 0.118 1.00 0.00 C ATOM 46 CE1 HIS A 3 -37.206 3.119 -0.148 1.00 0.00 C ATOM 47 NE2 HIS A 3 -36.349 3.726 0.652 1.00 0.00 N ATOM 0 H HIS A 3 -32.798 2.897 -4.597 1.00 0.00 H new ATOM 0 HA HIS A 3 -34.133 4.586 -2.607 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -34.613 1.819 -2.747 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -33.370 1.973 -1.521 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -34.177 4.018 0.542 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -38.271 3.039 0.011 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -36.585 4.197 1.525 1.00 0.00 H new ATOM 56 N HIS A 4 -31.977 4.531 -1.163 1.00 0.00 N ATOM 57 CA HIS A 4 -30.662 4.819 -0.605 1.00 0.00 C ATOM 58 C HIS A 4 -30.257 3.754 0.410 1.00 0.00 C ATOM 59 O HIS A 4 -30.749 3.739 1.539 1.00 0.00 O ATOM 60 CB HIS A 4 -30.655 6.198 0.055 1.00 0.00 C ATOM 61 CG HIS A 4 -31.716 6.368 1.098 1.00 0.00 C ATOM 62 ND1 HIS A 4 -33.025 6.680 0.795 1.00 0.00 N ATOM 63 CD2 HIS A 4 -31.658 6.268 2.447 1.00 0.00 C ATOM 64 CE1 HIS A 4 -33.725 6.764 1.912 1.00 0.00 C ATOM 65 NE2 HIS A 4 -32.920 6.517 2.928 1.00 0.00 N ATOM 0 H HIS A 4 -32.758 4.832 -0.579 1.00 0.00 H new ATOM 0 HA HIS A 4 -29.939 4.812 -1.421 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -29.679 6.369 0.510 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -30.787 6.960 -0.713 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -30.782 6.036 3.035 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -34.778 6.996 1.982 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -33.191 6.512 3.911 1.00 0.00 H new ATOM 74 N HIS A 5 -29.357 2.866 0.002 1.00 0.00 N ATOM 75 CA HIS A 5 -28.886 1.798 0.876 1.00 0.00 C ATOM 76 C HIS A 5 -27.575 1.214 0.362 1.00 0.00 C ATOM 77 O HIS A 5 -27.278 1.280 -0.831 1.00 0.00 O ATOM 78 CB HIS A 5 -29.941 0.695 0.983 1.00 0.00 C ATOM 79 CG HIS A 5 -30.354 0.132 -0.342 1.00 0.00 C ATOM 80 ND1 HIS A 5 -31.015 0.700 -1.379 1.00 0.00 N flip ATOM 81 CD2 HIS A 5 -30.096 -1.168 -0.723 1.00 0.00 C flip ATOM 82 CE1 HIS A 5 -31.140 -0.257 -2.356 1.00 0.00 C flip ATOM 83 NE2 HIS A 5 -30.577 -1.374 -1.936 1.00 0.00 N flip ATOM 0 H HIS A 5 -28.939 2.865 -0.928 1.00 0.00 H new ATOM 0 HA HIS A 5 -28.712 2.222 1.865 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -29.551 -0.110 1.605 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -30.820 1.092 1.490 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -29.581 -1.903 -0.123 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -31.621 -0.118 -3.313 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -30.522 -2.248 -2.459 1.00 0.00 H new ATOM 92 N HIS A 6 -26.790 0.643 1.272 1.00 0.00 N ATOM 93 CA HIS A 6 -25.508 0.047 0.911 1.00 0.00 C ATOM 94 C HIS A 6 -25.500 -1.448 1.212 1.00 0.00 C ATOM 95 O HIS A 6 -25.442 -1.858 2.371 1.00 0.00 O ATOM 96 CB HIS A 6 -24.371 0.739 1.666 1.00 0.00 C ATOM 97 CG HIS A 6 -23.692 1.813 0.873 1.00 0.00 C ATOM 98 ND1 HIS A 6 -23.791 3.153 1.179 1.00 0.00 N ATOM 99 CD2 HIS A 6 -22.899 1.737 -0.223 1.00 0.00 C ATOM 100 CE1 HIS A 6 -23.089 3.855 0.308 1.00 0.00 C ATOM 101 NE2 HIS A 6 -22.539 3.019 -0.553 1.00 0.00 N ATOM 0 H HIS A 6 -27.019 0.581 2.264 1.00 0.00 H new ATOM 0 HA HIS A 6 -25.359 0.184 -0.160 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -24.767 1.172 2.585 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -23.632 -0.008 1.958 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -22.605 0.836 -0.740 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -22.983 4.930 0.301 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -21.943 3.284 -1.337 1.00 0.00 H new ATOM 110 N HIS A 7 -25.556 -2.258 0.160 1.00 0.00 N ATOM 111 CA HIS A 7 -25.554 -3.709 0.312 1.00 0.00 C ATOM 112 C HIS A 7 -24.919 -4.383 -0.900 1.00 0.00 C ATOM 113 O HIS A 7 -25.291 -5.496 -1.271 1.00 0.00 O ATOM 114 CB HIS A 7 -26.981 -4.224 0.508 1.00 0.00 C ATOM 115 CG HIS A 7 -27.092 -5.294 1.550 1.00 0.00 C ATOM 116 ND1 HIS A 7 -26.624 -6.578 1.365 1.00 0.00 N ATOM 117 CD2 HIS A 7 -27.624 -5.265 2.796 1.00 0.00 C ATOM 118 CE1 HIS A 7 -26.863 -7.292 2.449 1.00 0.00 C ATOM 119 NE2 HIS A 7 -27.467 -6.519 3.332 1.00 0.00 N ATOM 0 H HIS A 7 -25.603 -1.935 -0.806 1.00 0.00 H new ATOM 0 HA HIS A 7 -24.962 -3.956 1.193 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -27.625 -3.390 0.785 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -27.352 -4.612 -0.441 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -28.085 -4.415 3.277 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -26.608 -8.332 2.590 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -27.769 -6.807 4.263 1.00 0.00 H new ATOM 128 N MET A 8 -23.957 -3.699 -1.515 1.00 0.00 N ATOM 129 CA MET A 8 -23.270 -4.232 -2.686 1.00 0.00 C ATOM 130 C MET A 8 -21.814 -3.774 -2.718 1.00 0.00 C ATOM 131 O MET A 8 -21.396 -2.948 -1.906 1.00 0.00 O ATOM 132 CB MET A 8 -23.986 -3.794 -3.967 1.00 0.00 C ATOM 133 CG MET A 8 -24.148 -4.910 -4.984 1.00 0.00 C ATOM 134 SD MET A 8 -24.801 -4.325 -6.559 1.00 0.00 S ATOM 135 CE MET A 8 -26.491 -3.944 -6.104 1.00 0.00 C ATOM 0 H MET A 8 -23.637 -2.776 -1.222 1.00 0.00 H new ATOM 0 HA MET A 8 -23.287 -5.320 -2.624 1.00 0.00 H new ATOM 0 HB2 MET A 8 -24.970 -3.404 -3.708 1.00 0.00 H new ATOM 0 HB3 MET A 8 -23.429 -2.976 -4.423 1.00 0.00 H new ATOM 0 HG2 MET A 8 -23.182 -5.388 -5.150 1.00 0.00 H new ATOM 0 HG3 MET A 8 -24.815 -5.671 -4.579 1.00 0.00 H new ATOM 0 HE1 MET A 8 -27.064 -3.706 -7.000 1.00 0.00 H new ATOM 0 HE2 MET A 8 -26.937 -4.805 -5.607 1.00 0.00 H new ATOM 0 HE3 MET A 8 -26.502 -3.089 -5.428 1.00 0.00 H new ATOM 145 N SER A 9 -21.049 -4.315 -3.659 1.00 0.00 N ATOM 146 CA SER A 9 -19.641 -3.963 -3.795 1.00 0.00 C ATOM 147 C SER A 9 -19.478 -2.470 -4.069 1.00 0.00 C ATOM 148 O SER A 9 -20.402 -1.812 -4.542 1.00 0.00 O ATOM 149 CB SER A 9 -18.997 -4.774 -4.923 1.00 0.00 C ATOM 150 OG SER A 9 -19.813 -4.771 -6.082 1.00 0.00 O ATOM 0 H SER A 9 -21.380 -4.999 -4.339 1.00 0.00 H new ATOM 0 HA SER A 9 -19.140 -4.199 -2.856 1.00 0.00 H new ATOM 0 HB2 SER A 9 -18.018 -4.357 -5.162 1.00 0.00 H new ATOM 0 HB3 SER A 9 -18.835 -5.799 -4.591 1.00 0.00 H new ATOM 0 HG SER A 9 -19.380 -5.294 -6.789 1.00 0.00 H new ATOM 156 N ASP A 10 -18.294 -1.945 -3.768 1.00 0.00 N ATOM 157 CA ASP A 10 -18.010 -0.532 -3.982 1.00 0.00 C ATOM 158 C ASP A 10 -17.245 -0.321 -5.284 1.00 0.00 C ATOM 159 O ASP A 10 -16.435 0.598 -5.399 1.00 0.00 O ATOM 160 CB ASP A 10 -17.208 0.034 -2.808 1.00 0.00 C ATOM 161 CG ASP A 10 -18.096 0.515 -1.678 1.00 0.00 C ATOM 162 OD1 ASP A 10 -18.655 1.626 -1.795 1.00 0.00 O ATOM 163 OD2 ASP A 10 -18.234 -0.220 -0.677 1.00 0.00 O ATOM 0 H ASP A 10 -17.517 -2.477 -3.376 1.00 0.00 H new ATOM 0 HA ASP A 10 -18.961 -0.004 -4.051 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -16.530 -0.732 -2.432 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -16.591 0.861 -3.159 1.00 0.00 H new ATOM 168 N GLY A 11 -17.510 -1.179 -6.263 1.00 0.00 N ATOM 169 CA GLY A 11 -16.839 -1.070 -7.546 1.00 0.00 C ATOM 170 C GLY A 11 -17.652 -0.288 -8.558 1.00 0.00 C ATOM 171 O GLY A 11 -18.272 -0.868 -9.448 1.00 0.00 O ATOM 0 H GLY A 11 -18.177 -1.948 -6.192 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -15.873 -0.585 -7.408 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -16.642 -2.069 -7.936 1.00 0.00 H new ATOM 175 N HIS A 12 -17.650 1.034 -8.419 1.00 0.00 N ATOM 176 CA HIS A 12 -18.395 1.898 -9.328 1.00 0.00 C ATOM 177 C HIS A 12 -17.489 2.961 -9.940 1.00 0.00 C ATOM 178 O HIS A 12 -17.566 3.240 -11.138 1.00 0.00 O ATOM 179 CB HIS A 12 -19.558 2.566 -8.592 1.00 0.00 C ATOM 180 CG HIS A 12 -20.743 2.832 -9.467 1.00 0.00 C ATOM 181 ND1 HIS A 12 -21.250 1.903 -10.352 1.00 0.00 N ATOM 182 CD2 HIS A 12 -21.524 3.932 -9.593 1.00 0.00 C ATOM 183 CE1 HIS A 12 -22.289 2.420 -10.984 1.00 0.00 C ATOM 184 NE2 HIS A 12 -22.475 3.650 -10.541 1.00 0.00 N ATOM 0 H HIS A 12 -17.142 1.530 -7.687 1.00 0.00 H new ATOM 0 HA HIS A 12 -18.790 1.278 -10.133 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -19.865 1.931 -7.761 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -19.214 3.507 -8.163 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -21.418 4.859 -9.048 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -22.884 1.922 -11.735 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -23.207 4.288 -10.853 1.00 0.00 H new ATOM 193 N ASN A 13 -16.629 3.549 -9.115 1.00 0.00 N ATOM 194 CA ASN A 13 -15.709 4.581 -9.578 1.00 0.00 C ATOM 195 C ASN A 13 -14.778 5.028 -8.455 1.00 0.00 C ATOM 196 O ASN A 13 -13.594 5.280 -8.680 1.00 0.00 O ATOM 197 CB ASN A 13 -16.488 5.783 -10.120 1.00 0.00 C ATOM 198 CG ASN A 13 -15.627 6.696 -10.970 1.00 0.00 C ATOM 199 OD1 ASN A 13 -14.860 6.236 -11.817 1.00 0.00 O ATOM 200 ND2 ASN A 13 -15.751 8.001 -10.749 1.00 0.00 N ATOM 0 H ASN A 13 -16.550 3.328 -8.122 1.00 0.00 H new ATOM 0 HA ASN A 13 -15.103 4.157 -10.379 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -17.331 5.428 -10.713 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -16.901 6.351 -9.286 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -15.198 8.665 -11.291 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -16.399 8.338 -10.037 1.00 0.00 H new ATOM 207 N GLY A 14 -15.321 5.127 -7.246 1.00 0.00 N ATOM 208 CA GLY A 14 -14.526 5.545 -6.107 1.00 0.00 C ATOM 209 C GLY A 14 -13.637 4.438 -5.576 1.00 0.00 C ATOM 210 O GLY A 14 -13.761 4.035 -4.419 1.00 0.00 O ATOM 0 H GLY A 14 -16.298 4.925 -7.035 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.908 6.396 -6.393 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -15.189 5.886 -5.312 1.00 0.00 H new ATOM 214 N LEU A 15 -12.736 3.946 -6.420 1.00 0.00 N ATOM 215 CA LEU A 15 -11.821 2.882 -6.021 1.00 0.00 C ATOM 216 C LEU A 15 -10.470 3.458 -5.613 1.00 0.00 C ATOM 217 O LEU A 15 -10.193 3.629 -4.426 1.00 0.00 O ATOM 218 CB LEU A 15 -11.654 1.869 -7.155 1.00 0.00 C ATOM 219 CG LEU A 15 -12.326 0.518 -6.909 1.00 0.00 C ATOM 220 CD1 LEU A 15 -11.721 -0.163 -5.688 1.00 0.00 C ATOM 221 CD2 LEU A 15 -13.827 0.696 -6.730 1.00 0.00 C ATOM 0 H LEU A 15 -12.620 4.266 -7.382 1.00 0.00 H new ATOM 0 HA LEU A 15 -12.246 2.368 -5.159 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -12.059 2.299 -8.071 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.590 1.705 -7.323 1.00 0.00 H new ATOM 0 HG LEU A 15 -12.155 -0.117 -7.778 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -12.211 -1.123 -5.527 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -10.655 -0.322 -5.851 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -11.864 0.468 -4.811 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -14.290 -0.275 -6.556 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -14.017 1.347 -5.877 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -14.250 1.144 -7.629 1.00 0.00 H new ATOM 233 N GLY A 16 -9.630 3.764 -6.600 1.00 0.00 N ATOM 234 CA GLY A 16 -8.326 4.327 -6.302 1.00 0.00 C ATOM 235 C GLY A 16 -8.420 5.787 -5.910 1.00 0.00 C ATOM 236 O GLY A 16 -8.324 6.134 -4.731 1.00 0.00 O ATOM 0 H GLY A 16 -9.828 3.633 -7.592 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.863 3.762 -5.493 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.679 4.225 -7.173 1.00 0.00 H new ATOM 240 N LYS A 17 -8.611 6.639 -6.909 1.00 0.00 N ATOM 241 CA LYS A 17 -8.726 8.075 -6.695 1.00 0.00 C ATOM 242 C LYS A 17 -8.936 8.788 -8.025 1.00 0.00 C ATOM 243 O LYS A 17 -9.675 9.769 -8.111 1.00 0.00 O ATOM 244 CB LYS A 17 -7.473 8.617 -5.999 1.00 0.00 C ATOM 245 CG LYS A 17 -7.509 10.118 -5.761 1.00 0.00 C ATOM 246 CD LYS A 17 -8.473 10.486 -4.641 1.00 0.00 C ATOM 247 CE LYS A 17 -9.549 11.450 -5.120 1.00 0.00 C ATOM 248 NZ LYS A 17 -10.866 10.773 -5.286 1.00 0.00 N ATOM 0 H LYS A 17 -8.690 6.356 -7.886 1.00 0.00 H new ATOM 0 HA LYS A 17 -9.587 8.261 -6.053 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -7.351 8.109 -5.042 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.599 8.374 -6.603 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -6.509 10.471 -5.511 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.806 10.625 -6.679 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.941 9.582 -4.252 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -7.919 10.938 -3.818 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.648 12.268 -4.406 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -9.245 11.891 -6.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -11.624 11.485 -5.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.875 10.247 -6.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.019 10.114 -4.496 1.00 0.00 H new ATOM 262 N GLY A 18 -8.281 8.279 -9.065 1.00 0.00 N ATOM 263 CA GLY A 18 -8.401 8.864 -10.386 1.00 0.00 C ATOM 264 C GLY A 18 -7.196 8.564 -11.253 1.00 0.00 C ATOM 265 O GLY A 18 -6.653 9.458 -11.898 1.00 0.00 O ATOM 0 H GLY A 18 -7.666 7.467 -9.014 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -9.300 8.483 -10.871 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.522 9.943 -10.295 1.00 0.00 H new ATOM 269 N PHE A 19 -6.773 7.302 -11.264 1.00 0.00 N ATOM 270 CA PHE A 19 -5.616 6.891 -12.052 1.00 0.00 C ATOM 271 C PHE A 19 -5.852 5.542 -12.728 1.00 0.00 C ATOM 272 O PHE A 19 -5.971 5.463 -13.950 1.00 0.00 O ATOM 273 CB PHE A 19 -4.369 6.811 -11.170 1.00 0.00 C ATOM 274 CG PHE A 19 -4.293 7.893 -10.131 1.00 0.00 C ATOM 275 CD1 PHE A 19 -4.343 9.226 -10.498 1.00 0.00 C ATOM 276 CD2 PHE A 19 -4.170 7.574 -8.789 1.00 0.00 C ATOM 277 CE1 PHE A 19 -4.273 10.225 -9.545 1.00 0.00 C ATOM 278 CE2 PHE A 19 -4.100 8.565 -7.830 1.00 0.00 C ATOM 279 CZ PHE A 19 -4.152 9.893 -8.209 1.00 0.00 C ATOM 0 H PHE A 19 -7.214 6.548 -10.737 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.464 7.642 -12.827 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.348 5.841 -10.674 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.483 6.865 -11.803 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.438 9.489 -11.541 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.128 6.537 -8.489 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -4.313 11.262 -9.844 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -4.005 8.303 -6.787 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.098 10.671 -7.462 1.00 0.00 H new ATOM 289 N GLY A 20 -5.908 4.483 -11.925 1.00 0.00 N ATOM 290 CA GLY A 20 -6.118 3.153 -12.467 1.00 0.00 C ATOM 291 C GLY A 20 -7.592 2.791 -12.570 1.00 0.00 C ATOM 292 O GLY A 20 -8.298 3.279 -13.451 1.00 0.00 O ATOM 0 H GLY A 20 -5.812 4.523 -10.910 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.662 3.091 -13.455 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -5.611 2.423 -11.836 1.00 0.00 H new ATOM 296 N ASP A 21 -8.054 1.929 -11.662 1.00 0.00 N ATOM 297 CA ASP A 21 -9.453 1.500 -11.645 1.00 0.00 C ATOM 298 C ASP A 21 -9.748 0.660 -10.400 1.00 0.00 C ATOM 299 O ASP A 21 -10.335 1.151 -9.436 1.00 0.00 O ATOM 300 CB ASP A 21 -9.785 0.702 -12.909 1.00 0.00 C ATOM 301 CG ASP A 21 -10.372 1.570 -14.003 1.00 0.00 C ATOM 302 OD1 ASP A 21 -11.471 2.127 -13.793 1.00 0.00 O ATOM 303 OD2 ASP A 21 -9.736 1.693 -15.070 1.00 0.00 O ATOM 0 H ASP A 21 -7.479 1.514 -10.929 1.00 0.00 H new ATOM 0 HA ASP A 21 -10.080 2.391 -11.618 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -8.880 0.219 -13.278 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.491 -0.091 -12.660 1.00 0.00 H new ATOM 308 N HIS A 22 -9.324 -0.600 -10.426 1.00 0.00 N ATOM 309 CA HIS A 22 -9.525 -1.512 -9.297 1.00 0.00 C ATOM 310 C HIS A 22 -8.277 -2.367 -9.091 1.00 0.00 C ATOM 311 O HIS A 22 -8.098 -3.383 -9.761 1.00 0.00 O ATOM 312 CB HIS A 22 -10.745 -2.405 -9.536 1.00 0.00 C ATOM 313 CG HIS A 22 -10.630 -3.274 -10.752 1.00 0.00 C ATOM 314 ND1 HIS A 22 -10.299 -2.974 -12.031 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -10.870 -4.633 -10.731 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -10.344 -4.145 -12.747 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -10.690 -5.131 -11.942 1.00 0.00 N flip ATOM 0 H HIS A 22 -8.837 -1.017 -11.219 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.704 -0.921 -8.399 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.897 -3.038 -8.662 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.630 -1.776 -9.632 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -11.160 -5.202 -9.860 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -10.130 -4.243 -13.801 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -10.800 -6.109 -12.208 1.00 0.00 H new ATOM 326 N ILE A 23 -7.408 -1.932 -8.179 1.00 0.00 N ATOM 327 CA ILE A 23 -6.157 -2.627 -7.903 1.00 0.00 C ATOM 328 C ILE A 23 -5.557 -2.209 -6.550 1.00 0.00 C ATOM 329 O ILE A 23 -5.708 -2.897 -5.524 1.00 0.00 O ATOM 330 CB ILE A 23 -5.118 -2.303 -8.999 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.500 -2.915 -10.344 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.743 -2.755 -8.571 1.00 0.00 C ATOM 333 CD1 ILE A 23 -6.132 -1.909 -11.282 1.00 0.00 C ATOM 0 H ILE A 23 -7.552 -1.094 -7.616 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.384 -3.693 -7.882 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.104 -1.221 -9.132 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.611 -3.335 -10.814 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.194 -3.739 -10.180 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.022 -2.520 -9.354 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.461 -2.241 -7.652 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.751 -3.831 -8.397 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.384 -2.397 -12.223 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.038 -1.507 -10.828 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.430 -1.097 -11.471 1.00 0.00 H new ATOM 345 N HIS A 24 -4.850 -1.073 -6.569 1.00 0.00 N ATOM 346 CA HIS A 24 -4.196 -0.542 -5.388 1.00 0.00 C ATOM 347 C HIS A 24 -5.172 0.244 -4.538 1.00 0.00 C ATOM 348 O HIS A 24 -4.850 1.318 -4.036 1.00 0.00 O ATOM 349 CB HIS A 24 -3.023 0.358 -5.790 1.00 0.00 C ATOM 350 CG HIS A 24 -1.760 -0.384 -6.100 1.00 0.00 C ATOM 351 ND1 HIS A 24 -0.782 -0.629 -5.159 1.00 0.00 N ATOM 352 CD2 HIS A 24 -1.308 -0.923 -7.258 1.00 0.00 C ATOM 353 CE1 HIS A 24 0.218 -1.284 -5.726 1.00 0.00 C ATOM 354 NE2 HIS A 24 -0.078 -1.474 -6.998 1.00 0.00 N ATOM 0 H HIS A 24 -4.721 -0.504 -7.406 1.00 0.00 H new ATOM 0 HA HIS A 24 -3.822 -1.382 -4.803 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.311 0.943 -6.663 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.828 1.064 -4.983 1.00 0.00 H new ATOM 0 HD1 HIS A 24 -0.823 -0.349 -4.179 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -1.820 -0.920 -8.209 1.00 0.00 H new ATOM 0 HE1 HIS A 24 1.122 -1.608 -5.232 1.00 0.00 H new ATOM 363 N TRP A 25 -6.374 -0.285 -4.401 1.00 0.00 N ATOM 364 CA TRP A 25 -7.407 0.392 -3.642 1.00 0.00 C ATOM 365 C TRP A 25 -8.602 -0.518 -3.399 1.00 0.00 C ATOM 366 O TRP A 25 -9.679 -0.056 -3.022 1.00 0.00 O ATOM 367 CB TRP A 25 -7.832 1.630 -4.416 1.00 0.00 C ATOM 368 CG TRP A 25 -7.526 1.507 -5.881 1.00 0.00 C ATOM 369 CD1 TRP A 25 -8.265 0.834 -6.795 1.00 0.00 C ATOM 370 CD2 TRP A 25 -6.396 2.044 -6.600 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.666 0.898 -8.023 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.532 1.642 -7.937 1.00 0.00 C ATOM 373 CE3 TRP A 25 -5.287 2.821 -6.258 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -5.614 1.983 -8.926 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -4.376 3.160 -7.239 1.00 0.00 C ATOM 376 CH2 TRP A 25 -4.545 2.743 -8.558 1.00 0.00 C ATOM 0 H TRP A 25 -6.658 -1.178 -4.804 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.013 0.673 -2.665 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.901 1.793 -4.281 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.322 2.504 -4.011 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -9.192 0.322 -6.585 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -8.016 0.455 -8.873 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -5.144 3.152 -5.240 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -5.744 1.657 -9.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -3.516 3.760 -6.979 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -3.815 3.027 -9.302 1.00 0.00 H new ATOM 387 N ARG A 26 -8.408 -1.815 -3.610 1.00 0.00 N ATOM 388 CA ARG A 26 -9.474 -2.786 -3.403 1.00 0.00 C ATOM 389 C ARG A 26 -10.104 -2.600 -2.025 1.00 0.00 C ATOM 390 O ARG A 26 -11.269 -2.939 -1.816 1.00 0.00 O ATOM 391 CB ARG A 26 -8.942 -4.214 -3.547 1.00 0.00 C ATOM 392 CG ARG A 26 -9.675 -5.033 -4.597 1.00 0.00 C ATOM 393 CD ARG A 26 -9.351 -6.512 -4.476 1.00 0.00 C ATOM 394 NE ARG A 26 -9.562 -7.225 -5.735 1.00 0.00 N ATOM 395 CZ ARG A 26 -10.757 -7.597 -6.184 1.00 0.00 C ATOM 396 NH1 ARG A 26 -11.851 -7.324 -5.485 1.00 0.00 N ATOM 397 NH2 ARG A 26 -10.861 -8.245 -7.336 1.00 0.00 N ATOM 0 H ARG A 26 -7.524 -2.217 -3.923 1.00 0.00 H new ATOM 0 HA ARG A 26 -10.236 -2.621 -4.165 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -7.883 -4.174 -3.803 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.019 -4.720 -2.585 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -10.750 -4.885 -4.490 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -9.402 -4.680 -5.591 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -8.314 -6.631 -4.162 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -9.973 -6.957 -3.699 1.00 0.00 H new ATOM 0 HE ARG A 26 -8.745 -7.450 -6.302 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -11.778 -6.826 -4.598 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -12.765 -7.612 -5.835 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -10.024 -8.458 -7.878 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -11.778 -8.530 -7.680 1.00 0.00 H new ATOM 411 N THR A 27 -9.319 -2.049 -1.092 1.00 0.00 N ATOM 412 CA THR A 27 -9.780 -1.792 0.275 1.00 0.00 C ATOM 413 C THR A 27 -9.505 -2.983 1.188 1.00 0.00 C ATOM 414 O THR A 27 -9.373 -4.117 0.727 1.00 0.00 O ATOM 415 CB THR A 27 -11.273 -1.446 0.299 1.00 0.00 C ATOM 416 OG1 THR A 27 -11.626 -0.679 -0.839 1.00 0.00 O ATOM 417 CG2 THR A 27 -11.687 -0.661 1.522 1.00 0.00 C ATOM 0 H THR A 27 -8.353 -1.771 -1.263 1.00 0.00 H new ATOM 0 HA THR A 27 -9.218 -0.936 0.649 1.00 0.00 H new ATOM 0 HB THR A 27 -11.791 -2.405 0.310 1.00 0.00 H new ATOM 0 HG1 THR A 27 -11.990 -1.269 -1.531 1.00 0.00 H new ATOM 0 HG21 THR A 27 -12.755 -0.450 1.474 1.00 0.00 H new ATOM 0 HG22 THR A 27 -11.472 -1.243 2.418 1.00 0.00 H new ATOM 0 HG23 THR A 27 -11.133 0.277 1.557 1.00 0.00 H new ATOM 425 N LEU A 28 -9.417 -2.711 2.488 1.00 0.00 N ATOM 426 CA LEU A 28 -9.155 -3.752 3.475 1.00 0.00 C ATOM 427 C LEU A 28 -10.367 -4.663 3.643 1.00 0.00 C ATOM 428 O LEU A 28 -10.231 -5.823 4.030 1.00 0.00 O ATOM 429 CB LEU A 28 -8.783 -3.125 4.820 1.00 0.00 C ATOM 430 CG LEU A 28 -7.323 -2.679 4.943 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.241 -1.220 5.371 1.00 0.00 C ATOM 432 CD2 LEU A 28 -6.572 -3.565 5.926 1.00 0.00 C ATOM 0 H LEU A 28 -9.524 -1.776 2.882 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.319 -4.354 3.118 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.427 -2.262 4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -8.996 -3.844 5.611 1.00 0.00 H new ATOM 0 HG LEU A 28 -6.854 -2.777 3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.195 -0.923 5.453 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.739 -0.595 4.630 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -7.730 -1.096 6.337 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -5.537 -3.232 5.999 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.044 -3.502 6.907 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.597 -4.598 5.578 1.00 0.00 H new ATOM 444 N GLU A 29 -11.550 -4.135 3.348 1.00 0.00 N ATOM 445 CA GLU A 29 -12.777 -4.912 3.466 1.00 0.00 C ATOM 446 C GLU A 29 -12.711 -6.161 2.593 1.00 0.00 C ATOM 447 O GLU A 29 -12.762 -7.285 3.092 1.00 0.00 O ATOM 448 CB GLU A 29 -13.985 -4.058 3.073 1.00 0.00 C ATOM 449 CG GLU A 29 -15.177 -4.232 3.999 1.00 0.00 C ATOM 450 CD GLU A 29 -16.385 -4.817 3.292 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.278 -5.946 2.770 1.00 0.00 O ATOM 452 OE2 GLU A 29 -17.438 -4.145 3.263 1.00 0.00 O ATOM 0 H GLU A 29 -11.684 -3.176 3.027 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.887 -5.223 4.505 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.691 -3.008 3.065 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.285 -4.312 2.056 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.896 -4.881 4.828 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -15.444 -3.266 4.427 1.00 0.00 H new ATOM 459 N ASP A 30 -12.590 -5.953 1.286 1.00 0.00 N ATOM 460 CA ASP A 30 -12.508 -7.060 0.339 1.00 0.00 C ATOM 461 C ASP A 30 -11.066 -7.537 0.184 1.00 0.00 C ATOM 462 O ASP A 30 -10.818 -8.699 -0.142 1.00 0.00 O ATOM 463 CB ASP A 30 -13.071 -6.636 -1.020 1.00 0.00 C ATOM 464 CG ASP A 30 -14.194 -7.542 -1.487 1.00 0.00 C ATOM 465 OD1 ASP A 30 -13.897 -8.646 -1.992 1.00 0.00 O ATOM 466 OD2 ASP A 30 -15.372 -7.147 -1.346 1.00 0.00 O ATOM 0 H ASP A 30 -12.547 -5.028 0.858 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.103 -7.886 0.728 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.437 -5.611 -0.955 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.271 -6.642 -1.760 1.00 0.00 H new ATOM 471 N GLY A 31 -10.120 -6.633 0.418 1.00 0.00 N ATOM 472 CA GLY A 31 -8.715 -6.979 0.299 1.00 0.00 C ATOM 473 C GLY A 31 -8.247 -7.897 1.411 1.00 0.00 C ATOM 474 O GLY A 31 -7.548 -8.878 1.162 1.00 0.00 O ATOM 0 H GLY A 31 -10.301 -5.666 0.688 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.543 -7.462 -0.663 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.118 -6.067 0.309 1.00 0.00 H new ATOM 478 N LYS A 32 -8.633 -7.577 2.643 1.00 0.00 N ATOM 479 CA LYS A 32 -8.247 -8.383 3.797 1.00 0.00 C ATOM 480 C LYS A 32 -9.031 -9.691 3.833 1.00 0.00 C ATOM 481 O LYS A 32 -8.463 -10.759 4.059 1.00 0.00 O ATOM 482 CB LYS A 32 -8.476 -7.604 5.093 1.00 0.00 C ATOM 483 CG LYS A 32 -7.811 -8.237 6.306 1.00 0.00 C ATOM 484 CD LYS A 32 -8.165 -7.497 7.586 1.00 0.00 C ATOM 485 CE LYS A 32 -9.391 -8.096 8.258 1.00 0.00 C ATOM 486 NZ LYS A 32 -10.533 -7.140 8.283 1.00 0.00 N ATOM 0 H LYS A 32 -9.211 -6.767 2.868 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.186 -8.616 3.705 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.098 -6.589 4.969 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -9.548 -7.525 5.276 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.121 -9.279 6.389 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -6.729 -8.236 6.171 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -7.319 -7.532 8.273 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.350 -6.447 7.361 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -9.688 -9.002 7.730 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.140 -8.388 9.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -11.349 -7.586 8.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -10.259 -6.285 8.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.790 -6.880 7.309 1.00 0.00 H new ATOM 500 N LYS A 33 -10.338 -9.599 3.605 1.00 0.00 N ATOM 501 CA LYS A 33 -11.198 -10.777 3.608 1.00 0.00 C ATOM 502 C LYS A 33 -10.700 -11.813 2.606 1.00 0.00 C ATOM 503 O LYS A 33 -10.802 -13.018 2.840 1.00 0.00 O ATOM 504 CB LYS A 33 -12.639 -10.383 3.281 1.00 0.00 C ATOM 505 CG LYS A 33 -13.637 -11.514 3.465 1.00 0.00 C ATOM 506 CD LYS A 33 -14.633 -11.571 2.317 1.00 0.00 C ATOM 507 CE LYS A 33 -15.022 -13.002 1.989 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.971 -13.072 0.843 1.00 0.00 N ATOM 0 H LYS A 33 -10.824 -8.722 3.416 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.168 -11.218 4.605 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -12.931 -9.546 3.915 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.686 -10.033 2.250 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -13.105 -12.463 3.534 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.171 -11.380 4.405 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.525 -11.001 2.579 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.201 -11.099 1.435 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.126 -13.577 1.754 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.476 -13.464 2.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -16.211 -14.066 0.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -16.837 -12.545 1.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -15.528 -12.654 -0.000 1.00 0.00 H new ATOM 522 N GLU A 34 -10.155 -11.334 1.494 1.00 0.00 N ATOM 523 CA GLU A 34 -9.634 -12.217 0.458 1.00 0.00 C ATOM 524 C GLU A 34 -8.151 -12.494 0.683 1.00 0.00 C ATOM 525 O GLU A 34 -7.650 -13.562 0.334 1.00 0.00 O ATOM 526 CB GLU A 34 -9.844 -11.603 -0.926 1.00 0.00 C ATOM 527 CG GLU A 34 -9.320 -12.472 -2.056 1.00 0.00 C ATOM 528 CD GLU A 34 -10.182 -12.397 -3.299 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.063 -11.402 -4.045 1.00 0.00 O ATOM 530 OE2 GLU A 34 -10.978 -13.332 -3.529 1.00 0.00 O ATOM 0 H GLU A 34 -10.062 -10.340 1.287 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.179 -13.160 0.512 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.908 -11.424 -1.078 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.349 -10.633 -0.964 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.304 -12.165 -2.304 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.266 -13.507 -1.718 1.00 0.00 H new ATOM 537 N ALA A 35 -7.456 -11.526 1.270 1.00 0.00 N ATOM 538 CA ALA A 35 -6.032 -11.668 1.544 1.00 0.00 C ATOM 539 C ALA A 35 -5.768 -12.864 2.450 1.00 0.00 C ATOM 540 O ALA A 35 -4.700 -13.470 2.398 1.00 0.00 O ATOM 541 CB ALA A 35 -5.480 -10.397 2.173 1.00 0.00 C ATOM 0 H ALA A 35 -7.856 -10.635 1.565 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.522 -11.839 0.596 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.415 -10.522 2.371 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.627 -9.560 1.491 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.002 -10.198 3.109 1.00 0.00 H new ATOM 547 N ALA A 36 -6.752 -13.194 3.281 1.00 0.00 N ATOM 548 CA ALA A 36 -6.632 -14.316 4.203 1.00 0.00 C ATOM 549 C ALA A 36 -6.697 -15.648 3.465 1.00 0.00 C ATOM 550 O ALA A 36 -5.960 -16.582 3.783 1.00 0.00 O ATOM 551 CB ALA A 36 -7.725 -14.242 5.258 1.00 0.00 C ATOM 0 H ALA A 36 -7.642 -12.699 3.334 1.00 0.00 H new ATOM 0 HA ALA A 36 -5.659 -14.252 4.691 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -7.627 -15.085 5.943 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -7.631 -13.309 5.814 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -8.701 -14.279 4.774 1.00 0.00 H new ATOM 557 N ALA A 37 -7.584 -15.731 2.477 1.00 0.00 N ATOM 558 CA ALA A 37 -7.745 -16.952 1.692 1.00 0.00 C ATOM 559 C ALA A 37 -6.411 -17.417 1.117 1.00 0.00 C ATOM 560 O ALA A 37 -5.863 -18.435 1.540 1.00 0.00 O ATOM 561 CB ALA A 37 -8.756 -16.733 0.577 1.00 0.00 C ATOM 0 H ALA A 37 -8.202 -14.968 2.201 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.116 -17.734 2.355 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.866 -17.651 0.000 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.719 -16.458 1.008 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.409 -15.933 -0.077 1.00 0.00 H new ATOM 567 N SER A 38 -5.892 -16.664 0.155 1.00 0.00 N ATOM 568 CA SER A 38 -4.618 -16.999 -0.473 1.00 0.00 C ATOM 569 C SER A 38 -3.452 -16.628 0.438 1.00 0.00 C ATOM 570 O SER A 38 -2.371 -17.213 0.347 1.00 0.00 O ATOM 571 CB SER A 38 -4.481 -16.278 -1.816 1.00 0.00 C ATOM 572 OG SER A 38 -5.590 -16.552 -2.657 1.00 0.00 O ATOM 0 H SER A 38 -6.332 -15.818 -0.208 1.00 0.00 H new ATOM 0 HA SER A 38 -4.596 -18.075 -0.644 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.403 -15.204 -1.649 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.561 -16.592 -2.309 1.00 0.00 H new ATOM 0 HG SER A 38 -5.480 -16.079 -3.508 1.00 0.00 H new ATOM 578 N GLY A 39 -3.677 -15.653 1.313 1.00 0.00 N ATOM 579 CA GLY A 39 -2.636 -15.221 2.227 1.00 0.00 C ATOM 580 C GLY A 39 -1.754 -14.145 1.627 1.00 0.00 C ATOM 581 O GLY A 39 -0.604 -13.980 2.036 1.00 0.00 O ATOM 0 H GLY A 39 -4.562 -15.154 1.405 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.093 -14.845 3.142 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.022 -16.077 2.506 1.00 0.00 H new ATOM 585 N LEU A 40 -2.288 -13.412 0.656 1.00 0.00 N ATOM 586 CA LEU A 40 -1.532 -12.348 0.007 1.00 0.00 C ATOM 587 C LEU A 40 -1.487 -11.106 0.900 1.00 0.00 C ATOM 588 O LEU A 40 -2.496 -10.721 1.491 1.00 0.00 O ATOM 589 CB LEU A 40 -2.138 -12.009 -1.359 1.00 0.00 C ATOM 590 CG LEU A 40 -3.596 -11.547 -1.334 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.680 -10.060 -1.030 1.00 0.00 C ATOM 592 CD2 LEU A 40 -4.285 -11.864 -2.656 1.00 0.00 C ATOM 0 H LEU A 40 -3.237 -13.534 0.303 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.512 -12.697 -0.151 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.535 -11.227 -1.821 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.064 -12.889 -1.999 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.112 -12.089 -0.542 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.725 -9.750 -1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.230 -9.861 -0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.146 -9.501 -1.798 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.321 -11.527 -2.616 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.768 -11.352 -3.468 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -4.260 -12.940 -2.831 1.00 0.00 H new ATOM 604 N PRO A 41 -0.305 -10.472 1.022 1.00 0.00 N ATOM 605 CA PRO A 41 -0.126 -9.279 1.863 1.00 0.00 C ATOM 606 C PRO A 41 -0.939 -8.083 1.384 1.00 0.00 C ATOM 607 O PRO A 41 -1.588 -8.134 0.337 1.00 0.00 O ATOM 608 CB PRO A 41 1.373 -8.981 1.753 1.00 0.00 C ATOM 609 CG PRO A 41 1.806 -9.647 0.494 1.00 0.00 C ATOM 610 CD PRO A 41 0.950 -10.873 0.365 1.00 0.00 C ATOM 0 HA PRO A 41 -0.469 -9.458 2.882 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.561 -7.908 1.717 1.00 0.00 H new ATOM 0 HB3 PRO A 41 1.917 -9.371 2.613 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.675 -8.986 -0.363 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.863 -9.910 0.534 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.790 -11.146 -0.678 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.404 -11.735 0.854 1.00 0.00 H new ATOM 618 N LEU A 42 -0.900 -7.004 2.163 1.00 0.00 N ATOM 619 CA LEU A 42 -1.629 -5.795 1.824 1.00 0.00 C ATOM 620 C LEU A 42 -0.674 -4.630 1.595 1.00 0.00 C ATOM 621 O LEU A 42 0.386 -4.546 2.213 1.00 0.00 O ATOM 622 CB LEU A 42 -2.621 -5.444 2.935 1.00 0.00 C ATOM 623 CG LEU A 42 -4.041 -5.969 2.722 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.055 -7.490 2.761 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.983 -5.395 3.769 1.00 0.00 C ATOM 0 H LEU A 42 -0.370 -6.947 3.032 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.178 -5.979 0.900 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.242 -5.838 3.878 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.662 -4.359 3.036 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.387 -5.648 1.739 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.073 -7.849 2.608 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.410 -7.880 1.973 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.692 -7.832 3.730 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.989 -5.779 3.603 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.643 -5.686 4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.992 -4.308 3.693 1.00 0.00 H new ATOM 637 N MET A 43 -1.071 -3.731 0.704 1.00 0.00 N ATOM 638 CA MET A 43 -0.271 -2.555 0.382 1.00 0.00 C ATOM 639 C MET A 43 -1.121 -1.294 0.535 1.00 0.00 C ATOM 640 O MET A 43 -2.347 -1.369 0.545 1.00 0.00 O ATOM 641 CB MET A 43 0.274 -2.664 -1.044 1.00 0.00 C ATOM 642 CG MET A 43 1.081 -1.454 -1.491 1.00 0.00 C ATOM 643 SD MET A 43 2.587 -1.902 -2.379 1.00 0.00 S ATOM 644 CE MET A 43 2.003 -3.261 -3.387 1.00 0.00 C ATOM 0 H MET A 43 -1.948 -3.794 0.188 1.00 0.00 H new ATOM 0 HA MET A 43 0.572 -2.496 1.070 1.00 0.00 H new ATOM 0 HB2 MET A 43 0.901 -3.553 -1.116 1.00 0.00 H new ATOM 0 HB3 MET A 43 -0.560 -2.806 -1.731 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.461 -0.827 -2.131 1.00 0.00 H new ATOM 0 HG3 MET A 43 1.344 -0.857 -0.618 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.664 -3.388 -4.244 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.996 -4.176 -2.795 1.00 0.00 H new ATOM 0 HE3 MET A 43 0.993 -3.047 -3.736 1.00 0.00 H new ATOM 654 N VAL A 44 -0.469 -0.144 0.670 1.00 0.00 N ATOM 655 CA VAL A 44 -1.184 1.114 0.836 1.00 0.00 C ATOM 656 C VAL A 44 -0.589 2.221 -0.029 1.00 0.00 C ATOM 657 O VAL A 44 0.611 2.489 0.022 1.00 0.00 O ATOM 658 CB VAL A 44 -1.176 1.576 2.307 1.00 0.00 C ATOM 659 CG1 VAL A 44 -1.911 2.898 2.469 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.791 0.510 3.198 1.00 0.00 C ATOM 0 H VAL A 44 0.547 -0.058 0.668 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.210 0.927 0.520 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.140 1.729 2.610 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.890 3.200 3.516 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.425 3.661 1.861 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.945 2.781 2.146 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.779 0.850 4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.820 0.326 2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.216 -0.412 3.112 1.00 0.00 H new ATOM 670 N ILE A 45 -1.448 2.870 -0.807 1.00 0.00 N ATOM 671 CA ILE A 45 -1.034 3.964 -1.670 1.00 0.00 C ATOM 672 C ILE A 45 -1.856 5.213 -1.355 1.00 0.00 C ATOM 673 O ILE A 45 -3.001 5.352 -1.786 1.00 0.00 O ATOM 674 CB ILE A 45 -1.187 3.597 -3.165 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.311 2.384 -3.499 1.00 0.00 C ATOM 676 CG2 ILE A 45 -0.827 4.781 -4.056 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.151 2.138 -4.986 1.00 0.00 C ATOM 0 H ILE A 45 -2.443 2.653 -0.856 1.00 0.00 H new ATOM 0 HA ILE A 45 0.021 4.161 -1.479 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.230 3.341 -3.354 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.674 2.526 -3.055 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.744 1.496 -3.038 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -0.943 4.498 -5.102 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.487 5.619 -3.832 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.207 5.074 -3.872 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.481 1.264 -5.144 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.130 1.964 -5.433 1.00 0.00 H new ATOM 0 HD13 ILE A 45 0.311 3.009 -5.451 1.00 0.00 H new ATOM 689 N ILE A 46 -1.266 6.118 -0.587 1.00 0.00 N ATOM 690 CA ILE A 46 -1.946 7.345 -0.207 1.00 0.00 C ATOM 691 C ILE A 46 -1.312 8.541 -0.903 1.00 0.00 C ATOM 692 O ILE A 46 -0.102 8.565 -1.128 1.00 0.00 O ATOM 693 CB ILE A 46 -1.903 7.564 1.319 1.00 0.00 C ATOM 694 CG1 ILE A 46 -2.097 6.241 2.065 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.963 8.568 1.745 1.00 0.00 C ATOM 696 CD1 ILE A 46 -1.150 6.070 3.230 1.00 0.00 C ATOM 0 H ILE A 46 -0.320 6.025 -0.216 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.987 7.250 -0.516 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.921 7.963 1.575 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.123 6.183 2.428 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.958 5.415 1.368 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.917 8.709 2.825 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.783 9.520 1.246 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.949 8.195 1.470 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.340 5.113 3.716 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -0.122 6.097 2.870 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.305 6.877 3.946 1.00 0.00 H new ATOM 708 N HIS A 47 -2.129 9.525 -1.253 1.00 0.00 N ATOM 709 CA HIS A 47 -1.625 10.715 -1.932 1.00 0.00 C ATOM 710 C HIS A 47 -2.254 11.981 -1.368 1.00 0.00 C ATOM 711 O HIS A 47 -3.402 12.300 -1.675 1.00 0.00 O ATOM 712 CB HIS A 47 -1.897 10.640 -3.437 1.00 0.00 C ATOM 713 CG HIS A 47 -1.853 9.254 -3.998 1.00 0.00 C ATOM 714 ND1 HIS A 47 -0.805 8.781 -4.756 1.00 0.00 N ATOM 715 CD2 HIS A 47 -2.749 8.244 -3.924 1.00 0.00 C ATOM 716 CE1 HIS A 47 -1.058 7.539 -5.126 1.00 0.00 C ATOM 717 NE2 HIS A 47 -2.233 7.188 -4.634 1.00 0.00 N ATOM 0 H HIS A 47 -3.134 9.526 -1.081 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.549 10.752 -1.763 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.877 11.071 -3.640 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.164 11.255 -3.959 1.00 0.00 H new ATOM 0 HD1 HIS A 47 0.035 9.308 -4.994 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.695 8.264 -3.403 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -0.414 6.916 -5.729 1.00 0.00 H new ATOM 726 N LYS A 48 -1.499 12.707 -0.551 1.00 0.00 N ATOM 727 CA LYS A 48 -2.010 13.947 0.039 1.00 0.00 C ATOM 728 C LYS A 48 -1.205 15.160 -0.421 1.00 0.00 C ATOM 729 O LYS A 48 -0.070 15.031 -0.879 1.00 0.00 O ATOM 730 CB LYS A 48 -2.003 13.863 1.564 1.00 0.00 C ATOM 731 CG LYS A 48 -3.389 13.706 2.171 1.00 0.00 C ATOM 732 CD LYS A 48 -3.984 15.051 2.563 1.00 0.00 C ATOM 733 CE LYS A 48 -4.704 15.708 1.394 1.00 0.00 C ATOM 734 NZ LYS A 48 -4.555 17.190 1.414 1.00 0.00 N ATOM 0 H LYS A 48 -0.545 12.467 -0.283 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.037 14.072 -0.304 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.384 13.020 1.870 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.539 14.763 1.967 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.046 13.211 1.456 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.332 13.063 3.049 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.681 14.914 3.390 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.192 15.710 2.920 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -4.309 15.316 0.457 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -5.762 15.449 1.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -4.878 17.584 0.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -5.127 17.586 2.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.555 17.436 1.562 1.00 0.00 H new ATOM 748 N SER A 49 -1.806 16.343 -0.287 1.00 0.00 N ATOM 749 CA SER A 49 -1.157 17.590 -0.680 1.00 0.00 C ATOM 750 C SER A 49 -0.834 17.597 -2.169 1.00 0.00 C ATOM 751 O SER A 49 -1.245 16.703 -2.907 1.00 0.00 O ATOM 752 CB SER A 49 0.124 17.797 0.131 1.00 0.00 C ATOM 753 OG SER A 49 -0.063 18.779 1.135 1.00 0.00 O ATOM 0 H SER A 49 -2.745 16.462 0.093 1.00 0.00 H new ATOM 0 HA SER A 49 -1.849 18.407 -0.476 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.424 16.855 0.590 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.934 18.100 -0.533 1.00 0.00 H new ATOM 0 HG SER A 49 0.738 19.341 1.197 1.00 0.00 H new ATOM 759 N TRP A 50 -0.093 18.614 -2.602 1.00 0.00 N ATOM 760 CA TRP A 50 0.296 18.739 -4.002 1.00 0.00 C ATOM 761 C TRP A 50 1.250 17.612 -4.385 1.00 0.00 C ATOM 762 O TRP A 50 2.441 17.833 -4.600 1.00 0.00 O ATOM 763 CB TRP A 50 0.952 20.100 -4.257 1.00 0.00 C ATOM 764 CG TRP A 50 1.971 20.473 -3.223 1.00 0.00 C ATOM 765 CD1 TRP A 50 3.290 20.123 -3.210 1.00 0.00 C ATOM 766 CD2 TRP A 50 1.752 21.267 -2.051 1.00 0.00 C ATOM 767 NE1 TRP A 50 3.906 20.650 -2.100 1.00 0.00 N ATOM 768 CE2 TRP A 50 2.984 21.357 -1.375 1.00 0.00 C ATOM 769 CE3 TRP A 50 0.638 21.911 -1.508 1.00 0.00 C ATOM 770 CZ2 TRP A 50 3.129 22.064 -0.184 1.00 0.00 C ATOM 771 CZ3 TRP A 50 0.783 22.613 -0.326 1.00 0.00 C ATOM 772 CH2 TRP A 50 2.021 22.685 0.325 1.00 0.00 C ATOM 0 H TRP A 50 0.250 19.364 -2.002 1.00 0.00 H new ATOM 0 HA TRP A 50 -0.599 18.666 -4.619 1.00 0.00 H new ATOM 0 HB2 TRP A 50 1.428 20.088 -5.237 1.00 0.00 H new ATOM 0 HB3 TRP A 50 0.179 20.868 -4.288 1.00 0.00 H new ATOM 0 HD1 TRP A 50 3.778 19.520 -3.962 1.00 0.00 H new ATOM 0 HE1 TRP A 50 4.890 20.533 -1.856 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -0.321 21.861 -2.003 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 4.082 22.120 0.320 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.072 23.114 0.102 1.00 0.00 H new ATOM 0 HH2 TRP A 50 2.103 23.242 1.247 1.00 0.00 H new ATOM 783 N CYS A 51 0.711 16.400 -4.447 1.00 0.00 N ATOM 784 CA CYS A 51 1.496 15.221 -4.780 1.00 0.00 C ATOM 785 C CYS A 51 1.625 15.051 -6.298 1.00 0.00 C ATOM 786 O CYS A 51 0.640 15.162 -7.028 1.00 0.00 O ATOM 787 CB CYS A 51 0.840 13.982 -4.139 1.00 0.00 C ATOM 788 SG CYS A 51 0.787 12.483 -5.182 1.00 0.00 S ATOM 0 H CYS A 51 -0.275 16.209 -4.269 1.00 0.00 H new ATOM 0 HA CYS A 51 2.505 15.340 -4.384 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.377 13.744 -3.221 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.180 14.240 -3.854 1.00 0.00 H new ATOM 793 N GLY A 52 2.840 14.764 -6.763 1.00 0.00 N ATOM 794 CA GLY A 52 3.062 14.561 -8.187 1.00 0.00 C ATOM 795 C GLY A 52 3.086 13.092 -8.540 1.00 0.00 C ATOM 796 O GLY A 52 2.713 12.703 -9.645 1.00 0.00 O ATOM 0 H GLY A 52 3.672 14.669 -6.181 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.276 15.060 -8.754 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.006 15.022 -8.478 1.00 0.00 H new ATOM 800 N ALA A 53 3.505 12.268 -7.581 1.00 0.00 N ATOM 801 CA ALA A 53 3.550 10.826 -7.778 1.00 0.00 C ATOM 802 C ALA A 53 2.173 10.301 -8.153 1.00 0.00 C ATOM 803 O ALA A 53 2.036 9.179 -8.634 1.00 0.00 O ATOM 804 CB ALA A 53 4.068 10.129 -6.529 1.00 0.00 C ATOM 0 H ALA A 53 3.818 12.577 -6.661 1.00 0.00 H new ATOM 0 HA ALA A 53 4.237 10.611 -8.596 1.00 0.00 H new ATOM 0 HB1 ALA A 53 4.094 9.052 -6.697 1.00 0.00 H new ATOM 0 HB2 ALA A 53 5.073 10.485 -6.304 1.00 0.00 H new ATOM 0 HB3 ALA A 53 3.409 10.349 -5.689 1.00 0.00 H new ATOM 810 N CYS A 54 1.158 11.129 -7.940 1.00 0.00 N ATOM 811 CA CYS A 54 -0.203 10.765 -8.270 1.00 0.00 C ATOM 812 C CYS A 54 -0.626 11.468 -9.553 1.00 0.00 C ATOM 813 O CYS A 54 -1.377 10.919 -10.367 1.00 0.00 O ATOM 814 CB CYS A 54 -1.149 11.128 -7.119 1.00 0.00 C ATOM 815 SG CYS A 54 -0.840 12.765 -6.370 1.00 0.00 S ATOM 0 H CYS A 54 1.259 12.061 -7.538 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.255 9.687 -8.425 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.175 11.099 -7.486 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.066 10.366 -6.344 1.00 0.00 H new ATOM 820 N LYS A 55 -0.119 12.681 -9.741 1.00 0.00 N ATOM 821 CA LYS A 55 -0.420 13.452 -10.934 1.00 0.00 C ATOM 822 C LYS A 55 -0.020 12.664 -12.174 1.00 0.00 C ATOM 823 O LYS A 55 -0.777 12.576 -13.140 1.00 0.00 O ATOM 824 CB LYS A 55 0.308 14.796 -10.907 1.00 0.00 C ATOM 825 CG LYS A 55 -0.383 15.876 -11.723 1.00 0.00 C ATOM 826 CD LYS A 55 0.562 17.023 -12.047 1.00 0.00 C ATOM 827 CE LYS A 55 0.247 18.257 -11.217 1.00 0.00 C ATOM 828 NZ LYS A 55 1.190 18.411 -10.075 1.00 0.00 N ATOM 0 H LYS A 55 0.502 13.149 -9.081 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.493 13.644 -10.962 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.395 15.132 -9.874 1.00 0.00 H new ATOM 0 HB3 LYS A 55 1.321 14.659 -11.284 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.764 15.445 -12.649 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.242 16.257 -11.171 1.00 0.00 H new ATOM 0 HD2 LYS A 55 1.590 16.712 -11.862 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.489 17.268 -13.107 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.295 19.143 -11.850 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.773 18.190 -10.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 0.943 19.263 -9.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.126 17.577 -9.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.161 18.500 -10.436 1.00 0.00 H new ATOM 842 N ALA A 56 1.173 12.076 -12.129 1.00 0.00 N ATOM 843 CA ALA A 56 1.666 11.279 -13.246 1.00 0.00 C ATOM 844 C ALA A 56 0.975 9.920 -13.292 1.00 0.00 C ATOM 845 O ALA A 56 0.885 9.295 -14.349 1.00 0.00 O ATOM 846 CB ALA A 56 3.176 11.111 -13.143 1.00 0.00 C ATOM 0 H ALA A 56 1.812 12.136 -11.336 1.00 0.00 H new ATOM 0 HA ALA A 56 1.435 11.804 -14.173 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.534 10.514 -13.982 1.00 0.00 H new ATOM 0 HB2 ALA A 56 3.653 12.091 -13.165 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.423 10.608 -12.208 1.00 0.00 H new ATOM 852 N LEU A 57 0.488 9.466 -12.139 1.00 0.00 N ATOM 853 CA LEU A 57 -0.195 8.178 -12.042 1.00 0.00 C ATOM 854 C LEU A 57 -1.417 8.130 -12.955 1.00 0.00 C ATOM 855 O LEU A 57 -1.815 7.069 -13.418 1.00 0.00 O ATOM 856 CB LEU A 57 -0.620 7.913 -10.591 1.00 0.00 C ATOM 857 CG LEU A 57 0.398 7.165 -9.713 1.00 0.00 C ATOM 858 CD1 LEU A 57 -0.068 5.741 -9.453 1.00 0.00 C ATOM 859 CD2 LEU A 57 1.787 7.167 -10.341 1.00 0.00 C ATOM 0 H LEU A 57 0.554 9.973 -11.256 1.00 0.00 H new ATOM 0 HA LEU A 57 0.502 7.404 -12.363 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.843 8.870 -10.119 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.547 7.341 -10.604 1.00 0.00 H new ATOM 0 HG LEU A 57 0.465 7.691 -8.761 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.664 5.227 -8.830 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.030 5.761 -8.941 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.173 5.214 -10.401 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.480 6.630 -9.693 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.747 6.678 -11.314 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.129 8.195 -10.465 1.00 0.00 H new ATOM 871 N LYS A 58 -2.022 9.278 -13.195 1.00 0.00 N ATOM 872 CA LYS A 58 -3.211 9.339 -14.040 1.00 0.00 C ATOM 873 C LYS A 58 -3.004 8.646 -15.403 1.00 0.00 C ATOM 874 O LYS A 58 -3.573 7.579 -15.657 1.00 0.00 O ATOM 875 CB LYS A 58 -3.637 10.797 -14.250 1.00 0.00 C ATOM 876 CG LYS A 58 -4.720 11.268 -13.296 1.00 0.00 C ATOM 877 CD LYS A 58 -5.179 12.679 -13.626 1.00 0.00 C ATOM 878 CE LYS A 58 -4.026 13.671 -13.566 1.00 0.00 C ATOM 879 NZ LYS A 58 -4.505 15.067 -13.365 1.00 0.00 N ATOM 0 H LYS A 58 -1.717 10.177 -12.823 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.001 8.797 -13.520 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.764 11.440 -14.138 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.992 10.917 -15.274 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.570 10.587 -13.344 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.344 11.236 -12.273 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.622 12.695 -14.622 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -5.958 12.982 -12.926 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.353 13.397 -12.753 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.450 13.614 -14.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.690 15.712 -13.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.127 15.338 -14.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.033 15.127 -12.471 1.00 0.00 H new ATOM 893 N PRO A 59 -2.199 9.245 -16.304 1.00 0.00 N ATOM 894 CA PRO A 59 -1.954 8.694 -17.646 1.00 0.00 C ATOM 895 C PRO A 59 -0.948 7.549 -17.678 1.00 0.00 C ATOM 896 O PRO A 59 -0.857 6.827 -18.669 1.00 0.00 O ATOM 897 CB PRO A 59 -1.394 9.894 -18.402 1.00 0.00 C ATOM 898 CG PRO A 59 -0.666 10.666 -17.361 1.00 0.00 C ATOM 899 CD PRO A 59 -1.472 10.511 -16.097 1.00 0.00 C ATOM 0 HA PRO A 59 -2.863 8.261 -18.064 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.728 9.583 -19.207 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -2.189 10.486 -18.856 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.347 10.285 -17.228 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.578 11.715 -17.642 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.832 10.467 -15.216 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -2.156 11.347 -15.952 1.00 0.00 H new ATOM 907 N LYS A 60 -0.193 7.383 -16.605 1.00 0.00 N ATOM 908 CA LYS A 60 0.799 6.320 -16.547 1.00 0.00 C ATOM 909 C LYS A 60 0.225 5.092 -15.865 1.00 0.00 C ATOM 910 O LYS A 60 0.337 3.981 -16.378 1.00 0.00 O ATOM 911 CB LYS A 60 2.055 6.787 -15.814 1.00 0.00 C ATOM 912 CG LYS A 60 1.932 6.685 -14.304 1.00 0.00 C ATOM 913 CD LYS A 60 3.073 7.380 -13.561 1.00 0.00 C ATOM 914 CE LYS A 60 4.178 7.883 -14.491 1.00 0.00 C ATOM 915 NZ LYS A 60 3.805 9.158 -15.165 1.00 0.00 N ATOM 0 H LYS A 60 -0.246 7.964 -15.769 1.00 0.00 H new ATOM 0 HA LYS A 60 1.072 6.059 -17.569 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.905 6.191 -16.145 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.265 7.821 -16.087 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.984 7.123 -13.992 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.907 5.634 -14.018 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.671 8.221 -12.996 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.503 6.687 -12.838 1.00 0.00 H new ATOM 0 HE2 LYS A 60 5.094 8.030 -13.919 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.391 7.124 -15.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 3.859 9.034 -16.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.835 9.421 -14.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.461 9.910 -14.872 1.00 0.00 H new ATOM 929 N PHE A 61 -0.411 5.292 -14.713 1.00 0.00 N ATOM 930 CA PHE A 61 -1.009 4.185 -14.006 1.00 0.00 C ATOM 931 C PHE A 61 -2.085 3.580 -14.879 1.00 0.00 C ATOM 932 O PHE A 61 -2.399 2.400 -14.759 1.00 0.00 O ATOM 933 CB PHE A 61 -1.562 4.606 -12.652 1.00 0.00 C ATOM 934 CG PHE A 61 -1.837 3.428 -11.760 1.00 0.00 C ATOM 935 CD1 PHE A 61 -2.985 2.671 -11.924 1.00 0.00 C ATOM 936 CD2 PHE A 61 -0.936 3.065 -10.772 1.00 0.00 C ATOM 937 CE1 PHE A 61 -3.233 1.578 -11.117 1.00 0.00 C ATOM 938 CE2 PHE A 61 -1.176 1.972 -9.963 1.00 0.00 C ATOM 939 CZ PHE A 61 -2.325 1.228 -10.135 1.00 0.00 C ATOM 0 H PHE A 61 -0.520 6.200 -14.262 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.242 3.438 -13.800 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.852 5.272 -12.163 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.482 5.172 -12.797 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.695 2.939 -12.692 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -0.035 3.644 -10.633 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.134 0.998 -11.253 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.465 1.700 -9.197 1.00 0.00 H new ATOM 0 HZ PHE A 61 -2.515 0.373 -9.503 1.00 0.00 H new ATOM 949 N ALA A 62 -2.606 4.377 -15.818 1.00 0.00 N ATOM 950 CA ALA A 62 -3.581 3.863 -16.760 1.00 0.00 C ATOM 951 C ALA A 62 -2.952 2.673 -17.498 1.00 0.00 C ATOM 952 O ALA A 62 -3.646 1.809 -18.035 1.00 0.00 O ATOM 953 CB ALA A 62 -4.008 4.952 -17.734 1.00 0.00 C ATOM 0 H ALA A 62 -2.369 5.362 -15.938 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.477 3.534 -16.234 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.740 4.548 -18.433 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.452 5.780 -17.182 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.138 5.309 -18.285 1.00 0.00 H new ATOM 959 N GLU A 63 -1.614 2.641 -17.469 1.00 0.00 N ATOM 960 CA GLU A 63 -0.814 1.581 -18.070 1.00 0.00 C ATOM 961 C GLU A 63 -0.883 0.322 -17.221 1.00 0.00 C ATOM 962 O GLU A 63 -0.519 -0.771 -17.663 1.00 0.00 O ATOM 963 CB GLU A 63 0.639 2.050 -18.199 1.00 0.00 C ATOM 964 CG GLU A 63 1.460 1.239 -19.188 1.00 0.00 C ATOM 965 CD GLU A 63 1.657 1.956 -20.509 1.00 0.00 C ATOM 966 OE1 GLU A 63 0.684 2.044 -21.286 1.00 0.00 O ATOM 967 OE2 GLU A 63 2.783 2.430 -20.766 1.00 0.00 O ATOM 0 H GLU A 63 -1.054 3.365 -17.019 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.209 1.352 -19.060 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.647 3.096 -18.506 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.115 2.001 -17.220 1.00 0.00 H new ATOM 0 HG2 GLU A 63 2.433 1.017 -18.751 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.966 0.284 -19.367 1.00 0.00 H new ATOM 974 N SER A 64 -1.373 0.484 -15.999 1.00 0.00 N ATOM 975 CA SER A 64 -1.520 -0.617 -15.071 1.00 0.00 C ATOM 976 C SER A 64 -2.404 -1.719 -15.642 1.00 0.00 C ATOM 977 O SER A 64 -2.699 -2.688 -14.950 1.00 0.00 O ATOM 978 CB SER A 64 -2.114 -0.112 -13.764 1.00 0.00 C ATOM 979 OG SER A 64 -1.184 0.682 -13.048 1.00 0.00 O ATOM 0 H SER A 64 -1.678 1.384 -15.628 1.00 0.00 H new ATOM 0 HA SER A 64 -0.530 -1.038 -14.892 1.00 0.00 H new ATOM 0 HB2 SER A 64 -3.010 0.472 -13.971 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.421 -0.959 -13.150 1.00 0.00 H new ATOM 0 HG SER A 64 -1.648 1.161 -12.330 1.00 0.00 H new ATOM 985 N THR A 65 -2.821 -1.591 -16.907 1.00 0.00 N ATOM 986 CA THR A 65 -3.646 -2.612 -17.531 1.00 0.00 C ATOM 987 C THR A 65 -3.049 -3.976 -17.225 1.00 0.00 C ATOM 988 O THR A 65 -3.763 -4.931 -16.923 1.00 0.00 O ATOM 989 CB THR A 65 -3.723 -2.395 -19.042 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.484 -1.037 -19.367 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.062 -2.778 -19.631 1.00 0.00 C ATOM 0 H THR A 65 -2.600 -0.796 -17.507 1.00 0.00 H new ATOM 0 HA THR A 65 -4.659 -2.553 -17.133 1.00 0.00 H new ATOM 0 HB THR A 65 -2.957 -3.043 -19.467 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.536 -0.919 -20.338 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.051 -2.600 -20.706 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.255 -3.834 -19.440 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.847 -2.177 -19.172 1.00 0.00 H new ATOM 999 N GLU A 66 -1.720 -4.037 -17.250 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.021 -5.265 -16.920 1.00 0.00 C ATOM 1001 C GLU A 66 -0.977 -5.413 -15.413 1.00 0.00 C ATOM 1002 O GLU A 66 -1.074 -6.520 -14.885 1.00 0.00 O ATOM 1003 CB GLU A 66 0.399 -5.283 -17.491 1.00 0.00 C ATOM 1004 CG GLU A 66 0.601 -6.337 -18.564 1.00 0.00 C ATOM 1005 CD GLU A 66 2.050 -6.464 -18.993 1.00 0.00 C ATOM 1006 OE1 GLU A 66 2.793 -7.238 -18.352 1.00 0.00 O ATOM 1007 OE2 GLU A 66 2.443 -5.791 -19.969 1.00 0.00 O ATOM 0 H GLU A 66 -1.114 -3.254 -17.494 1.00 0.00 H new ATOM 0 HA GLU A 66 -1.560 -6.100 -17.367 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.628 -4.302 -17.907 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.107 -5.459 -16.681 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.250 -7.300 -18.192 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.010 -6.088 -19.432 1.00 0.00 H new ATOM 1014 N ILE A 67 -0.867 -4.281 -14.719 1.00 0.00 N ATOM 1015 CA ILE A 67 -0.855 -4.300 -13.269 1.00 0.00 C ATOM 1016 C ILE A 67 -2.227 -4.714 -12.746 1.00 0.00 C ATOM 1017 O ILE A 67 -2.372 -5.073 -11.577 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.449 -2.934 -12.675 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.909 -2.492 -13.230 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.408 -3.002 -11.154 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.450 -1.230 -12.587 1.00 0.00 C ATOM 0 H ILE A 67 -0.786 -3.354 -15.137 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.107 -5.027 -12.953 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.197 -2.196 -12.965 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.629 -3.298 -13.089 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.817 -2.331 -14.304 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.120 -2.030 -10.754 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.394 -3.273 -10.775 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.319 -3.752 -10.843 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.413 -0.980 -13.031 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.751 -0.410 -12.751 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.575 -1.392 -11.516 1.00 0.00 H new ATOM 1033 N SER A 68 -3.234 -4.686 -13.626 1.00 0.00 N ATOM 1034 CA SER A 68 -4.581 -5.086 -13.251 1.00 0.00 C ATOM 1035 C SER A 68 -4.608 -6.585 -13.003 1.00 0.00 C ATOM 1036 O SER A 68 -5.281 -7.071 -12.094 1.00 0.00 O ATOM 1037 CB SER A 68 -5.580 -4.711 -14.349 1.00 0.00 C ATOM 1038 OG SER A 68 -6.703 -4.035 -13.808 1.00 0.00 O ATOM 0 H SER A 68 -3.135 -4.391 -14.597 1.00 0.00 H new ATOM 0 HA SER A 68 -4.868 -4.562 -12.339 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.091 -4.077 -15.088 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.909 -5.611 -14.869 1.00 0.00 H new ATOM 0 HG SER A 68 -7.325 -3.805 -14.529 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.842 -7.309 -13.811 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.736 -8.753 -13.684 1.00 0.00 C ATOM 1046 C GLU A 69 -2.506 -9.119 -12.861 1.00 0.00 C ATOM 1047 O GLU A 69 -2.414 -10.217 -12.314 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.662 -9.413 -15.063 1.00 0.00 C ATOM 1049 CG GLU A 69 -4.653 -8.844 -16.065 1.00 0.00 C ATOM 1050 CD GLU A 69 -6.080 -8.870 -15.553 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -6.333 -8.298 -14.471 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -6.945 -9.460 -16.234 1.00 0.00 O ATOM 0 H GLU A 69 -3.282 -6.913 -14.566 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.626 -9.120 -13.173 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.653 -9.298 -15.458 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.842 -10.483 -14.955 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.375 -7.817 -16.303 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.593 -9.413 -16.993 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.570 -8.179 -12.768 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.350 -8.381 -12.003 1.00 0.00 C ATOM 1061 C LEU A 70 -0.646 -8.298 -10.513 1.00 0.00 C ATOM 1062 O LEU A 70 -0.447 -9.257 -9.772 1.00 0.00 O ATOM 1063 CB LEU A 70 0.688 -7.323 -12.387 1.00 0.00 C ATOM 1064 CG LEU A 70 2.085 -7.860 -12.676 1.00 0.00 C ATOM 1065 CD1 LEU A 70 2.116 -8.505 -14.048 1.00 0.00 C ATOM 1066 CD2 LEU A 70 3.118 -6.745 -12.584 1.00 0.00 C ATOM 0 H LEU A 70 -1.637 -7.266 -13.217 1.00 0.00 H new ATOM 0 HA LEU A 70 0.048 -9.370 -12.229 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.331 -6.790 -13.268 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.756 -6.594 -11.580 1.00 0.00 H new ATOM 0 HG LEU A 70 2.334 -8.613 -11.928 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.117 -8.887 -14.248 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.401 -9.327 -14.080 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.852 -7.765 -14.804 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.109 -7.149 -12.794 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.881 -5.969 -13.311 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.105 -6.319 -11.581 1.00 0.00 H new ATOM 1078 N SER A 71 -1.134 -7.136 -10.089 1.00 0.00 N ATOM 1079 CA SER A 71 -1.471 -6.895 -8.688 1.00 0.00 C ATOM 1080 C SER A 71 -2.314 -8.014 -8.080 1.00 0.00 C ATOM 1081 O SER A 71 -2.447 -8.093 -6.863 1.00 0.00 O ATOM 1082 CB SER A 71 -2.217 -5.578 -8.537 1.00 0.00 C ATOM 1083 OG SER A 71 -1.324 -4.506 -8.287 1.00 0.00 O ATOM 0 H SER A 71 -1.306 -6.339 -10.702 1.00 0.00 H new ATOM 0 HA SER A 71 -0.524 -6.858 -8.150 1.00 0.00 H new ATOM 0 HB2 SER A 71 -2.788 -5.375 -9.443 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.934 -5.655 -7.719 1.00 0.00 H new ATOM 0 HG SER A 71 -1.586 -4.047 -7.462 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.874 -8.882 -8.918 1.00 0.00 N ATOM 1090 CA HIS A 72 -3.688 -9.996 -8.438 1.00 0.00 C ATOM 1091 C HIS A 72 -2.900 -10.841 -7.440 1.00 0.00 C ATOM 1092 O HIS A 72 -3.463 -11.662 -6.719 1.00 0.00 O ATOM 1093 CB HIS A 72 -4.147 -10.864 -9.610 1.00 0.00 C ATOM 1094 CG HIS A 72 -5.530 -10.547 -10.084 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -6.489 -11.513 -10.306 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -6.119 -9.363 -10.374 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -7.606 -10.937 -10.713 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -7.408 -9.633 -10.762 1.00 0.00 N ATOM 0 H HIS A 72 -2.779 -8.836 -9.933 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.566 -9.589 -7.937 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -3.450 -10.739 -10.439 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -4.105 -11.912 -9.314 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -5.660 -8.387 -10.312 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -8.525 -11.446 -10.963 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -8.100 -8.938 -11.043 1.00 0.00 H new ATOM 1107 N ASN A 73 -1.590 -10.619 -7.409 1.00 0.00 N ATOM 1108 CA ASN A 73 -0.702 -11.339 -6.509 1.00 0.00 C ATOM 1109 C ASN A 73 -0.972 -10.952 -5.053 1.00 0.00 C ATOM 1110 O ASN A 73 -0.497 -11.605 -4.124 1.00 0.00 O ATOM 1111 CB ASN A 73 0.763 -11.071 -6.878 1.00 0.00 C ATOM 1112 CG ASN A 73 1.009 -9.675 -7.430 1.00 0.00 C ATOM 1113 OD1 ASN A 73 1.627 -9.594 -8.609 1.00 0.00 O flip ATOM 1114 ND2 ASN A 73 0.646 -8.678 -6.805 1.00 0.00 N flip ATOM 0 H ASN A 73 -1.118 -9.938 -8.004 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.896 -12.406 -6.616 1.00 0.00 H new ATOM 0 HB2 ASN A 73 1.384 -11.217 -5.994 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.083 -11.806 -7.617 1.00 0.00 H new ATOM 0 HD21 ASN A 73 0.176 -8.783 -5.906 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.815 -7.747 -7.187 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.760 -9.894 -4.872 1.00 0.00 N ATOM 1122 CA PHE A 74 -2.137 -9.409 -3.559 1.00 0.00 C ATOM 1123 C PHE A 74 -3.115 -8.241 -3.698 1.00 0.00 C ATOM 1124 O PHE A 74 -3.631 -7.993 -4.786 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.903 -9.025 -2.742 1.00 0.00 C ATOM 1126 CG PHE A 74 -0.041 -7.969 -3.367 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -0.461 -6.652 -3.424 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.201 -8.297 -3.883 1.00 0.00 C ATOM 1129 CE1 PHE A 74 0.341 -5.680 -3.988 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.006 -7.332 -4.450 1.00 0.00 C ATOM 1131 CZ PHE A 74 1.576 -6.022 -4.501 1.00 0.00 C ATOM 0 H PHE A 74 -2.154 -9.351 -5.640 1.00 0.00 H new ATOM 0 HA PHE A 74 -2.640 -10.209 -3.015 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -1.227 -8.677 -1.761 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -0.300 -9.918 -2.579 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.427 -6.381 -3.023 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.543 -9.320 -3.841 1.00 0.00 H new ATOM 0 HE1 PHE A 74 0.003 -4.655 -4.028 1.00 0.00 H new ATOM 0 HE2 PHE A 74 2.971 -7.601 -4.853 1.00 0.00 H new ATOM 0 HZ PHE A 74 2.206 -5.264 -4.942 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.390 -7.532 -2.607 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.330 -6.414 -2.663 1.00 0.00 C ATOM 1143 C VAL A 75 -3.759 -5.178 -1.978 1.00 0.00 C ATOM 1144 O VAL A 75 -3.036 -5.296 -0.989 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.676 -6.786 -2.010 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.478 -7.184 -0.554 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -6.667 -5.639 -2.126 1.00 0.00 C ATOM 0 H VAL A 75 -2.984 -7.706 -1.688 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.497 -6.188 -3.716 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.086 -7.644 -2.543 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.441 -7.442 -0.113 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.811 -8.045 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.040 -6.350 -0.005 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.610 -5.924 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.265 -4.759 -1.625 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -6.838 -5.411 -3.178 1.00 0.00 H new ATOM 1157 N MET A 76 -4.077 -3.987 -2.496 1.00 0.00 N ATOM 1158 CA MET A 76 -3.565 -2.762 -1.896 1.00 0.00 C ATOM 1159 C MET A 76 -4.698 -1.847 -1.423 1.00 0.00 C ATOM 1160 O MET A 76 -5.879 -2.189 -1.535 1.00 0.00 O ATOM 1161 CB MET A 76 -2.636 -2.038 -2.866 1.00 0.00 C ATOM 1162 CG MET A 76 -1.782 -2.981 -3.706 1.00 0.00 C ATOM 1163 SD MET A 76 -2.504 -3.370 -5.312 1.00 0.00 S ATOM 1164 CE MET A 76 -2.563 -5.157 -5.239 1.00 0.00 C ATOM 0 H MET A 76 -4.674 -3.851 -3.312 1.00 0.00 H new ATOM 0 HA MET A 76 -2.988 -3.038 -1.013 1.00 0.00 H new ATOM 0 HB2 MET A 76 -3.233 -1.412 -3.530 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.982 -1.373 -2.303 1.00 0.00 H new ATOM 0 HG2 MET A 76 -0.801 -2.532 -3.857 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.627 -3.907 -3.153 1.00 0.00 H new ATOM 0 HE1 MET A 76 -3.487 -5.510 -5.696 1.00 0.00 H new ATOM 0 HE2 MET A 76 -1.711 -5.571 -5.777 1.00 0.00 H new ATOM 0 HE3 MET A 76 -2.527 -5.480 -4.199 1.00 0.00 H new ATOM 1174 N VAL A 77 -4.327 -0.696 -0.865 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.304 0.253 -0.337 1.00 0.00 C ATOM 1176 C VAL A 77 -4.869 1.694 -0.573 1.00 0.00 C ATOM 1177 O VAL A 77 -3.958 2.190 0.084 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.510 0.019 1.176 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.936 1.292 1.898 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -6.521 -1.092 1.397 1.00 0.00 C ATOM 0 H VAL A 77 -3.356 -0.398 -0.767 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.242 0.088 -0.866 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.552 -0.282 1.601 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -6.069 1.081 2.959 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.168 2.055 1.773 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.876 1.651 1.478 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.660 -1.250 2.466 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -7.473 -0.813 0.945 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.157 -2.012 0.939 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.536 2.361 -1.503 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.225 3.744 -1.820 1.00 0.00 C ATOM 1192 C ASN A 78 -6.288 4.674 -1.254 1.00 0.00 C ATOM 1193 O ASN A 78 -7.454 4.619 -1.647 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.101 3.906 -3.336 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.409 5.303 -3.849 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -5.965 5.464 -4.932 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -5.033 6.315 -3.086 1.00 0.00 N ATOM 0 H ASN A 78 -6.298 1.964 -2.052 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.273 4.013 -1.361 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.088 3.638 -3.635 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -5.774 3.198 -3.820 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -5.202 7.274 -3.391 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -4.574 6.137 -2.193 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.874 5.524 -0.328 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.795 6.468 0.297 1.00 0.00 C ATOM 1206 C LEU A 79 -6.272 7.903 0.234 1.00 0.00 C ATOM 1207 O LEU A 79 -5.148 8.160 -0.213 1.00 0.00 O ATOM 1208 CB LEU A 79 -7.057 6.070 1.752 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.826 6.062 2.656 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -5.678 7.399 3.364 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -5.914 4.929 3.670 1.00 0.00 C ATOM 0 H LEU A 79 -4.913 5.582 0.008 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.729 6.431 -0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.792 6.756 2.173 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -7.504 5.076 1.765 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.945 5.900 2.035 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.796 7.376 4.004 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.569 8.192 2.624 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.563 7.589 3.972 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -5.028 4.939 4.305 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -6.804 5.060 4.286 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -5.973 3.975 3.146 1.00 0.00 H new ATOM 1223 N GLU A 80 -7.108 8.836 0.684 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.764 10.253 0.694 1.00 0.00 C ATOM 1225 C GLU A 80 -7.294 10.921 1.959 1.00 0.00 C ATOM 1226 O GLU A 80 -7.750 10.246 2.882 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.334 10.948 -0.546 1.00 0.00 C ATOM 1228 CG GLU A 80 -6.271 11.380 -1.541 1.00 0.00 C ATOM 1229 CD GLU A 80 -5.658 10.207 -2.281 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -6.423 9.395 -2.842 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -4.415 10.101 -2.300 1.00 0.00 O ATOM 0 H GLU A 80 -8.038 8.631 1.050 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.678 10.344 0.680 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.032 10.274 -1.042 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.904 11.823 -0.233 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.711 12.070 -2.261 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -5.486 11.925 -1.016 1.00 0.00 H new ATOM 1238 N ASP A 81 -7.233 12.250 1.998 1.00 0.00 N ATOM 1239 CA ASP A 81 -7.711 13.001 3.157 1.00 0.00 C ATOM 1240 C ASP A 81 -9.134 12.592 3.530 1.00 0.00 C ATOM 1241 O ASP A 81 -9.529 12.678 4.693 1.00 0.00 O ATOM 1242 CB ASP A 81 -7.665 14.505 2.882 1.00 0.00 C ATOM 1243 CG ASP A 81 -8.167 14.863 1.496 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -7.572 14.383 0.508 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -9.152 15.624 1.400 1.00 0.00 O ATOM 0 H ASP A 81 -6.859 12.827 1.245 1.00 0.00 H new ATOM 0 HA ASP A 81 -7.051 12.770 3.993 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.267 15.025 3.627 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -6.641 14.860 2.996 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.900 12.149 2.537 1.00 0.00 N ATOM 1251 CA GLU A 82 -11.280 11.730 2.761 1.00 0.00 C ATOM 1252 C GLU A 82 -11.362 10.672 3.859 1.00 0.00 C ATOM 1253 O GLU A 82 -12.277 10.687 4.681 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.884 11.184 1.466 1.00 0.00 C ATOM 1255 CG GLU A 82 -13.399 11.301 1.405 1.00 0.00 C ATOM 1256 CD GLU A 82 -13.917 11.412 -0.016 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -13.367 12.227 -0.786 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -14.872 10.683 -0.357 1.00 0.00 O ATOM 0 H GLU A 82 -9.588 12.071 1.569 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.849 12.603 3.082 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -11.452 11.718 0.620 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -11.604 10.136 1.358 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -13.847 10.431 1.884 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.716 12.176 1.973 1.00 0.00 H new ATOM 1265 N GLU A 83 -10.399 9.758 3.864 1.00 0.00 N ATOM 1266 CA GLU A 83 -10.362 8.696 4.862 1.00 0.00 C ATOM 1267 C GLU A 83 -9.617 9.151 6.112 1.00 0.00 C ATOM 1268 O GLU A 83 -10.102 8.989 7.231 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.696 7.445 4.283 1.00 0.00 C ATOM 1270 CG GLU A 83 -10.679 6.459 3.674 1.00 0.00 C ATOM 1271 CD GLU A 83 -10.640 5.102 4.348 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -9.672 4.349 4.111 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -11.576 4.792 5.114 1.00 0.00 O ATOM 0 H GLU A 83 -9.634 9.731 3.189 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.388 8.456 5.140 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.977 7.746 3.521 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -9.134 6.945 5.072 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -11.687 6.867 3.745 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.458 6.340 2.613 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.433 9.723 5.913 1.00 0.00 N ATOM 1281 CA GLU A 84 -7.618 10.203 7.022 1.00 0.00 C ATOM 1282 C GLU A 84 -7.300 9.068 7.993 1.00 0.00 C ATOM 1283 O GLU A 84 -7.976 8.900 9.008 1.00 0.00 O ATOM 1284 CB GLU A 84 -8.337 11.334 7.761 1.00 0.00 C ATOM 1285 CG GLU A 84 -7.395 12.346 8.389 1.00 0.00 C ATOM 1286 CD GLU A 84 -8.045 13.699 8.597 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -8.860 13.829 9.537 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -7.740 14.631 7.823 1.00 0.00 O ATOM 0 H GLU A 84 -8.017 9.865 4.993 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.682 10.583 6.614 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -8.998 11.849 7.064 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -8.967 10.905 8.540 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -7.045 11.964 9.348 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -6.517 12.463 7.753 1.00 0.00 H new ATOM 1295 N PRO A 85 -6.261 8.271 7.692 1.00 0.00 N ATOM 1296 CA PRO A 85 -5.856 7.147 8.542 1.00 0.00 C ATOM 1297 C PRO A 85 -5.535 7.587 9.966 1.00 0.00 C ATOM 1298 O PRO A 85 -5.676 6.813 10.912 1.00 0.00 O ATOM 1299 CB PRO A 85 -4.599 6.605 7.852 1.00 0.00 C ATOM 1300 CG PRO A 85 -4.706 7.070 6.441 1.00 0.00 C ATOM 1301 CD PRO A 85 -5.402 8.400 6.501 1.00 0.00 C ATOM 0 HA PRO A 85 -6.651 6.408 8.643 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -3.694 6.985 8.326 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -4.556 5.517 7.907 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -3.721 7.164 5.984 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.271 6.360 5.837 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -4.693 9.222 6.602 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.986 8.591 5.601 1.00 0.00 H new ATOM 1309 N LYS A 86 -5.102 8.835 10.109 1.00 0.00 N ATOM 1310 CA LYS A 86 -4.759 9.380 11.418 1.00 0.00 C ATOM 1311 C LYS A 86 -3.669 8.551 12.091 1.00 0.00 C ATOM 1312 O LYS A 86 -3.562 8.528 13.317 1.00 0.00 O ATOM 1313 CB LYS A 86 -6.000 9.435 12.310 1.00 0.00 C ATOM 1314 CG LYS A 86 -6.825 10.697 12.128 1.00 0.00 C ATOM 1315 CD LYS A 86 -7.920 10.803 13.177 1.00 0.00 C ATOM 1316 CE LYS A 86 -8.111 12.238 13.638 1.00 0.00 C ATOM 1317 NZ LYS A 86 -8.795 13.066 12.608 1.00 0.00 N ATOM 0 H LYS A 86 -4.980 9.488 9.335 1.00 0.00 H new ATOM 0 HA LYS A 86 -4.378 10.391 11.272 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.627 8.568 12.100 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.691 9.360 13.353 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -6.175 11.570 12.190 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.271 10.701 11.133 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -8.856 10.424 12.767 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -7.669 10.175 14.032 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -8.695 12.249 14.559 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -7.141 12.677 13.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -8.683 14.073 12.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -8.374 12.878 11.676 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -9.807 12.827 12.586 1.00 0.00 H new ATOM 1331 N ASP A 87 -2.864 7.870 11.282 1.00 0.00 N ATOM 1332 CA ASP A 87 -1.784 7.039 11.801 1.00 0.00 C ATOM 1333 C ASP A 87 -0.505 7.240 10.992 1.00 0.00 C ATOM 1334 O ASP A 87 -0.552 7.474 9.785 1.00 0.00 O ATOM 1335 CB ASP A 87 -2.192 5.565 11.777 1.00 0.00 C ATOM 1336 CG ASP A 87 -1.959 4.878 13.109 1.00 0.00 C ATOM 1337 OD1 ASP A 87 -0.792 4.552 13.412 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -2.943 4.666 13.847 1.00 0.00 O ATOM 0 H ASP A 87 -2.939 7.877 10.265 1.00 0.00 H new ATOM 0 HA ASP A 87 -1.590 7.338 12.831 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.246 5.487 11.511 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.628 5.047 11.001 1.00 0.00 H new ATOM 1343 N GLU A 88 0.637 7.143 11.664 1.00 0.00 N ATOM 1344 CA GLU A 88 1.931 7.313 11.008 1.00 0.00 C ATOM 1345 C GLU A 88 2.110 6.321 9.858 1.00 0.00 C ATOM 1346 O GLU A 88 2.999 6.487 9.026 1.00 0.00 O ATOM 1347 CB GLU A 88 3.062 7.150 12.022 1.00 0.00 C ATOM 1348 CG GLU A 88 3.665 8.471 12.466 1.00 0.00 C ATOM 1349 CD GLU A 88 2.760 9.233 13.413 1.00 0.00 C ATOM 1350 OE1 GLU A 88 2.136 8.593 14.284 1.00 0.00 O ATOM 1351 OE2 GLU A 88 2.675 10.474 13.284 1.00 0.00 O ATOM 0 H GLU A 88 0.694 6.947 12.663 1.00 0.00 H new ATOM 0 HA GLU A 88 1.964 8.320 10.591 1.00 0.00 H new ATOM 0 HB2 GLU A 88 2.684 6.619 12.896 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.845 6.529 11.586 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.622 8.284 12.954 1.00 0.00 H new ATOM 0 HG3 GLU A 88 3.869 9.086 11.590 1.00 0.00 H new ATOM 1358 N ASP A 89 1.265 5.291 9.814 1.00 0.00 N ATOM 1359 CA ASP A 89 1.342 4.280 8.763 1.00 0.00 C ATOM 1360 C ASP A 89 1.414 4.920 7.372 1.00 0.00 C ATOM 1361 O ASP A 89 1.929 4.315 6.434 1.00 0.00 O ATOM 1362 CB ASP A 89 0.137 3.335 8.842 1.00 0.00 C ATOM 1363 CG ASP A 89 0.367 2.169 9.791 1.00 0.00 C ATOM 1364 OD1 ASP A 89 1.069 2.361 10.806 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -0.156 1.061 9.519 1.00 0.00 O ATOM 0 H ASP A 89 0.521 5.136 10.494 1.00 0.00 H new ATOM 0 HA ASP A 89 2.257 3.709 8.921 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.739 3.896 9.168 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.083 2.950 7.846 1.00 0.00 H new ATOM 1370 N PHE A 90 0.894 6.143 7.240 1.00 0.00 N ATOM 1371 CA PHE A 90 0.910 6.838 5.951 1.00 0.00 C ATOM 1372 C PHE A 90 2.259 7.510 5.683 1.00 0.00 C ATOM 1373 O PHE A 90 2.555 7.891 4.546 1.00 0.00 O ATOM 1374 CB PHE A 90 -0.221 7.873 5.864 1.00 0.00 C ATOM 1375 CG PHE A 90 -0.439 8.677 7.118 1.00 0.00 C ATOM 1376 CD1 PHE A 90 0.619 9.307 7.756 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -1.712 8.812 7.651 1.00 0.00 C ATOM 1378 CE1 PHE A 90 0.412 10.052 8.902 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -1.925 9.557 8.795 1.00 0.00 C ATOM 1380 CZ PHE A 90 -0.862 10.178 9.421 1.00 0.00 C ATOM 0 H PHE A 90 0.461 6.667 8.001 1.00 0.00 H new ATOM 0 HA PHE A 90 0.751 6.081 5.183 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.006 8.557 5.043 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.148 7.357 5.614 1.00 0.00 H new ATOM 0 HD1 PHE A 90 1.617 9.214 7.353 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.547 8.329 7.166 1.00 0.00 H new ATOM 0 HE1 PHE A 90 1.245 10.535 9.391 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.922 9.654 9.199 1.00 0.00 H new ATOM 0 HZ PHE A 90 -1.027 10.761 10.315 1.00 0.00 H new ATOM 1390 N SER A 91 3.073 7.652 6.728 1.00 0.00 N ATOM 1391 CA SER A 91 4.386 8.274 6.599 1.00 0.00 C ATOM 1392 C SER A 91 5.256 7.967 7.820 1.00 0.00 C ATOM 1393 O SER A 91 5.727 8.876 8.502 1.00 0.00 O ATOM 1394 CB SER A 91 4.246 9.788 6.425 1.00 0.00 C ATOM 1395 OG SER A 91 2.995 10.123 5.851 1.00 0.00 O ATOM 0 H SER A 91 2.844 7.344 7.673 1.00 0.00 H new ATOM 0 HA SER A 91 4.870 7.859 5.715 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.349 10.279 7.393 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.051 10.160 5.792 1.00 0.00 H new ATOM 0 HG SER A 91 3.043 11.023 5.465 1.00 0.00 H new ATOM 1401 N PRO A 92 5.472 6.672 8.116 1.00 0.00 N ATOM 1402 CA PRO A 92 6.274 6.239 9.256 1.00 0.00 C ATOM 1403 C PRO A 92 7.747 6.038 8.904 1.00 0.00 C ATOM 1404 O PRO A 92 8.409 5.159 9.457 1.00 0.00 O ATOM 1405 CB PRO A 92 5.625 4.905 9.603 1.00 0.00 C ATOM 1406 CG PRO A 92 5.216 4.340 8.281 1.00 0.00 C ATOM 1407 CD PRO A 92 4.942 5.516 7.368 1.00 0.00 C ATOM 0 HA PRO A 92 6.286 6.971 10.063 1.00 0.00 H new ATOM 0 HB2 PRO A 92 6.323 4.245 10.119 1.00 0.00 H new ATOM 0 HB3 PRO A 92 4.767 5.039 10.261 1.00 0.00 H new ATOM 0 HG2 PRO A 92 6.003 3.707 7.871 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.328 3.717 8.385 1.00 0.00 H new ATOM 0 HD2 PRO A 92 5.440 5.400 6.405 1.00 0.00 H new ATOM 0 HD3 PRO A 92 3.877 5.625 7.165 1.00 0.00 H new ATOM 1415 N ASP A 93 8.254 6.847 7.980 1.00 0.00 N ATOM 1416 CA ASP A 93 9.647 6.744 7.559 1.00 0.00 C ATOM 1417 C ASP A 93 10.340 8.104 7.610 1.00 0.00 C ATOM 1418 O ASP A 93 11.348 8.271 8.295 1.00 0.00 O ATOM 1419 CB ASP A 93 9.731 6.165 6.143 1.00 0.00 C ATOM 1420 CG ASP A 93 10.530 4.877 6.093 1.00 0.00 C ATOM 1421 OD1 ASP A 93 9.940 3.802 6.323 1.00 0.00 O ATOM 1422 OD2 ASP A 93 11.749 4.947 5.825 1.00 0.00 O ATOM 0 H ASP A 93 7.723 7.580 7.509 1.00 0.00 H new ATOM 0 HA ASP A 93 10.159 6.075 8.250 1.00 0.00 H new ATOM 0 HB2 ASP A 93 8.724 5.980 5.769 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.188 6.899 5.479 1.00 0.00 H new ATOM 1427 N GLY A 94 9.797 9.069 6.877 1.00 0.00 N ATOM 1428 CA GLY A 94 10.379 10.397 6.851 1.00 0.00 C ATOM 1429 C GLY A 94 9.389 11.471 7.255 1.00 0.00 C ATOM 1430 O GLY A 94 8.865 11.454 8.368 1.00 0.00 O ATOM 0 H GLY A 94 8.964 8.955 6.300 1.00 0.00 H new ATOM 0 HA2 GLY A 94 11.237 10.427 7.522 1.00 0.00 H new ATOM 0 HA3 GLY A 94 10.751 10.608 5.848 1.00 0.00 H new ATOM 1434 N GLY A 95 9.131 12.408 6.348 1.00 0.00 N ATOM 1435 CA GLY A 95 8.199 13.480 6.636 1.00 0.00 C ATOM 1436 C GLY A 95 7.424 13.919 5.409 1.00 0.00 C ATOM 1437 O GLY A 95 7.462 15.089 5.029 1.00 0.00 O ATOM 0 H GLY A 95 9.551 12.443 5.419 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.500 13.153 7.406 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.744 14.332 7.042 1.00 0.00 H new ATOM 1441 N TYR A 96 6.712 12.981 4.793 1.00 0.00 N ATOM 1442 CA TYR A 96 5.917 13.280 3.608 1.00 0.00 C ATOM 1443 C TYR A 96 4.429 13.214 3.936 1.00 0.00 C ATOM 1444 O TYR A 96 4.050 12.847 5.048 1.00 0.00 O ATOM 1445 CB TYR A 96 6.259 12.319 2.463 1.00 0.00 C ATOM 1446 CG TYR A 96 6.560 10.906 2.911 1.00 0.00 C ATOM 1447 CD1 TYR A 96 7.768 10.583 3.516 1.00 0.00 C ATOM 1448 CD2 TYR A 96 5.629 9.896 2.726 1.00 0.00 C ATOM 1449 CE1 TYR A 96 8.035 9.293 3.929 1.00 0.00 C ATOM 1450 CE2 TYR A 96 5.889 8.599 3.130 1.00 0.00 C ATOM 1451 CZ TYR A 96 7.094 8.303 3.733 1.00 0.00 C ATOM 1452 OH TYR A 96 7.356 7.021 4.152 1.00 0.00 O ATOM 0 H TYR A 96 6.669 12.008 5.095 1.00 0.00 H new ATOM 0 HA TYR A 96 6.157 14.292 3.283 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.425 12.296 1.761 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.121 12.708 1.922 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.510 11.353 3.666 1.00 0.00 H new ATOM 0 HD2 TYR A 96 4.683 10.126 2.258 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.977 9.060 4.404 1.00 0.00 H new ATOM 0 HE2 TYR A 96 5.154 7.823 2.974 1.00 0.00 H new ATOM 0 HH TYR A 96 6.530 6.494 4.127 1.00 0.00 H new ATOM 1462 N ILE A 97 3.584 13.591 2.979 1.00 0.00 N ATOM 1463 CA ILE A 97 2.141 13.587 3.203 1.00 0.00 C ATOM 1464 C ILE A 97 1.351 13.323 1.884 1.00 0.00 C ATOM 1465 O ILE A 97 0.713 14.315 1.528 1.00 0.00 O ATOM 1466 CB ILE A 97 1.684 14.940 3.777 1.00 0.00 C ATOM 1467 CG1 ILE A 97 2.404 16.071 3.049 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.948 15.008 5.273 1.00 0.00 C ATOM 1469 CD1 ILE A 97 1.527 17.268 2.764 1.00 0.00 C ATOM 0 H ILE A 97 3.870 13.900 2.050 1.00 0.00 H new ATOM 0 HA ILE A 97 1.933 12.783 3.909 1.00 0.00 H new ATOM 0 HB ILE A 97 0.610 15.046 3.625 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.257 16.391 3.648 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.801 15.690 2.108 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.617 15.973 5.657 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.401 14.210 5.776 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.015 14.890 5.460 1.00 0.00 H new ATOM 0 HD11 ILE A 97 2.109 18.030 2.245 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.688 16.964 2.139 1.00 0.00 H new ATOM 0 HD13 ILE A 97 1.151 17.675 3.703 1.00 0.00 H new ATOM 1481 N PRO A 98 0.659 12.151 1.889 1.00 0.00 N ATOM 1482 CA PRO A 98 0.895 10.702 2.198 1.00 0.00 C ATOM 1483 C PRO A 98 1.427 9.982 0.968 1.00 0.00 C ATOM 1484 O PRO A 98 1.166 10.412 -0.162 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.478 10.158 2.559 1.00 0.00 C ATOM 1486 CG PRO A 98 -0.887 11.201 3.456 1.00 0.00 C ATOM 1487 CD PRO A 98 0.314 12.092 3.386 1.00 0.00 C ATOM 0 HA PRO A 98 1.625 10.564 2.996 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.135 10.060 1.695 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.434 9.180 3.038 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.797 11.702 3.125 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.074 10.833 4.465 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.097 13.084 3.783 1.00 0.00 H new ATOM 0 HD3 PRO A 98 1.142 11.689 3.969 1.00 0.00 H new ATOM 1495 N ARG A 99 2.197 8.912 1.194 1.00 0.00 N ATOM 1496 CA ARG A 99 2.804 8.141 0.111 1.00 0.00 C ATOM 1497 C ARG A 99 2.385 6.670 0.155 1.00 0.00 C ATOM 1498 O ARG A 99 1.469 6.291 0.885 1.00 0.00 O ATOM 1499 CB ARG A 99 4.322 8.246 0.195 1.00 0.00 C ATOM 1500 CG ARG A 99 4.924 9.290 -0.728 1.00 0.00 C ATOM 1501 CD ARG A 99 4.422 10.690 -0.413 1.00 0.00 C ATOM 1502 NE ARG A 99 4.047 11.417 -1.623 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.979 12.744 -1.703 1.00 0.00 C ATOM 1504 NH1 ARG A 99 4.238 13.494 -0.639 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.650 13.321 -2.849 1.00 0.00 N ATOM 0 H ARG A 99 2.414 8.561 2.127 1.00 0.00 H new ATOM 0 HA ARG A 99 2.453 8.558 -0.833 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.603 8.480 1.222 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.756 7.274 -0.041 1.00 0.00 H new ATOM 0 HG2 ARG A 99 6.010 9.267 -0.641 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.682 9.042 -1.761 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.562 10.626 0.254 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.197 11.243 0.118 1.00 0.00 H new ATOM 0 HE ARG A 99 3.824 10.875 -2.458 1.00 0.00 H new ATOM 0 HH11 ARG A 99 4.491 13.054 0.246 1.00 0.00 H new ATOM 0 HH12 ARG A 99 4.184 14.510 -0.706 1.00 0.00 H new ATOM 0 HH21 ARG A 99 3.449 12.749 -3.669 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.598 14.338 -2.911 1.00 0.00 H new ATOM 1519 N ILE A 100 3.073 5.849 -0.640 1.00 0.00 N ATOM 1520 CA ILE A 100 2.793 4.415 -0.712 1.00 0.00 C ATOM 1521 C ILE A 100 3.619 3.639 0.307 1.00 0.00 C ATOM 1522 O ILE A 100 4.582 4.167 0.862 1.00 0.00 O ATOM 1523 CB ILE A 100 3.067 3.856 -2.125 1.00 0.00 C ATOM 1524 CG1 ILE A 100 4.562 3.913 -2.458 1.00 0.00 C ATOM 1525 CG2 ILE A 100 2.269 4.635 -3.157 1.00 0.00 C ATOM 1526 CD1 ILE A 100 4.972 2.971 -3.570 1.00 0.00 C ATOM 0 H ILE A 100 3.833 6.156 -1.247 1.00 0.00 H new ATOM 0 HA ILE A 100 1.735 4.288 -0.483 1.00 0.00 H new ATOM 0 HB ILE A 100 2.755 2.812 -2.146 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.824 4.932 -2.742 1.00 0.00 H new ATOM 0 HG13 ILE A 100 5.135 3.675 -1.562 1.00 0.00 H new ATOM 0 HG21 ILE A 100 2.469 4.233 -4.150 1.00 0.00 H new ATOM 0 HG22 ILE A 100 1.205 4.546 -2.937 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.560 5.685 -3.125 1.00 0.00 H new ATOM 0 HD11 ILE A 100 6.043 3.066 -3.751 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.742 1.945 -3.281 1.00 0.00 H new ATOM 0 HD13 ILE A 100 4.427 3.223 -4.480 1.00 0.00 H new ATOM 1538 N LEU A 101 3.240 2.387 0.560 1.00 0.00 N ATOM 1539 CA LEU A 101 3.961 1.565 1.532 1.00 0.00 C ATOM 1540 C LEU A 101 3.357 0.168 1.660 1.00 0.00 C ATOM 1541 O LEU A 101 2.149 -0.013 1.526 1.00 0.00 O ATOM 1542 CB LEU A 101 3.962 2.262 2.895 1.00 0.00 C ATOM 1543 CG LEU A 101 2.771 3.195 3.151 1.00 0.00 C ATOM 1544 CD1 LEU A 101 1.915 2.663 4.277 1.00 0.00 C ATOM 1545 CD2 LEU A 101 3.243 4.608 3.467 1.00 0.00 C ATOM 0 H LEU A 101 2.449 1.924 0.113 1.00 0.00 H new ATOM 0 HA LEU A 101 4.984 1.447 1.175 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.981 1.501 3.675 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.882 2.839 2.990 1.00 0.00 H new ATOM 0 HG LEU A 101 2.170 3.232 2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 101 1.075 3.337 4.445 1.00 0.00 H new ATOM 0 HD12 LEU A 101 1.540 1.674 4.013 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.512 2.593 5.186 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.379 5.249 3.644 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.871 4.591 4.358 1.00 0.00 H new ATOM 0 HD23 LEU A 101 3.817 4.997 2.626 1.00 0.00 H new ATOM 1557 N PHE A 102 4.213 -0.819 1.925 1.00 0.00 N ATOM 1558 CA PHE A 102 3.769 -2.204 2.076 1.00 0.00 C ATOM 1559 C PHE A 102 3.477 -2.539 3.538 1.00 0.00 C ATOM 1560 O PHE A 102 3.954 -1.860 4.458 1.00 0.00 O ATOM 1561 CB PHE A 102 4.827 -3.162 1.524 1.00 0.00 C ATOM 1562 CG PHE A 102 4.304 -4.100 0.473 1.00 0.00 C ATOM 1563 CD1 PHE A 102 3.550 -5.207 0.827 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.567 -3.875 -0.869 1.00 0.00 C ATOM 1565 CE1 PHE A 102 3.069 -6.073 -0.136 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.088 -4.737 -1.839 1.00 0.00 C ATOM 1567 CZ PHE A 102 3.339 -5.837 -1.471 1.00 0.00 C ATOM 0 H PHE A 102 5.218 -0.685 2.039 1.00 0.00 H new ATOM 0 HA PHE A 102 2.845 -2.321 1.510 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.647 -2.580 1.103 1.00 0.00 H new ATOM 0 HB3 PHE A 102 5.240 -3.746 2.347 1.00 0.00 H new ATOM 0 HD1 PHE A 102 3.336 -5.395 1.869 1.00 0.00 H new ATOM 0 HD2 PHE A 102 5.153 -3.016 -1.161 1.00 0.00 H new ATOM 0 HE1 PHE A 102 2.483 -6.933 0.154 1.00 0.00 H new ATOM 0 HE2 PHE A 102 4.299 -4.550 -2.882 1.00 0.00 H new ATOM 0 HZ PHE A 102 2.964 -6.513 -2.226 1.00 0.00 H new ATOM 1577 N LEU A 103 2.687 -3.589 3.753 1.00 0.00 N ATOM 1578 CA LEU A 103 2.336 -3.994 5.105 1.00 0.00 C ATOM 1579 C LEU A 103 1.852 -5.439 5.159 1.00 0.00 C ATOM 1580 O LEU A 103 1.661 -6.085 4.129 1.00 0.00 O ATOM 1581 CB LEU A 103 1.266 -3.060 5.660 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.136 -3.242 5.098 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.179 -2.830 6.113 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.303 -2.462 3.804 1.00 0.00 C ATOM 0 H LEU A 103 2.284 -4.167 3.015 1.00 0.00 H new ATOM 0 HA LEU A 103 3.235 -3.929 5.718 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.222 -3.192 6.741 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.579 -2.032 5.477 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.279 -4.300 4.877 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.174 -2.969 5.689 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.077 -3.443 7.009 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.039 -1.781 6.374 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.313 -2.607 3.420 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.135 -1.402 3.994 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.419 -2.818 3.069 1.00 0.00 H new ATOM 1596 N ASP A 104 1.650 -5.936 6.378 1.00 0.00 N ATOM 1597 CA ASP A 104 1.184 -7.302 6.583 1.00 0.00 C ATOM 1598 C ASP A 104 -0.305 -7.419 6.259 1.00 0.00 C ATOM 1599 O ASP A 104 -1.079 -6.491 6.516 1.00 0.00 O ATOM 1600 CB ASP A 104 1.446 -7.742 8.025 1.00 0.00 C ATOM 1601 CG ASP A 104 2.631 -8.682 8.133 1.00 0.00 C ATOM 1602 OD1 ASP A 104 3.547 -8.581 7.291 1.00 0.00 O ATOM 1603 OD2 ASP A 104 2.642 -9.519 9.061 1.00 0.00 O ATOM 0 H ASP A 104 1.803 -5.410 7.239 1.00 0.00 H new ATOM 0 HA ASP A 104 1.736 -7.957 5.909 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.625 -6.863 8.644 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.557 -8.234 8.420 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.722 -8.569 5.686 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.121 -8.811 5.316 1.00 0.00 C ATOM 1610 C PRO A 105 -3.062 -8.722 6.510 1.00 0.00 C ATOM 1611 O PRO A 105 -3.322 -9.717 7.186 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.121 -10.235 4.740 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.830 -10.847 5.170 1.00 0.00 C ATOM 1614 CD PRO A 105 0.141 -9.714 5.355 1.00 0.00 C ATOM 0 HA PRO A 105 -2.479 -8.061 4.611 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.969 -10.808 5.114 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.203 -10.217 3.653 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.956 -11.405 6.098 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.466 -11.551 4.421 1.00 0.00 H new ATOM 0 HD2 PRO A 105 0.853 -9.923 6.153 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.721 -9.531 4.450 1.00 0.00 H new ATOM 1622 N SER A 106 -3.572 -7.519 6.757 1.00 0.00 N ATOM 1623 CA SER A 106 -4.493 -7.270 7.865 1.00 0.00 C ATOM 1624 C SER A 106 -4.585 -5.777 8.156 1.00 0.00 C ATOM 1625 O SER A 106 -5.605 -5.291 8.645 1.00 0.00 O ATOM 1626 CB SER A 106 -4.047 -8.015 9.129 1.00 0.00 C ATOM 1627 OG SER A 106 -4.687 -9.276 9.229 1.00 0.00 O ATOM 0 H SER A 106 -3.361 -6.692 6.199 1.00 0.00 H new ATOM 0 HA SER A 106 -5.475 -7.640 7.571 1.00 0.00 H new ATOM 0 HB2 SER A 106 -2.966 -8.152 9.112 1.00 0.00 H new ATOM 0 HB3 SER A 106 -4.278 -7.415 10.009 1.00 0.00 H new ATOM 0 HG SER A 106 -4.555 -9.777 8.397 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.507 -5.057 7.860 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.481 -3.628 8.103 1.00 0.00 C ATOM 1635 C GLY A 107 -2.366 -3.240 9.054 1.00 0.00 C ATOM 1636 O GLY A 107 -2.582 -2.457 9.979 1.00 0.00 O ATOM 0 H GLY A 107 -2.652 -5.439 7.456 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.353 -3.101 7.158 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.439 -3.312 8.517 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.171 -3.804 8.852 1.00 0.00 N ATOM 1641 CA LYS A 108 -0.049 -3.508 9.742 1.00 0.00 C ATOM 1642 C LYS A 108 1.189 -2.989 9.005 1.00 0.00 C ATOM 1643 O LYS A 108 2.226 -3.653 8.972 1.00 0.00 O ATOM 1644 CB LYS A 108 0.310 -4.752 10.554 1.00 0.00 C ATOM 1645 CG LYS A 108 -0.303 -4.757 11.942 1.00 0.00 C ATOM 1646 CD LYS A 108 0.608 -5.436 12.951 1.00 0.00 C ATOM 1647 CE LYS A 108 -0.186 -6.249 13.959 1.00 0.00 C ATOM 1648 NZ LYS A 108 0.605 -7.388 14.502 1.00 0.00 N ATOM 0 H LYS A 108 -0.960 -4.455 8.096 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.376 -2.706 10.403 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.022 -5.639 10.014 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.394 -4.820 10.642 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.498 -3.732 12.258 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.264 -5.271 11.915 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.310 -6.087 12.429 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.199 -4.684 13.473 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -0.501 -5.603 14.778 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -1.092 -6.629 13.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.027 -7.917 15.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.885 -8.019 13.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 1.456 -7.025 14.976 1.00 0.00 H new ATOM 1662 N VAL A 109 1.085 -1.786 8.438 1.00 0.00 N ATOM 1663 CA VAL A 109 2.202 -1.161 7.736 1.00 0.00 C ATOM 1664 C VAL A 109 3.452 -1.154 8.596 1.00 0.00 C ATOM 1665 O VAL A 109 3.393 -0.936 9.806 1.00 0.00 O ATOM 1666 CB VAL A 109 1.843 0.284 7.322 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.058 1.195 7.360 1.00 0.00 C ATOM 1668 CG2 VAL A 109 1.189 0.304 5.950 1.00 0.00 C ATOM 0 H VAL A 109 0.234 -1.225 8.453 1.00 0.00 H new ATOM 0 HA VAL A 109 2.401 -1.749 6.840 1.00 0.00 H new ATOM 0 HB VAL A 109 1.126 0.668 8.048 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.767 2.202 7.063 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.464 1.218 8.371 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.816 0.819 6.673 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.945 1.331 5.678 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.876 -0.112 5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.277 -0.292 5.973 1.00 0.00 H new ATOM 1678 N HIS A 110 4.583 -1.389 7.952 1.00 0.00 N ATOM 1679 CA HIS A 110 5.856 -1.404 8.646 1.00 0.00 C ATOM 1680 C HIS A 110 6.963 -0.908 7.728 1.00 0.00 C ATOM 1681 O HIS A 110 6.997 -1.249 6.546 1.00 0.00 O ATOM 1682 CB HIS A 110 6.177 -2.816 9.143 1.00 0.00 C ATOM 1683 CG HIS A 110 5.803 -3.044 10.575 1.00 0.00 C ATOM 1684 ND1 HIS A 110 4.597 -3.255 11.155 1.00 0.00 N flip ATOM 1685 CD2 HIS A 110 6.727 -3.073 11.599 1.00 0.00 C flip ATOM 1686 CE1 HIS A 110 4.815 -3.406 12.502 1.00 0.00 C flip ATOM 1687 NE2 HIS A 110 6.107 -3.293 12.743 1.00 0.00 N flip ATOM 0 H HIS A 110 4.644 -1.572 6.950 1.00 0.00 H new ATOM 0 HA HIS A 110 5.789 -0.738 9.507 1.00 0.00 H new ATOM 0 HB2 HIS A 110 5.653 -3.540 8.519 1.00 0.00 H new ATOM 0 HB3 HIS A 110 7.244 -3.002 9.020 1.00 0.00 H new ATOM 0 HD1 HIS A 110 3.695 -3.294 10.680 1.00 0.00 H new ATOM 0 HD2 HIS A 110 7.792 -2.937 11.483 1.00 0.00 H new ATOM 0 HE1 HIS A 110 4.052 -3.588 13.244 1.00 0.00 H new ATOM 1696 N PRO A 111 7.894 -0.101 8.257 1.00 0.00 N ATOM 1697 CA PRO A 111 9.009 0.430 7.472 1.00 0.00 C ATOM 1698 C PRO A 111 10.013 -0.654 7.102 1.00 0.00 C ATOM 1699 O PRO A 111 11.223 -0.429 7.130 1.00 0.00 O ATOM 1700 CB PRO A 111 9.648 1.458 8.406 1.00 0.00 C ATOM 1701 CG PRO A 111 9.284 1.002 9.777 1.00 0.00 C ATOM 1702 CD PRO A 111 7.937 0.352 9.658 1.00 0.00 C ATOM 0 HA PRO A 111 8.678 0.852 6.523 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.729 1.494 8.275 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.270 2.461 8.209 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.023 0.299 10.162 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.251 1.842 10.471 1.00 0.00 H new ATOM 0 HD2 PRO A 111 7.831 -0.482 10.352 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.132 1.054 9.877 1.00 0.00 H new ATOM 1710 N GLU A 112 9.503 -1.832 6.754 1.00 0.00 N ATOM 1711 CA GLU A 112 10.361 -2.950 6.375 1.00 0.00 C ATOM 1712 C GLU A 112 10.344 -3.151 4.866 1.00 0.00 C ATOM 1713 O GLU A 112 11.391 -3.283 4.233 1.00 0.00 O ATOM 1714 CB GLU A 112 9.915 -4.234 7.083 1.00 0.00 C ATOM 1715 CG GLU A 112 8.428 -4.524 6.954 1.00 0.00 C ATOM 1716 CD GLU A 112 8.002 -5.738 7.755 1.00 0.00 C ATOM 1717 OE1 GLU A 112 8.577 -6.823 7.539 1.00 0.00 O ATOM 1718 OE2 GLU A 112 7.091 -5.603 8.599 1.00 0.00 O ATOM 0 H GLU A 112 8.504 -2.037 6.727 1.00 0.00 H new ATOM 0 HA GLU A 112 11.380 -2.717 6.684 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.476 -5.075 6.676 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.171 -4.162 8.140 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.861 -3.655 7.288 1.00 0.00 H new ATOM 0 HG3 GLU A 112 8.181 -4.681 5.904 1.00 0.00 H new ATOM 1725 N ILE A 113 9.145 -3.157 4.294 1.00 0.00 N ATOM 1726 CA ILE A 113 8.984 -3.326 2.856 1.00 0.00 C ATOM 1727 C ILE A 113 8.622 -1.996 2.206 1.00 0.00 C ATOM 1728 O ILE A 113 7.446 -1.674 2.025 1.00 0.00 O ATOM 1729 CB ILE A 113 7.898 -4.371 2.532 1.00 0.00 C ATOM 1730 CG1 ILE A 113 8.276 -5.726 3.130 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.694 -4.487 1.026 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.482 -6.365 2.472 1.00 0.00 C ATOM 0 H ILE A 113 8.270 -3.047 4.806 1.00 0.00 H new ATOM 0 HA ILE A 113 9.934 -3.681 2.456 1.00 0.00 H new ATOM 0 HB ILE A 113 6.958 -4.044 2.976 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.477 -5.601 4.194 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.425 -6.402 3.044 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.923 -5.230 0.819 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.384 -3.522 0.625 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.628 -4.793 0.555 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.691 -7.323 2.948 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.278 -6.523 1.413 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.346 -5.709 2.581 1.00 0.00 H new ATOM 1744 N ILE A 114 9.646 -1.223 1.871 1.00 0.00 N ATOM 1745 CA ILE A 114 9.455 0.080 1.253 1.00 0.00 C ATOM 1746 C ILE A 114 9.524 -0.003 -0.265 1.00 0.00 C ATOM 1747 O ILE A 114 9.705 -1.080 -0.834 1.00 0.00 O ATOM 1748 CB ILE A 114 10.500 1.098 1.753 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.923 0.672 1.345 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.387 1.282 3.261 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.586 -0.308 2.296 1.00 0.00 C ATOM 0 H ILE A 114 10.622 -1.479 2.018 1.00 0.00 H new ATOM 0 HA ILE A 114 8.460 0.418 1.542 1.00 0.00 H new ATOM 0 HB ILE A 114 10.297 2.059 1.281 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.883 0.224 0.352 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.547 1.563 1.269 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.132 2.004 3.596 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.390 1.647 3.509 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.558 0.327 3.758 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.583 -0.552 1.930 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.662 0.141 3.286 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.989 -1.218 2.355 1.00 0.00 H new ATOM 1763 N ASN A 115 9.378 1.146 -0.916 1.00 0.00 N ATOM 1764 CA ASN A 115 9.421 1.219 -2.371 1.00 0.00 C ATOM 1765 C ASN A 115 10.712 0.611 -2.912 1.00 0.00 C ATOM 1766 O ASN A 115 10.725 0.008 -3.985 1.00 0.00 O ATOM 1767 CB ASN A 115 9.298 2.674 -2.824 1.00 0.00 C ATOM 1768 CG ASN A 115 9.265 2.809 -4.334 1.00 0.00 C ATOM 1769 OD1 ASN A 115 9.260 4.047 -4.818 1.00 0.00 O flip ATOM 1770 ND2 ASN A 115 9.244 1.814 -5.059 1.00 0.00 N flip ATOM 0 H ASN A 115 9.228 2.044 -0.456 1.00 0.00 H new ATOM 0 HA ASN A 115 8.583 0.646 -2.767 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.390 3.107 -2.403 1.00 0.00 H new ATOM 0 HB3 ASN A 115 10.137 3.247 -2.429 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.249 0.882 -4.646 1.00 0.00 H new ATOM 0 HD22 ASN A 115 9.222 1.922 -6.073 1.00 0.00 H new ATOM 1777 N GLU A 116 11.795 0.775 -2.159 1.00 0.00 N ATOM 1778 CA GLU A 116 13.093 0.242 -2.561 1.00 0.00 C ATOM 1779 C GLU A 116 13.545 0.841 -3.892 1.00 0.00 C ATOM 1780 O GLU A 116 14.396 0.276 -4.578 1.00 0.00 O ATOM 1781 CB GLU A 116 13.026 -1.283 -2.668 1.00 0.00 C ATOM 1782 CG GLU A 116 13.906 -2.002 -1.659 1.00 0.00 C ATOM 1783 CD GLU A 116 15.384 -1.847 -1.960 1.00 0.00 C ATOM 1784 OE1 GLU A 116 15.889 -2.569 -2.845 1.00 0.00 O ATOM 1785 OE2 GLU A 116 16.037 -1.001 -1.311 1.00 0.00 O ATOM 0 H GLU A 116 11.800 1.272 -1.268 1.00 0.00 H new ATOM 0 HA GLU A 116 13.823 0.516 -1.799 1.00 0.00 H new ATOM 0 HB2 GLU A 116 11.993 -1.604 -2.531 1.00 0.00 H new ATOM 0 HB3 GLU A 116 13.322 -1.582 -3.674 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.700 -1.615 -0.661 1.00 0.00 H new ATOM 0 HG3 GLU A 116 13.650 -3.061 -1.649 1.00 0.00 H new ATOM 1792 N ASN A 117 12.971 1.985 -4.248 1.00 0.00 N ATOM 1793 CA ASN A 117 13.317 2.658 -5.495 1.00 0.00 C ATOM 1794 C ASN A 117 13.708 4.109 -5.239 1.00 0.00 C ATOM 1795 O ASN A 117 14.603 4.645 -5.893 1.00 0.00 O ATOM 1796 CB ASN A 117 12.144 2.595 -6.475 1.00 0.00 C ATOM 1797 CG ASN A 117 12.374 1.590 -7.587 1.00 0.00 C ATOM 1798 OD1 ASN A 117 11.946 0.440 -7.497 1.00 0.00 O ATOM 1799 ND2 ASN A 117 13.054 2.022 -8.644 1.00 0.00 N ATOM 0 H ASN A 117 12.264 2.466 -3.691 1.00 0.00 H new ATOM 0 HA ASN A 117 14.173 2.144 -5.933 1.00 0.00 H new ATOM 0 HB2 ASN A 117 11.235 2.332 -5.934 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.983 3.582 -6.908 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.240 1.391 -9.424 1.00 0.00 H new ATOM 0 HD22 ASN A 117 13.390 2.985 -8.676 1.00 0.00 H new ATOM 1806 N GLY A 118 13.031 4.741 -4.286 1.00 0.00 N ATOM 1807 CA GLY A 118 13.321 6.125 -3.964 1.00 0.00 C ATOM 1808 C GLY A 118 14.698 6.303 -3.355 1.00 0.00 C ATOM 1809 O GLY A 118 15.489 5.362 -3.301 1.00 0.00 O ATOM 0 H GLY A 118 12.287 4.319 -3.731 1.00 0.00 H new ATOM 0 HA2 GLY A 118 13.247 6.728 -4.869 1.00 0.00 H new ATOM 0 HA3 GLY A 118 12.569 6.498 -3.269 1.00 0.00 H new ATOM 1813 N ASN A 119 14.983 7.517 -2.897 1.00 0.00 N ATOM 1814 CA ASN A 119 16.271 7.825 -2.287 1.00 0.00 C ATOM 1815 C ASN A 119 16.326 7.313 -0.850 1.00 0.00 C ATOM 1816 O ASN A 119 15.306 6.905 -0.290 1.00 0.00 O ATOM 1817 CB ASN A 119 16.518 9.335 -2.319 1.00 0.00 C ATOM 1818 CG ASN A 119 15.493 10.105 -1.510 1.00 0.00 C ATOM 1819 OD1 ASN A 119 14.459 10.524 -2.033 1.00 0.00 O ATOM 1820 ND2 ASN A 119 15.773 10.295 -0.226 1.00 0.00 N ATOM 0 H ASN A 119 14.337 8.306 -2.937 1.00 0.00 H new ATOM 0 HA ASN A 119 17.052 7.324 -2.859 1.00 0.00 H new ATOM 0 HB2 ASN A 119 17.515 9.546 -1.932 1.00 0.00 H new ATOM 0 HB3 ASN A 119 16.497 9.682 -3.352 1.00 0.00 H new ATOM 0 HD21 ASN A 119 15.120 10.805 0.368 1.00 0.00 H new ATOM 0 HD22 ASN A 119 16.641 9.931 0.166 1.00 0.00 H new ATOM 1827 N PRO A 120 17.525 7.323 -0.232 1.00 0.00 N ATOM 1828 CA PRO A 120 17.722 6.858 1.144 1.00 0.00 C ATOM 1829 C PRO A 120 17.210 7.859 2.181 1.00 0.00 C ATOM 1830 O PRO A 120 17.930 8.229 3.110 1.00 0.00 O ATOM 1831 CB PRO A 120 19.249 6.696 1.264 1.00 0.00 C ATOM 1832 CG PRO A 120 19.799 6.937 -0.107 1.00 0.00 C ATOM 1833 CD PRO A 120 18.785 7.778 -0.825 1.00 0.00 C ATOM 0 HA PRO A 120 17.168 5.939 1.338 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.662 7.407 1.980 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.509 5.699 1.619 1.00 0.00 H new ATOM 0 HG2 PRO A 120 20.761 7.447 -0.056 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.964 5.995 -0.631 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.950 8.843 -0.661 1.00 0.00 H new ATOM 0 HD3 PRO A 120 18.810 7.614 -1.902 1.00 0.00 H new ATOM 1841 N SER A 121 15.964 8.290 2.017 1.00 0.00 N ATOM 1842 CA SER A 121 15.346 9.243 2.929 1.00 0.00 C ATOM 1843 C SER A 121 13.934 9.550 2.454 1.00 0.00 C ATOM 1844 O SER A 121 13.478 10.692 2.501 1.00 0.00 O ATOM 1845 CB SER A 121 16.174 10.530 3.008 1.00 0.00 C ATOM 1846 OG SER A 121 16.751 10.685 4.293 1.00 0.00 O ATOM 0 H SER A 121 15.358 7.990 1.253 1.00 0.00 H new ATOM 0 HA SER A 121 15.305 8.807 3.927 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.960 10.508 2.253 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.541 11.388 2.784 1.00 0.00 H new ATOM 0 HG SER A 121 17.380 9.952 4.460 1.00 0.00 H new ATOM 1852 N TYR A 122 13.260 8.513 1.977 1.00 0.00 N ATOM 1853 CA TYR A 122 11.907 8.644 1.464 1.00 0.00 C ATOM 1854 C TYR A 122 11.289 7.270 1.242 1.00 0.00 C ATOM 1855 O TYR A 122 10.242 6.951 1.801 1.00 0.00 O ATOM 1856 CB TYR A 122 11.941 9.429 0.153 1.00 0.00 C ATOM 1857 CG TYR A 122 11.393 10.835 0.261 1.00 0.00 C ATOM 1858 CD1 TYR A 122 10.031 11.065 0.390 1.00 0.00 C ATOM 1859 CD2 TYR A 122 12.244 11.934 0.225 1.00 0.00 C ATOM 1860 CE1 TYR A 122 9.530 12.350 0.481 1.00 0.00 C ATOM 1861 CE2 TYR A 122 11.752 13.220 0.316 1.00 0.00 C ATOM 1862 CZ TYR A 122 10.394 13.424 0.443 1.00 0.00 C ATOM 1863 OH TYR A 122 9.900 14.705 0.531 1.00 0.00 O ATOM 0 H TYR A 122 13.634 7.565 1.935 1.00 0.00 H new ATOM 0 HA TYR A 122 11.295 9.179 2.191 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.970 9.478 -0.202 1.00 0.00 H new ATOM 0 HB3 TYR A 122 11.370 8.885 -0.599 1.00 0.00 H new ATOM 0 HD1 TYR A 122 9.351 10.226 0.420 1.00 0.00 H new ATOM 0 HD2 TYR A 122 13.308 11.779 0.124 1.00 0.00 H new ATOM 0 HE1 TYR A 122 8.467 12.512 0.581 1.00 0.00 H new ATOM 0 HE2 TYR A 122 12.427 14.063 0.288 1.00 0.00 H new ATOM 0 HH TYR A 122 10.641 15.345 0.490 1.00 0.00 H new ATOM 1873 N LYS A 123 11.961 6.459 0.426 1.00 0.00 N ATOM 1874 CA LYS A 123 11.508 5.101 0.117 1.00 0.00 C ATOM 1875 C LYS A 123 10.022 5.063 -0.254 1.00 0.00 C ATOM 1876 O LYS A 123 9.670 5.082 -1.432 1.00 0.00 O ATOM 1877 CB LYS A 123 11.791 4.173 1.299 1.00 0.00 C ATOM 1878 CG LYS A 123 13.240 4.190 1.755 1.00 0.00 C ATOM 1879 CD LYS A 123 14.131 3.398 0.810 1.00 0.00 C ATOM 1880 CE LYS A 123 15.428 4.135 0.519 1.00 0.00 C ATOM 1881 NZ LYS A 123 16.598 3.215 0.495 1.00 0.00 N ATOM 0 H LYS A 123 12.831 6.722 -0.038 1.00 0.00 H new ATOM 0 HA LYS A 123 12.066 4.754 -0.753 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.153 4.459 2.135 1.00 0.00 H new ATOM 0 HB3 LYS A 123 11.518 3.154 1.023 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.593 5.220 1.812 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.311 3.773 2.759 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.354 2.425 1.248 1.00 0.00 H new ATOM 0 HD3 LYS A 123 13.599 3.212 -0.123 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.348 4.645 -0.441 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.586 4.903 1.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 17.462 3.757 0.293 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.691 2.747 1.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.460 2.497 -0.244 1.00 0.00 H new ATOM 1895 N TYR A 124 9.157 5.012 0.760 1.00 0.00 N ATOM 1896 CA TYR A 124 7.704 4.975 0.560 1.00 0.00 C ATOM 1897 C TYR A 124 7.264 5.897 -0.579 1.00 0.00 C ATOM 1898 O TYR A 124 6.254 5.644 -1.236 1.00 0.00 O ATOM 1899 CB TYR A 124 7.000 5.369 1.858 1.00 0.00 C ATOM 1900 CG TYR A 124 6.917 4.247 2.879 1.00 0.00 C ATOM 1901 CD1 TYR A 124 7.488 3.000 2.635 1.00 0.00 C ATOM 1902 CD2 TYR A 124 6.258 4.436 4.088 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.405 1.981 3.562 1.00 0.00 C ATOM 1904 CE2 TYR A 124 6.172 3.418 5.020 1.00 0.00 C ATOM 1905 CZ TYR A 124 6.745 2.194 4.752 1.00 0.00 C ATOM 1906 OH TYR A 124 6.657 1.182 5.679 1.00 0.00 O ATOM 0 H TYR A 124 9.440 4.995 1.740 1.00 0.00 H new ATOM 0 HA TYR A 124 7.426 3.958 0.283 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.526 6.214 2.303 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.991 5.709 1.624 1.00 0.00 H new ATOM 0 HD1 TYR A 124 8.005 2.827 1.703 1.00 0.00 H new ATOM 0 HD2 TYR A 124 5.806 5.393 4.303 1.00 0.00 H new ATOM 0 HE1 TYR A 124 7.855 1.021 3.355 1.00 0.00 H new ATOM 0 HE2 TYR A 124 5.657 3.582 5.955 1.00 0.00 H new ATOM 0 HH TYR A 124 6.907 0.332 5.260 1.00 0.00 H new ATOM 1916 N PHE A 125 8.027 6.960 -0.813 1.00 0.00 N ATOM 1917 CA PHE A 125 7.715 7.903 -1.879 1.00 0.00 C ATOM 1918 C PHE A 125 8.224 7.383 -3.221 1.00 0.00 C ATOM 1919 O PHE A 125 9.425 7.180 -3.404 1.00 0.00 O ATOM 1920 CB PHE A 125 8.336 9.271 -1.577 1.00 0.00 C ATOM 1921 CG PHE A 125 8.233 10.248 -2.716 1.00 0.00 C ATOM 1922 CD1 PHE A 125 7.053 10.931 -2.958 1.00 0.00 C ATOM 1923 CD2 PHE A 125 9.319 10.480 -3.544 1.00 0.00 C ATOM 1924 CE1 PHE A 125 6.957 11.827 -4.006 1.00 0.00 C ATOM 1925 CE2 PHE A 125 9.231 11.375 -4.592 1.00 0.00 C ATOM 1926 CZ PHE A 125 8.048 12.049 -4.824 1.00 0.00 C ATOM 0 H PHE A 125 8.865 7.189 -0.279 1.00 0.00 H new ATOM 0 HA PHE A 125 6.632 8.011 -1.935 1.00 0.00 H new ATOM 0 HB2 PHE A 125 7.847 9.696 -0.700 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.387 9.134 -1.321 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.198 10.762 -2.321 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.246 9.954 -3.368 1.00 0.00 H new ATOM 0 HE1 PHE A 125 6.031 12.353 -4.185 1.00 0.00 H new ATOM 0 HE2 PHE A 125 10.086 11.548 -5.229 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.976 12.749 -5.644 1.00 0.00 H new ATOM 1936 N TYR A 126 7.306 7.170 -4.158 1.00 0.00 N ATOM 1937 CA TYR A 126 7.668 6.678 -5.478 1.00 0.00 C ATOM 1938 C TYR A 126 7.399 7.741 -6.540 1.00 0.00 C ATOM 1939 O TYR A 126 6.957 8.846 -6.227 1.00 0.00 O ATOM 1940 CB TYR A 126 6.888 5.398 -5.797 1.00 0.00 C ATOM 1941 CG TYR A 126 5.449 5.642 -6.200 1.00 0.00 C ATOM 1942 CD1 TYR A 126 4.509 6.077 -5.273 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.036 5.439 -7.506 1.00 0.00 C ATOM 1944 CE1 TYR A 126 3.197 6.302 -5.643 1.00 0.00 C ATOM 1945 CE2 TYR A 126 3.725 5.661 -7.884 1.00 0.00 C ATOM 1946 CZ TYR A 126 2.809 6.092 -6.948 1.00 0.00 C ATOM 1947 OH TYR A 126 1.504 6.313 -7.318 1.00 0.00 O ATOM 0 H TYR A 126 6.307 7.331 -4.026 1.00 0.00 H new ATOM 0 HA TYR A 126 8.734 6.450 -5.482 1.00 0.00 H new ATOM 0 HB2 TYR A 126 7.395 4.866 -6.602 1.00 0.00 H new ATOM 0 HB3 TYR A 126 6.905 4.746 -4.923 1.00 0.00 H new ATOM 0 HD1 TYR A 126 4.809 6.242 -4.249 1.00 0.00 H new ATOM 0 HD2 TYR A 126 5.751 5.101 -8.242 1.00 0.00 H new ATOM 0 HE1 TYR A 126 2.478 6.641 -4.912 1.00 0.00 H new ATOM 0 HE2 TYR A 126 3.420 5.498 -8.907 1.00 0.00 H new ATOM 0 HH TYR A 126 0.913 5.729 -6.798 1.00 0.00 H new ATOM 1957 N VAL A 127 7.662 7.395 -7.794 1.00 0.00 N ATOM 1958 CA VAL A 127 7.450 8.309 -8.905 1.00 0.00 C ATOM 1959 C VAL A 127 7.453 7.555 -10.226 1.00 0.00 C ATOM 1960 O VAL A 127 8.512 7.263 -10.778 1.00 0.00 O ATOM 1961 CB VAL A 127 8.523 9.414 -8.954 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.215 10.507 -7.945 1.00 0.00 C ATOM 1963 CG2 VAL A 127 9.906 8.832 -8.709 1.00 0.00 C ATOM 0 H VAL A 127 8.025 6.481 -8.066 1.00 0.00 H new ATOM 0 HA VAL A 127 6.478 8.778 -8.748 1.00 0.00 H new ATOM 0 HB VAL A 127 8.511 9.856 -9.950 1.00 0.00 H new ATOM 0 HG11 VAL A 127 8.985 11.277 -7.996 1.00 0.00 H new ATOM 0 HG12 VAL A 127 7.245 10.949 -8.172 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.194 10.081 -6.942 1.00 0.00 H new ATOM 0 HG21 VAL A 127 10.648 9.629 -8.748 1.00 0.00 H new ATOM 0 HG22 VAL A 127 9.933 8.359 -7.727 1.00 0.00 H new ATOM 0 HG23 VAL A 127 10.130 8.090 -9.476 1.00 0.00 H new ATOM 1973 N SER A 128 6.256 7.249 -10.723 1.00 0.00 N ATOM 1974 CA SER A 128 6.081 6.530 -11.989 1.00 0.00 C ATOM 1975 C SER A 128 5.829 5.038 -11.770 1.00 0.00 C ATOM 1976 O SER A 128 6.357 4.428 -10.835 1.00 0.00 O ATOM 1977 CB SER A 128 7.285 6.719 -12.920 1.00 0.00 C ATOM 1978 OG SER A 128 6.938 6.444 -14.266 1.00 0.00 O ATOM 0 H SER A 128 5.379 7.491 -10.262 1.00 0.00 H new ATOM 0 HA SER A 128 5.200 6.961 -12.465 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.655 7.741 -12.838 1.00 0.00 H new ATOM 0 HB3 SER A 128 8.096 6.061 -12.609 1.00 0.00 H new ATOM 0 HG SER A 128 7.722 6.574 -14.839 1.00 0.00 H new ATOM 1984 N ALA A 129 5.017 4.460 -12.656 1.00 0.00 N ATOM 1985 CA ALA A 129 4.682 3.043 -12.595 1.00 0.00 C ATOM 1986 C ALA A 129 5.939 2.183 -12.651 1.00 0.00 C ATOM 1987 O ALA A 129 5.974 1.078 -12.111 1.00 0.00 O ATOM 1988 CB ALA A 129 3.744 2.679 -13.736 1.00 0.00 C ATOM 0 H ALA A 129 4.578 4.959 -13.429 1.00 0.00 H new ATOM 0 HA ALA A 129 4.181 2.850 -11.647 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.500 1.618 -13.682 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.829 3.267 -13.657 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.230 2.891 -14.688 1.00 0.00 H new ATOM 1994 N GLU A 130 6.968 2.699 -13.318 1.00 0.00 N ATOM 1995 CA GLU A 130 8.236 1.990 -13.467 1.00 0.00 C ATOM 1996 C GLU A 130 8.704 1.369 -12.151 1.00 0.00 C ATOM 1997 O GLU A 130 8.883 0.156 -12.054 1.00 0.00 O ATOM 1998 CB GLU A 130 9.309 2.937 -14.007 1.00 0.00 C ATOM 1999 CG GLU A 130 9.960 2.445 -15.289 1.00 0.00 C ATOM 2000 CD GLU A 130 8.947 2.151 -16.378 1.00 0.00 C ATOM 2001 OE1 GLU A 130 8.590 3.087 -17.125 1.00 0.00 O ATOM 2002 OE2 GLU A 130 8.509 0.987 -16.485 1.00 0.00 O ATOM 0 H GLU A 130 6.947 3.614 -13.768 1.00 0.00 H new ATOM 0 HA GLU A 130 8.074 1.178 -14.176 1.00 0.00 H new ATOM 0 HB2 GLU A 130 8.862 3.915 -14.187 1.00 0.00 H new ATOM 0 HB3 GLU A 130 10.078 3.073 -13.247 1.00 0.00 H new ATOM 0 HG2 GLU A 130 10.665 3.196 -15.646 1.00 0.00 H new ATOM 0 HG3 GLU A 130 10.534 1.543 -15.078 1.00 0.00 H new ATOM 2009 N GLN A 131 8.920 2.199 -11.138 1.00 0.00 N ATOM 2010 CA GLN A 131 9.382 1.684 -9.858 1.00 0.00 C ATOM 2011 C GLN A 131 8.281 0.950 -9.109 1.00 0.00 C ATOM 2012 O GLN A 131 8.458 -0.197 -8.699 1.00 0.00 O ATOM 2013 CB GLN A 131 9.937 2.778 -8.963 1.00 0.00 C ATOM 2014 CG GLN A 131 9.096 4.043 -8.912 1.00 0.00 C ATOM 2015 CD GLN A 131 9.942 5.298 -9.012 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.303 5.732 -10.105 1.00 0.00 O ATOM 2017 NE2 GLN A 131 10.267 5.884 -7.866 1.00 0.00 N ATOM 0 H GLN A 131 8.786 3.209 -11.176 1.00 0.00 H new ATOM 0 HA GLN A 131 10.182 0.984 -10.097 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.039 2.385 -7.952 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.938 3.037 -9.307 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.372 4.029 -9.727 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.528 4.063 -7.982 1.00 0.00 H new ATOM 0 HE21 GLN A 131 9.945 5.489 -6.982 1.00 0.00 H new ATOM 0 HE22 GLN A 131 10.838 6.729 -7.869 1.00 0.00 H new ATOM 2026 N VAL A 132 7.142 1.606 -8.914 1.00 0.00 N ATOM 2027 CA VAL A 132 6.042 0.977 -8.190 1.00 0.00 C ATOM 2028 C VAL A 132 5.697 -0.378 -8.796 1.00 0.00 C ATOM 2029 O VAL A 132 5.125 -1.231 -8.122 1.00 0.00 O ATOM 2030 CB VAL A 132 4.781 1.872 -8.119 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.600 2.674 -9.394 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.533 1.048 -7.817 1.00 0.00 C ATOM 0 H VAL A 132 6.957 2.555 -9.240 1.00 0.00 H new ATOM 0 HA VAL A 132 6.389 0.832 -7.167 1.00 0.00 H new ATOM 0 HB VAL A 132 4.927 2.575 -7.299 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.706 3.292 -9.311 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.469 3.313 -9.548 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.495 1.994 -10.240 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.665 1.705 -7.774 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.388 0.306 -8.602 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.654 0.543 -6.859 1.00 0.00 H new ATOM 2042 N VAL A 133 6.063 -0.585 -10.057 1.00 0.00 N ATOM 2043 CA VAL A 133 5.793 -1.856 -10.706 1.00 0.00 C ATOM 2044 C VAL A 133 6.872 -2.878 -10.368 1.00 0.00 C ATOM 2045 O VAL A 133 6.599 -4.078 -10.337 1.00 0.00 O ATOM 2046 CB VAL A 133 5.671 -1.731 -12.238 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.028 -1.485 -12.877 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.033 -2.984 -12.811 1.00 0.00 C ATOM 0 H VAL A 133 6.540 0.102 -10.640 1.00 0.00 H new ATOM 0 HA VAL A 133 4.830 -2.193 -10.322 1.00 0.00 H new ATOM 0 HB VAL A 133 5.036 -0.874 -12.463 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.912 -1.401 -13.958 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.453 -0.561 -12.485 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.694 -2.316 -12.647 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.950 -2.888 -13.894 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.650 -3.849 -12.570 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.040 -3.116 -12.382 1.00 0.00 H new ATOM 2058 N GLN A 134 8.100 -2.414 -10.100 1.00 0.00 N ATOM 2059 CA GLN A 134 9.168 -3.351 -9.753 1.00 0.00 C ATOM 2060 C GLN A 134 9.011 -3.772 -8.303 1.00 0.00 C ATOM 2061 O GLN A 134 9.288 -4.914 -7.939 1.00 0.00 O ATOM 2062 CB GLN A 134 10.561 -2.766 -10.002 1.00 0.00 C ATOM 2063 CG GLN A 134 10.672 -1.287 -9.704 1.00 0.00 C ATOM 2064 CD GLN A 134 12.071 -0.749 -9.936 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.257 0.246 -10.636 1.00 0.00 O ATOM 2066 NE2 GLN A 134 13.063 -1.405 -9.344 1.00 0.00 N ATOM 0 H GLN A 134 8.370 -1.430 -10.116 1.00 0.00 H new ATOM 0 HA GLN A 134 9.079 -4.222 -10.402 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.284 -3.304 -9.389 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.835 -2.938 -11.043 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.968 -0.740 -10.331 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.384 -1.106 -8.668 1.00 0.00 H new ATOM 0 HE21 GLN A 134 12.862 -2.226 -8.772 1.00 0.00 H new ATOM 0 HE22 GLN A 134 14.025 -1.088 -9.461 1.00 0.00 H new ATOM 2075 N GLY A 135 8.517 -2.849 -7.487 1.00 0.00 N ATOM 2076 CA GLY A 135 8.276 -3.152 -6.095 1.00 0.00 C ATOM 2077 C GLY A 135 7.031 -4.002 -5.945 1.00 0.00 C ATOM 2078 O GLY A 135 6.882 -4.741 -4.971 1.00 0.00 O ATOM 0 H GLY A 135 8.280 -1.897 -7.767 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.135 -3.677 -5.677 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.162 -2.227 -5.530 1.00 0.00 H new ATOM 2082 N MET A 136 6.136 -3.902 -6.932 1.00 0.00 N ATOM 2083 CA MET A 136 4.900 -4.674 -6.927 1.00 0.00 C ATOM 2084 C MET A 136 5.148 -6.070 -7.486 1.00 0.00 C ATOM 2085 O MET A 136 4.668 -7.069 -6.948 1.00 0.00 O ATOM 2086 CB MET A 136 3.832 -3.958 -7.759 1.00 0.00 C ATOM 2087 CG MET A 136 2.407 -4.277 -7.344 1.00 0.00 C ATOM 2088 SD MET A 136 1.975 -6.003 -7.623 1.00 0.00 S ATOM 2089 CE MET A 136 1.457 -5.939 -9.335 1.00 0.00 C ATOM 0 H MET A 136 6.248 -3.293 -7.742 1.00 0.00 H new ATOM 0 HA MET A 136 4.547 -4.765 -5.900 1.00 0.00 H new ATOM 0 HB2 MET A 136 3.989 -2.882 -7.684 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.963 -4.227 -8.807 1.00 0.00 H new ATOM 0 HG2 MET A 136 2.278 -4.040 -6.288 1.00 0.00 H new ATOM 0 HG3 MET A 136 1.719 -3.640 -7.900 1.00 0.00 H new ATOM 0 HE1 MET A 136 1.481 -6.942 -9.760 1.00 0.00 H new ATOM 0 HE2 MET A 136 0.443 -5.544 -9.394 1.00 0.00 H new ATOM 0 HE3 MET A 136 2.131 -5.291 -9.895 1.00 0.00 H new ATOM 2099 N LYS A 137 5.914 -6.121 -8.571 1.00 0.00 N ATOM 2100 CA LYS A 137 6.253 -7.379 -9.227 1.00 0.00 C ATOM 2101 C LYS A 137 7.240 -8.200 -8.391 1.00 0.00 C ATOM 2102 O LYS A 137 7.459 -9.379 -8.662 1.00 0.00 O ATOM 2103 CB LYS A 137 6.821 -7.116 -10.626 1.00 0.00 C ATOM 2104 CG LYS A 137 8.285 -6.700 -10.646 1.00 0.00 C ATOM 2105 CD LYS A 137 8.645 -5.980 -11.939 1.00 0.00 C ATOM 2106 CE LYS A 137 8.243 -6.783 -13.169 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.130 -7.960 -13.380 1.00 0.00 N ATOM 0 H LYS A 137 6.315 -5.297 -9.018 1.00 0.00 H new ATOM 0 HA LYS A 137 5.337 -7.962 -9.324 1.00 0.00 H new ATOM 0 HB2 LYS A 137 6.705 -8.018 -11.227 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.228 -6.336 -11.104 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.490 -6.049 -9.797 1.00 0.00 H new ATOM 0 HG3 LYS A 137 8.916 -7.581 -10.532 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.151 -5.009 -11.963 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.719 -5.793 -11.963 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.212 -7.120 -13.061 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.277 -6.140 -14.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 8.822 -8.479 -14.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.110 -7.637 -13.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.078 -8.587 -12.552 1.00 0.00 H new ATOM 2121 N GLU A 138 7.837 -7.568 -7.383 1.00 0.00 N ATOM 2122 CA GLU A 138 8.805 -8.241 -6.520 1.00 0.00 C ATOM 2123 C GLU A 138 8.136 -8.809 -5.274 1.00 0.00 C ATOM 2124 O GLU A 138 7.966 -10.021 -5.144 1.00 0.00 O ATOM 2125 CB GLU A 138 9.912 -7.268 -6.112 1.00 0.00 C ATOM 2126 CG GLU A 138 11.089 -7.250 -7.072 1.00 0.00 C ATOM 2127 CD GLU A 138 12.381 -7.704 -6.421 1.00 0.00 C ATOM 2128 OE1 GLU A 138 13.034 -6.872 -5.757 1.00 0.00 O ATOM 2129 OE2 GLU A 138 12.739 -8.890 -6.576 1.00 0.00 O ATOM 0 H GLU A 138 7.668 -6.591 -7.144 1.00 0.00 H new ATOM 0 HA GLU A 138 9.236 -9.068 -7.084 1.00 0.00 H new ATOM 0 HB2 GLU A 138 9.494 -6.264 -6.043 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.269 -7.533 -5.117 1.00 0.00 H new ATOM 0 HG2 GLU A 138 10.869 -7.895 -7.922 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.219 -6.241 -7.463 1.00 0.00 H new ATOM 2136 N ALA A 139 7.767 -7.922 -4.358 1.00 0.00 N ATOM 2137 CA ALA A 139 7.123 -8.322 -3.109 1.00 0.00 C ATOM 2138 C ALA A 139 5.965 -9.286 -3.351 1.00 0.00 C ATOM 2139 O ALA A 139 5.602 -10.070 -2.477 1.00 0.00 O ATOM 2140 CB ALA A 139 6.631 -7.095 -2.358 1.00 0.00 C ATOM 0 H ALA A 139 7.903 -6.916 -4.456 1.00 0.00 H new ATOM 0 HA ALA A 139 7.867 -8.843 -2.507 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.153 -7.405 -1.429 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.475 -6.444 -2.132 1.00 0.00 H new ATOM 0 HB3 ALA A 139 5.912 -6.556 -2.974 1.00 0.00 H new ATOM 2146 N GLN A 140 5.374 -9.212 -4.538 1.00 0.00 N ATOM 2147 CA GLN A 140 4.245 -10.060 -4.883 1.00 0.00 C ATOM 2148 C GLN A 140 4.536 -11.549 -4.678 1.00 0.00 C ATOM 2149 O GLN A 140 3.608 -12.355 -4.617 1.00 0.00 O ATOM 2150 CB GLN A 140 3.818 -9.815 -6.327 1.00 0.00 C ATOM 2151 CG GLN A 140 4.972 -9.775 -7.311 1.00 0.00 C ATOM 2152 CD GLN A 140 5.457 -11.157 -7.705 1.00 0.00 C ATOM 2153 OE1 GLN A 140 6.651 -11.445 -7.647 1.00 0.00 O ATOM 2154 NE2 GLN A 140 4.530 -12.015 -8.117 1.00 0.00 N ATOM 0 H GLN A 140 5.661 -8.571 -5.278 1.00 0.00 H new ATOM 0 HA GLN A 140 3.435 -9.791 -4.205 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.124 -10.599 -6.628 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.275 -8.871 -6.380 1.00 0.00 H new ATOM 0 HG2 GLN A 140 4.662 -9.235 -8.206 1.00 0.00 H new ATOM 0 HG3 GLN A 140 5.799 -9.216 -6.872 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.551 -11.732 -8.149 1.00 0.00 H new ATOM 0 HE22 GLN A 140 4.798 -12.957 -8.402 1.00 0.00 H new ATOM 2163 N GLU A 141 5.809 -11.923 -4.583 1.00 0.00 N ATOM 2164 CA GLU A 141 6.165 -13.331 -4.396 1.00 0.00 C ATOM 2165 C GLU A 141 7.019 -13.543 -3.144 1.00 0.00 C ATOM 2166 O GLU A 141 6.878 -14.554 -2.456 1.00 0.00 O ATOM 2167 CB GLU A 141 6.878 -13.871 -5.640 1.00 0.00 C ATOM 2168 CG GLU A 141 8.371 -14.033 -5.469 1.00 0.00 C ATOM 2169 CD GLU A 141 9.111 -14.110 -6.790 1.00 0.00 C ATOM 2170 OE1 GLU A 141 8.835 -15.042 -7.573 1.00 0.00 O ATOM 2171 OE2 GLU A 141 9.970 -13.238 -7.039 1.00 0.00 O ATOM 0 H GLU A 141 6.602 -11.284 -4.631 1.00 0.00 H new ATOM 0 HA GLU A 141 5.240 -13.889 -4.252 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.446 -14.836 -5.904 1.00 0.00 H new ATOM 0 HB3 GLU A 141 6.689 -13.198 -6.476 1.00 0.00 H new ATOM 0 HG2 GLU A 141 8.758 -13.195 -4.890 1.00 0.00 H new ATOM 0 HG3 GLU A 141 8.570 -14.937 -4.894 1.00 0.00 H new ATOM 2178 N ARG A 142 7.907 -12.598 -2.857 1.00 0.00 N ATOM 2179 CA ARG A 142 8.780 -12.709 -1.692 1.00 0.00 C ATOM 2180 C ARG A 142 8.065 -12.275 -0.416 1.00 0.00 C ATOM 2181 O ARG A 142 8.486 -12.626 0.688 1.00 0.00 O ATOM 2182 CB ARG A 142 10.050 -11.878 -1.887 1.00 0.00 C ATOM 2183 CG ARG A 142 9.789 -10.483 -2.433 1.00 0.00 C ATOM 2184 CD ARG A 142 10.326 -9.402 -1.509 1.00 0.00 C ATOM 2185 NE ARG A 142 11.767 -9.532 -1.288 1.00 0.00 N ATOM 2186 CZ ARG A 142 12.314 -10.082 -0.204 1.00 0.00 C ATOM 2187 NH1 ARG A 142 11.550 -10.569 0.766 1.00 0.00 N ATOM 2188 NH2 ARG A 142 13.634 -10.149 -0.093 1.00 0.00 N ATOM 0 H ARG A 142 8.042 -11.752 -3.410 1.00 0.00 H new ATOM 0 HA ARG A 142 9.055 -13.759 -1.589 1.00 0.00 H new ATOM 0 HB2 ARG A 142 10.569 -11.794 -0.932 1.00 0.00 H new ATOM 0 HB3 ARG A 142 10.718 -12.406 -2.567 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.253 -10.385 -3.414 1.00 0.00 H new ATOM 0 HG3 ARG A 142 8.717 -10.342 -2.572 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.112 -8.422 -1.936 1.00 0.00 H new ATOM 0 HD3 ARG A 142 9.807 -9.453 -0.552 1.00 0.00 H new ATOM 0 HE ARG A 142 12.394 -9.179 -2.011 1.00 0.00 H new ATOM 0 HH11 ARG A 142 10.534 -10.524 0.686 1.00 0.00 H new ATOM 0 HH12 ARG A 142 11.979 -10.988 1.591 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.228 -9.780 -0.836 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.055 -10.569 0.735 1.00 0.00 H new ATOM 2202 N LEU A 143 6.989 -11.508 -0.564 1.00 0.00 N ATOM 2203 CA LEU A 143 6.234 -11.030 0.586 1.00 0.00 C ATOM 2204 C LEU A 143 5.102 -11.988 0.954 1.00 0.00 C ATOM 2205 O LEU A 143 4.642 -12.005 2.096 1.00 0.00 O ATOM 2206 CB LEU A 143 5.675 -9.641 0.291 1.00 0.00 C ATOM 2207 CG LEU A 143 5.873 -8.619 1.403 1.00 0.00 C ATOM 2208 CD1 LEU A 143 5.134 -9.046 2.663 1.00 0.00 C ATOM 2209 CD2 LEU A 143 7.356 -8.428 1.688 1.00 0.00 C ATOM 0 H LEU A 143 6.622 -11.206 -1.467 1.00 0.00 H new ATOM 0 HA LEU A 143 6.911 -10.978 1.439 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.143 -9.263 -0.618 1.00 0.00 H new ATOM 0 HB3 LEU A 143 4.608 -9.731 0.086 1.00 0.00 H new ATOM 0 HG LEU A 143 5.459 -7.666 1.074 1.00 0.00 H new ATOM 0 HD11 LEU A 143 5.288 -8.302 3.445 1.00 0.00 H new ATOM 0 HD12 LEU A 143 4.069 -9.131 2.449 1.00 0.00 H new ATOM 0 HD13 LEU A 143 5.515 -10.010 2.999 1.00 0.00 H new ATOM 0 HD21 LEU A 143 7.482 -7.695 2.485 1.00 0.00 H new ATOM 0 HD22 LEU A 143 7.792 -9.378 1.997 1.00 0.00 H new ATOM 0 HD23 LEU A 143 7.857 -8.074 0.787 1.00 0.00 H new ATOM 2221 N THR A 144 4.653 -12.782 -0.015 1.00 0.00 N ATOM 2222 CA THR A 144 3.576 -13.736 0.216 1.00 0.00 C ATOM 2223 C THR A 144 3.905 -14.670 1.377 1.00 0.00 C ATOM 2224 O THR A 144 4.815 -15.494 1.284 1.00 0.00 O ATOM 2225 CB THR A 144 3.320 -14.550 -1.049 1.00 0.00 C ATOM 2226 OG1 THR A 144 4.349 -15.502 -1.252 1.00 0.00 O ATOM 2227 CG2 THR A 144 3.227 -13.701 -2.298 1.00 0.00 C ATOM 0 H THR A 144 5.019 -12.782 -0.967 1.00 0.00 H new ATOM 0 HA THR A 144 2.678 -13.176 0.475 1.00 0.00 H new ATOM 0 HB THR A 144 2.359 -15.038 -0.888 1.00 0.00 H new ATOM 0 HG1 THR A 144 4.952 -15.502 -0.479 1.00 0.00 H new ATOM 0 HG21 THR A 144 3.044 -14.342 -3.161 1.00 0.00 H new ATOM 0 HG22 THR A 144 2.408 -12.990 -2.194 1.00 0.00 H new ATOM 0 HG23 THR A 144 4.162 -13.159 -2.440 1.00 0.00 H new ATOM 2235 N GLY A 145 3.157 -14.537 2.468 1.00 0.00 N ATOM 2236 CA GLY A 145 3.384 -15.377 3.630 1.00 0.00 C ATOM 2237 C GLY A 145 4.233 -14.694 4.685 1.00 0.00 C ATOM 2238 O GLY A 145 3.965 -13.554 5.065 1.00 0.00 O ATOM 0 H GLY A 145 2.398 -13.863 2.568 1.00 0.00 H new ATOM 0 HA2 GLY A 145 2.424 -15.656 4.065 1.00 0.00 H new ATOM 0 HA3 GLY A 145 3.872 -16.300 3.317 1.00 0.00 H new ATOM 2242 N ASP A 146 5.258 -15.395 5.160 1.00 0.00 N ATOM 2243 CA ASP A 146 6.150 -14.852 6.178 1.00 0.00 C ATOM 2244 C ASP A 146 7.603 -14.909 5.717 1.00 0.00 C ATOM 2245 O ASP A 146 8.521 -14.975 6.534 1.00 0.00 O ATOM 2246 CB ASP A 146 5.991 -15.626 7.489 1.00 0.00 C ATOM 2247 CG ASP A 146 4.940 -15.016 8.396 1.00 0.00 C ATOM 2248 OD1 ASP A 146 5.139 -13.869 8.848 1.00 0.00 O ATOM 2249 OD2 ASP A 146 3.918 -15.687 8.654 1.00 0.00 O ATOM 0 H ASP A 146 5.491 -16.340 4.856 1.00 0.00 H new ATOM 0 HA ASP A 146 5.880 -13.809 6.342 1.00 0.00 H new ATOM 0 HB2 ASP A 146 5.721 -16.659 7.268 1.00 0.00 H new ATOM 0 HB3 ASP A 146 6.947 -15.651 8.011 1.00 0.00 H new ATOM 2254 N ALA A 147 7.806 -14.879 4.404 1.00 0.00 N ATOM 2255 CA ALA A 147 9.149 -14.925 3.839 1.00 0.00 C ATOM 2256 C ALA A 147 9.837 -13.568 3.954 1.00 0.00 C ATOM 2257 O ALA A 147 11.066 -13.485 3.976 1.00 0.00 O ATOM 2258 CB ALA A 147 9.095 -15.371 2.385 1.00 0.00 C ATOM 0 H ALA A 147 7.058 -14.823 3.712 1.00 0.00 H new ATOM 0 HA ALA A 147 9.733 -15.649 4.407 1.00 0.00 H new ATOM 0 HB1 ALA A 147 10.105 -15.401 1.976 1.00 0.00 H new ATOM 0 HB2 ALA A 147 8.650 -16.364 2.325 1.00 0.00 H new ATOM 0 HB3 ALA A 147 8.492 -14.668 1.811 1.00 0.00 H new ATOM 2264 N PHE A 148 9.038 -12.506 4.027 1.00 0.00 N ATOM 2265 CA PHE A 148 9.570 -11.154 4.141 1.00 0.00 C ATOM 2266 C PHE A 148 10.468 -11.022 5.368 1.00 0.00 C ATOM 2267 O PHE A 148 11.482 -10.324 5.335 1.00 0.00 O ATOM 2268 CB PHE A 148 8.428 -10.139 4.218 1.00 0.00 C ATOM 2269 CG PHE A 148 7.573 -10.288 5.443 1.00 0.00 C ATOM 2270 CD1 PHE A 148 6.541 -11.213 5.477 1.00 0.00 C ATOM 2271 CD2 PHE A 148 7.800 -9.502 6.561 1.00 0.00 C ATOM 2272 CE1 PHE A 148 5.752 -11.351 6.604 1.00 0.00 C ATOM 2273 CE2 PHE A 148 7.014 -9.635 7.691 1.00 0.00 C ATOM 2274 CZ PHE A 148 5.988 -10.561 7.712 1.00 0.00 C ATOM 0 H PHE A 148 8.019 -12.558 4.009 1.00 0.00 H new ATOM 0 HA PHE A 148 10.169 -10.951 3.253 1.00 0.00 H new ATOM 0 HB2 PHE A 148 8.846 -9.132 4.197 1.00 0.00 H new ATOM 0 HB3 PHE A 148 7.801 -10.242 3.333 1.00 0.00 H new ATOM 0 HD1 PHE A 148 6.351 -11.833 4.613 1.00 0.00 H new ATOM 0 HD2 PHE A 148 8.600 -8.777 6.550 1.00 0.00 H new ATOM 0 HE1 PHE A 148 4.952 -12.076 6.618 1.00 0.00 H new ATOM 0 HE2 PHE A 148 7.202 -9.016 8.556 1.00 0.00 H new ATOM 0 HZ PHE A 148 5.372 -10.667 8.593 1.00 0.00 H new ATOM 2284 N ARG A 149 10.086 -11.694 6.448 1.00 0.00 N ATOM 2285 CA ARG A 149 10.849 -11.654 7.683 1.00 0.00 C ATOM 2286 C ARG A 149 12.199 -12.341 7.506 1.00 0.00 C ATOM 2287 O ARG A 149 12.548 -12.776 6.408 1.00 0.00 O ATOM 2288 CB ARG A 149 10.057 -12.328 8.801 1.00 0.00 C ATOM 2289 CG ARG A 149 8.834 -11.540 9.239 1.00 0.00 C ATOM 2290 CD ARG A 149 8.406 -11.915 10.648 1.00 0.00 C ATOM 2291 NE ARG A 149 7.906 -10.763 11.395 1.00 0.00 N ATOM 2292 CZ ARG A 149 8.689 -9.851 11.964 1.00 0.00 C ATOM 2293 NH1 ARG A 149 10.011 -9.953 11.874 1.00 0.00 N ATOM 2294 NH2 ARG A 149 8.153 -8.835 12.626 1.00 0.00 N ATOM 0 H ARG A 149 9.248 -12.274 6.490 1.00 0.00 H new ATOM 0 HA ARG A 149 11.029 -10.612 7.948 1.00 0.00 H new ATOM 0 HB2 ARG A 149 9.742 -13.316 8.467 1.00 0.00 H new ATOM 0 HB3 ARG A 149 10.711 -12.476 9.660 1.00 0.00 H new ATOM 0 HG2 ARG A 149 9.053 -10.473 9.196 1.00 0.00 H new ATOM 0 HG3 ARG A 149 8.013 -11.726 8.547 1.00 0.00 H new ATOM 0 HD2 ARG A 149 7.631 -12.680 10.600 1.00 0.00 H new ATOM 0 HD3 ARG A 149 9.252 -12.352 11.179 1.00 0.00 H new ATOM 0 HE ARG A 149 6.896 -10.652 11.485 1.00 0.00 H new ATOM 0 HH11 ARG A 149 10.429 -10.733 11.367 1.00 0.00 H new ATOM 0 HH12 ARG A 149 10.608 -9.251 12.312 1.00 0.00 H new ATOM 0 HH21 ARG A 149 7.139 -8.752 12.699 1.00 0.00 H new ATOM 0 HH22 ARG A 149 8.755 -8.136 13.062 1.00 0.00 H new ATOM 2308 N LYS A 150 12.954 -12.436 8.594 1.00 0.00 N ATOM 2309 CA LYS A 150 14.266 -13.071 8.559 1.00 0.00 C ATOM 2310 C LYS A 150 14.133 -14.591 8.533 1.00 0.00 C ATOM 2311 O LYS A 150 13.257 -15.158 9.187 1.00 0.00 O ATOM 2312 CB LYS A 150 15.099 -12.637 9.768 1.00 0.00 C ATOM 2313 CG LYS A 150 16.070 -11.509 9.464 1.00 0.00 C ATOM 2314 CD LYS A 150 16.260 -10.597 10.664 1.00 0.00 C ATOM 2315 CE LYS A 150 16.636 -9.187 10.239 1.00 0.00 C ATOM 2316 NZ LYS A 150 18.112 -9.000 10.175 1.00 0.00 N ATOM 0 H LYS A 150 12.681 -12.082 9.511 1.00 0.00 H new ATOM 0 HA LYS A 150 14.773 -12.754 7.648 1.00 0.00 H new ATOM 0 HB2 LYS A 150 14.428 -12.322 10.567 1.00 0.00 H new ATOM 0 HB3 LYS A 150 15.658 -13.495 10.141 1.00 0.00 H new ATOM 0 HG2 LYS A 150 17.032 -11.926 9.167 1.00 0.00 H new ATOM 0 HG3 LYS A 150 15.701 -10.928 8.619 1.00 0.00 H new ATOM 0 HD2 LYS A 150 15.341 -10.569 11.250 1.00 0.00 H new ATOM 0 HD3 LYS A 150 17.038 -11.003 11.311 1.00 0.00 H new ATOM 0 HE2 LYS A 150 16.201 -8.974 9.263 1.00 0.00 H new ATOM 0 HE3 LYS A 150 16.210 -8.471 10.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 18.326 -8.026 9.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 18.525 -9.178 11.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 18.517 -9.666 9.486 1.00 0.00 H new ATOM 2330 N LYS A 151 15.007 -15.243 7.774 1.00 0.00 N ATOM 2331 CA LYS A 151 14.985 -16.698 7.660 1.00 0.00 C ATOM 2332 C LYS A 151 13.664 -17.175 7.064 1.00 0.00 C ATOM 2333 O LYS A 151 12.816 -16.367 6.683 1.00 0.00 O ATOM 2334 CB LYS A 151 15.201 -17.340 9.033 1.00 0.00 C ATOM 2335 CG LYS A 151 16.551 -17.012 9.650 1.00 0.00 C ATOM 2336 CD LYS A 151 17.685 -17.698 8.907 1.00 0.00 C ATOM 2337 CE LYS A 151 17.726 -19.188 9.205 1.00 0.00 C ATOM 2338 NZ LYS A 151 18.378 -19.955 8.108 1.00 0.00 N ATOM 0 H LYS A 151 15.739 -14.788 7.229 1.00 0.00 H new ATOM 0 HA LYS A 151 15.794 -17.000 6.994 1.00 0.00 H new ATOM 0 HB2 LYS A 151 14.412 -17.009 9.708 1.00 0.00 H new ATOM 0 HB3 LYS A 151 15.107 -18.422 8.938 1.00 0.00 H new ATOM 0 HG2 LYS A 151 16.706 -15.933 9.636 1.00 0.00 H new ATOM 0 HG3 LYS A 151 16.559 -17.322 10.695 1.00 0.00 H new ATOM 0 HD2 LYS A 151 17.565 -17.544 7.835 1.00 0.00 H new ATOM 0 HD3 LYS A 151 18.634 -17.243 9.190 1.00 0.00 H new ATOM 0 HE2 LYS A 151 18.265 -19.357 10.137 1.00 0.00 H new ATOM 0 HE3 LYS A 151 16.711 -19.557 9.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 18.386 -20.967 8.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 17.849 -19.814 7.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 19.355 -19.621 7.984 1.00 0.00 H new ATOM 2352 N HIS A 152 13.495 -18.490 6.984 1.00 0.00 N ATOM 2353 CA HIS A 152 12.278 -19.071 6.433 1.00 0.00 C ATOM 2354 C HIS A 152 11.098 -18.864 7.377 1.00 0.00 C ATOM 2355 O HIS A 152 9.995 -18.529 6.945 1.00 0.00 O ATOM 2356 CB HIS A 152 12.473 -20.565 6.163 1.00 0.00 C ATOM 2357 CG HIS A 152 13.433 -20.851 5.051 1.00 0.00 C ATOM 2358 ND1 HIS A 152 14.691 -20.292 4.976 1.00 0.00 N ATOM 2359 CD2 HIS A 152 13.312 -21.647 3.961 1.00 0.00 C ATOM 2360 CE1 HIS A 152 15.302 -20.729 3.890 1.00 0.00 C ATOM 2361 NE2 HIS A 152 14.486 -21.553 3.257 1.00 0.00 N ATOM 0 H HIS A 152 14.186 -19.173 7.294 1.00 0.00 H new ATOM 0 HA HIS A 152 12.061 -18.565 5.492 1.00 0.00 H new ATOM 0 HB2 HIS A 152 12.830 -21.047 7.073 1.00 0.00 H new ATOM 0 HB3 HIS A 152 11.508 -21.012 5.923 1.00 0.00 H new ATOM 0 HD2 HIS A 152 12.452 -22.244 3.696 1.00 0.00 H new ATOM 0 HE1 HIS A 152 16.299 -20.459 3.573 1.00 0.00 H new ATOM 0 HE2 HIS A 152 14.695 -22.041 2.386 1.00 0.00 H new ATOM 2370 N LEU A 153 11.338 -19.062 8.669 1.00 0.00 N ATOM 2371 CA LEU A 153 10.296 -18.895 9.675 1.00 0.00 C ATOM 2372 C LEU A 153 10.903 -18.616 11.046 1.00 0.00 C ATOM 2373 O LEU A 153 11.930 -19.187 11.409 1.00 0.00 O ATOM 2374 CB LEU A 153 9.414 -20.145 9.740 1.00 0.00 C ATOM 2375 CG LEU A 153 10.171 -21.462 9.924 1.00 0.00 C ATOM 2376 CD1 LEU A 153 9.457 -22.354 10.928 1.00 0.00 C ATOM 2377 CD2 LEU A 153 10.325 -22.179 8.590 1.00 0.00 C ATOM 0 H LEU A 153 12.245 -19.338 9.044 1.00 0.00 H new ATOM 0 HA LEU A 153 9.683 -18.041 9.388 1.00 0.00 H new ATOM 0 HB2 LEU A 153 8.708 -20.031 10.563 1.00 0.00 H new ATOM 0 HB3 LEU A 153 8.827 -20.206 8.823 1.00 0.00 H new ATOM 0 HG LEU A 153 11.164 -21.236 10.311 1.00 0.00 H new ATOM 0 HD11 LEU A 153 10.011 -23.286 11.045 1.00 0.00 H new ATOM 0 HD12 LEU A 153 9.397 -21.844 11.890 1.00 0.00 H new ATOM 0 HD13 LEU A 153 8.451 -22.572 10.570 1.00 0.00 H new ATOM 0 HD21 LEU A 153 10.866 -23.114 8.740 1.00 0.00 H new ATOM 0 HD22 LEU A 153 9.340 -22.392 8.176 1.00 0.00 H new ATOM 0 HD23 LEU A 153 10.880 -21.545 7.898 1.00 0.00 H new ATOM 2389 N GLU A 154 10.258 -17.734 11.802 1.00 0.00 N ATOM 2390 CA GLU A 154 10.734 -17.377 13.134 1.00 0.00 C ATOM 2391 C GLU A 154 9.729 -17.800 14.202 1.00 0.00 C ATOM 2392 O GLU A 154 8.625 -18.245 13.887 1.00 0.00 O ATOM 2393 CB GLU A 154 10.987 -15.871 13.223 1.00 0.00 C ATOM 2394 CG GLU A 154 9.748 -15.030 12.958 1.00 0.00 C ATOM 2395 CD GLU A 154 9.161 -14.441 14.225 1.00 0.00 C ATOM 2396 OE1 GLU A 154 9.912 -13.789 14.981 1.00 0.00 O ATOM 2397 OE2 GLU A 154 7.951 -14.633 14.463 1.00 0.00 O ATOM 0 H GLU A 154 9.405 -17.253 11.516 1.00 0.00 H new ATOM 0 HA GLU A 154 11.670 -17.906 13.311 1.00 0.00 H new ATOM 0 HB2 GLU A 154 11.372 -15.633 14.215 1.00 0.00 H new ATOM 0 HB3 GLU A 154 11.762 -15.598 12.506 1.00 0.00 H new ATOM 0 HG2 GLU A 154 10.001 -14.223 12.270 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.995 -15.645 12.465 1.00 0.00 H new ATOM 2404 N ASP A 155 10.117 -17.655 15.465 1.00 0.00 N ATOM 2405 CA ASP A 155 9.251 -18.021 16.578 1.00 0.00 C ATOM 2406 C ASP A 155 8.902 -19.506 16.530 1.00 0.00 C ATOM 2407 O ASP A 155 8.092 -19.937 15.709 1.00 0.00 O ATOM 2408 CB ASP A 155 7.972 -17.183 16.553 1.00 0.00 C ATOM 2409 CG ASP A 155 7.535 -16.752 17.939 1.00 0.00 C ATOM 2410 OD1 ASP A 155 7.427 -17.627 18.825 1.00 0.00 O ATOM 2411 OD2 ASP A 155 7.301 -15.542 18.138 1.00 0.00 O ATOM 0 H ASP A 155 11.027 -17.286 15.742 1.00 0.00 H new ATOM 0 HA ASP A 155 9.789 -17.822 17.505 1.00 0.00 H new ATOM 0 HB2 ASP A 155 8.132 -16.300 15.935 1.00 0.00 H new ATOM 0 HB3 ASP A 155 7.173 -17.759 16.086 1.00 0.00 H new ATOM 2416 N GLU A 156 9.518 -20.282 17.415 1.00 0.00 N ATOM 2417 CA GLU A 156 9.272 -21.719 17.474 1.00 0.00 C ATOM 2418 C GLU A 156 9.477 -22.249 18.888 1.00 0.00 C ATOM 2419 O GLU A 156 8.638 -22.976 19.418 1.00 0.00 O ATOM 2420 CB GLU A 156 10.195 -22.455 16.502 1.00 0.00 C ATOM 2421 CG GLU A 156 9.743 -23.872 16.188 1.00 0.00 C ATOM 2422 CD GLU A 156 8.492 -23.908 15.333 1.00 0.00 C ATOM 2423 OE1 GLU A 156 7.419 -23.507 15.832 1.00 0.00 O ATOM 2424 OE2 GLU A 156 8.584 -24.338 14.164 1.00 0.00 O ATOM 0 H GLU A 156 10.191 -19.941 18.101 1.00 0.00 H new ATOM 0 HA GLU A 156 8.236 -21.897 17.186 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.257 -21.888 15.573 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.200 -22.488 16.923 1.00 0.00 H new ATOM 0 HG2 GLU A 156 10.546 -24.400 15.673 1.00 0.00 H new ATOM 0 HG3 GLU A 156 9.557 -24.405 17.120 1.00 0.00 H new ATOM 2431 N LEU A 157 10.600 -21.879 19.496 1.00 0.00 N ATOM 2432 CA LEU A 157 10.917 -22.317 20.851 1.00 0.00 C ATOM 2433 C LEU A 157 10.422 -21.305 21.880 1.00 0.00 C ATOM 2434 O LEU A 157 9.915 -21.737 22.936 1.00 0.00 O ATOM 2435 CB LEU A 157 12.426 -22.521 21.004 1.00 0.00 C ATOM 2436 CG LEU A 157 12.930 -23.919 20.637 1.00 0.00 C ATOM 2437 CD1 LEU A 157 14.057 -23.834 19.618 1.00 0.00 C ATOM 2438 CD2 LEU A 157 13.391 -24.665 21.881 1.00 0.00 C ATOM 2439 OXT LEU A 157 10.546 -20.090 21.620 1.00 0.00 O ATOM 0 H LEU A 157 11.306 -21.277 19.072 1.00 0.00 H new ATOM 0 HA LEU A 157 10.409 -23.265 21.027 1.00 0.00 H new ATOM 0 HB2 LEU A 157 12.941 -21.790 20.381 1.00 0.00 H new ATOM 0 HB3 LEU A 157 12.703 -22.311 22.037 1.00 0.00 H new ATOM 0 HG LEU A 157 12.105 -24.473 20.189 1.00 0.00 H new ATOM 0 HD11 LEU A 157 14.401 -24.838 19.371 1.00 0.00 H new ATOM 0 HD12 LEU A 157 13.695 -23.342 18.715 1.00 0.00 H new ATOM 0 HD13 LEU A 157 14.884 -23.260 20.037 1.00 0.00 H new ATOM 0 HD21 LEU A 157 13.746 -25.657 21.600 1.00 0.00 H new ATOM 0 HD22 LEU A 157 14.200 -24.112 22.358 1.00 0.00 H new ATOM 0 HD23 LEU A 157 12.558 -24.761 22.577 1.00 0.00 H new TER 2451 LEU A 157