USER MOD reduce.3.24.130724 H: found=0, std=0, add=842, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 841 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 77 HIS : no HD1:sc= -1.5 K(o=-3.6,f=-4.4) USER MOD Set 1.2: A 79 HIS : no HD1:sc= -1.57! C(o=-3.6!,f=-5.4!) USER MOD Set 1.3: A 125 SER OG : rot -80:sc= -0.507 USER MOD Single : A 64 SER OG : rot 17:sc= 0.704 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.0478 K(o=-0.048,f=-2.8!) USER MOD Single : A 71 LYS NZ :NH3+ -154:sc= -0.477 (180deg=-1.31) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0371 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.392 K(o=-0.39,f=-2.5!) USER MOD Single : A 86 SER OG : rot 150:sc= -1.27 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.0633 USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 95 LYS NZ :NH3+ 153:sc= -0.0683 (180deg=-0.308) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 159:sc= -0.0564 (180deg=-0.409) USER MOD Single : A 115 THR OG1 : rot 180:sc= -1.07 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 171:sc= -1.65 (180deg=-1.75!) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.658 K(o=-0.66,f=-4.7!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 ASN : amide:sc= -0.337 K(o=-0.34,f=-2.3) USER MOD Single : A 137 GLN :FLIP amide:sc= -0.506 F(o=-1.9,f=-0.51) USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 139 MET CE :methyl -147:sc= -2.6 (180deg=-5.28!) USER MOD Single : A 142 GLN :FLIP amide:sc= -0.51 F(o=-1,f=-0.51) USER MOD Single : A 148 GLN : amide:sc= 0.976 K(o=0.98,f=-0.35) USER MOD Single : A 151 THR OG1 : rot 80:sc= -1.82 USER MOD Single : A 152 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.3) USER MOD Single : A 155 THR OG1 : rot 180:sc= -0.145 USER MOD Single : A 157 LYS NZ :NH3+ 178:sc= 0.0463 (180deg=0.0457) USER MOD Single : A 162 LYS NZ :NH3+ 161:sc= 0.528 (180deg=0.464) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 SER OG : rot 180:sc= -0.0043 USER MOD Single : A 168 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 169 THR OG1 : rot 25:sc= 0.136 USER MOD Single : A 170 LYS NZ :NH3+ 166:sc= -0.0584 (180deg=-0.372) USER MOD Single : A 171 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 172 SER OG : rot 180:sc= 0 USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 176 SER OG : rot 26:sc= 0.0401 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 63 12.878 -10.154 23.090 1.00 0.00 N ATOM 2 CA GLY A 63 13.276 -9.180 24.090 1.00 0.00 C ATOM 3 C GLY A 63 13.940 -7.961 23.481 1.00 0.00 C ATOM 4 O GLY A 63 13.311 -7.208 22.739 1.00 0.00 O ATOM 0 HA2 GLY A 63 12.399 -8.867 24.657 1.00 0.00 H new ATOM 0 HA3 GLY A 63 13.962 -9.648 24.796 1.00 0.00 H new ATOM 8 N SER A 64 15.217 -7.766 23.796 1.00 0.00 N ATOM 9 CA SER A 64 15.966 -6.627 23.279 1.00 0.00 C ATOM 10 C SER A 64 16.971 -7.073 22.222 1.00 0.00 C ATOM 11 O SER A 64 17.865 -7.874 22.497 1.00 0.00 O ATOM 12 CB SER A 64 16.692 -5.908 24.418 1.00 0.00 C ATOM 13 OG SER A 64 17.770 -6.686 24.907 1.00 0.00 O ATOM 0 H SER A 64 15.754 -8.382 24.406 1.00 0.00 H new ATOM 0 HA SER A 64 15.259 -5.938 22.816 1.00 0.00 H new ATOM 0 HB2 SER A 64 17.064 -4.946 24.066 1.00 0.00 H new ATOM 0 HB3 SER A 64 15.991 -5.702 25.227 1.00 0.00 H new ATOM 0 HG SER A 64 17.995 -7.381 24.253 1.00 0.00 H new ATOM 19 N SER A 65 16.818 -6.548 21.010 1.00 0.00 N ATOM 20 CA SER A 65 17.709 -6.894 19.909 1.00 0.00 C ATOM 21 C SER A 65 18.298 -5.640 19.272 1.00 0.00 C ATOM 22 O SER A 65 17.737 -5.087 18.327 1.00 0.00 O ATOM 23 CB SER A 65 16.958 -7.711 18.855 1.00 0.00 C ATOM 24 OG SER A 65 17.827 -8.118 17.812 1.00 0.00 O ATOM 0 H SER A 65 16.085 -5.882 20.766 1.00 0.00 H new ATOM 0 HA SER A 65 18.526 -7.494 20.310 1.00 0.00 H new ATOM 0 HB2 SER A 65 16.509 -8.588 19.322 1.00 0.00 H new ATOM 0 HB3 SER A 65 16.143 -7.117 18.442 1.00 0.00 H new ATOM 0 HG SER A 65 17.324 -8.640 17.152 1.00 0.00 H new ATOM 30 N GLY A 66 19.436 -5.195 19.798 1.00 0.00 N ATOM 31 CA GLY A 66 20.083 -4.009 19.269 1.00 0.00 C ATOM 32 C GLY A 66 20.386 -4.124 17.788 1.00 0.00 C ATOM 33 O GLY A 66 21.011 -5.089 17.349 1.00 0.00 O ATOM 0 H GLY A 66 19.921 -5.635 20.580 1.00 0.00 H new ATOM 0 HA2 GLY A 66 19.443 -3.143 19.439 1.00 0.00 H new ATOM 0 HA3 GLY A 66 21.010 -3.832 19.814 1.00 0.00 H new ATOM 37 N SER A 67 19.939 -3.139 17.016 1.00 0.00 N ATOM 38 CA SER A 67 20.160 -3.137 15.575 1.00 0.00 C ATOM 39 C SER A 67 20.881 -1.865 15.138 1.00 0.00 C ATOM 40 O SER A 67 21.886 -1.920 14.429 1.00 0.00 O ATOM 41 CB SER A 67 18.828 -3.262 14.833 1.00 0.00 C ATOM 42 OG SER A 67 18.281 -4.560 14.983 1.00 0.00 O ATOM 0 H SER A 67 19.422 -2.332 17.364 1.00 0.00 H new ATOM 0 HA SER A 67 20.787 -3.993 15.327 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.125 -2.521 15.214 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.976 -3.046 13.775 1.00 0.00 H new ATOM 0 HG SER A 67 17.429 -4.614 14.501 1.00 0.00 H new ATOM 48 N SER A 68 20.360 -0.720 15.566 1.00 0.00 N ATOM 49 CA SER A 68 20.951 0.567 15.217 1.00 0.00 C ATOM 50 C SER A 68 21.394 0.583 13.757 1.00 0.00 C ATOM 51 O SER A 68 22.471 1.079 13.429 1.00 0.00 O ATOM 52 CB SER A 68 22.142 0.869 16.128 1.00 0.00 C ATOM 53 OG SER A 68 21.727 1.042 17.471 1.00 0.00 O ATOM 0 H SER A 68 19.530 -0.657 16.155 1.00 0.00 H new ATOM 0 HA SER A 68 20.193 1.337 15.356 1.00 0.00 H new ATOM 0 HB2 SER A 68 22.864 0.055 16.070 1.00 0.00 H new ATOM 0 HB3 SER A 68 22.649 1.770 15.782 1.00 0.00 H new ATOM 0 HG SER A 68 22.507 1.232 18.033 1.00 0.00 H new ATOM 59 N GLY A 69 20.555 0.034 12.884 1.00 0.00 N ATOM 60 CA GLY A 69 20.877 -0.006 11.470 1.00 0.00 C ATOM 61 C GLY A 69 19.760 0.544 10.605 1.00 0.00 C ATOM 62 O GLY A 69 20.005 1.332 9.692 1.00 0.00 O ATOM 0 H GLY A 69 19.658 -0.384 13.131 1.00 0.00 H new ATOM 0 HA2 GLY A 69 21.787 0.567 11.291 1.00 0.00 H new ATOM 0 HA3 GLY A 69 21.086 -1.035 11.177 1.00 0.00 H new ATOM 66 N GLN A 70 18.532 0.127 10.892 1.00 0.00 N ATOM 67 CA GLN A 70 17.374 0.582 10.132 1.00 0.00 C ATOM 68 C GLN A 70 16.706 1.770 10.815 1.00 0.00 C ATOM 69 O GLN A 70 17.001 2.083 11.969 1.00 0.00 O ATOM 70 CB GLN A 70 16.367 -0.558 9.966 1.00 0.00 C ATOM 71 CG GLN A 70 16.660 -1.460 8.778 1.00 0.00 C ATOM 72 CD GLN A 70 16.338 -0.801 7.451 1.00 0.00 C ATOM 73 OE1 GLN A 70 15.947 0.366 7.403 1.00 0.00 O ATOM 74 NE2 GLN A 70 16.501 -1.546 6.364 1.00 0.00 N ATOM 0 H GLN A 70 18.313 -0.525 11.645 1.00 0.00 H new ATOM 0 HA GLN A 70 17.719 0.900 9.148 1.00 0.00 H new ATOM 0 HB2 GLN A 70 16.359 -1.160 10.875 1.00 0.00 H new ATOM 0 HB3 GLN A 70 15.368 -0.136 9.854 1.00 0.00 H new ATOM 0 HG2 GLN A 70 17.712 -1.743 8.793 1.00 0.00 H new ATOM 0 HG3 GLN A 70 16.081 -2.379 8.873 1.00 0.00 H new ATOM 0 HE21 GLN A 70 16.827 -2.509 6.450 1.00 0.00 H new ATOM 0 HE22 GLN A 70 16.300 -1.156 5.443 1.00 0.00 H new ATOM 83 N LYS A 71 15.804 2.430 10.097 1.00 0.00 N ATOM 84 CA LYS A 71 15.092 3.584 10.633 1.00 0.00 C ATOM 85 C LYS A 71 13.999 4.043 9.674 1.00 0.00 C ATOM 86 O LYS A 71 14.094 3.838 8.463 1.00 0.00 O ATOM 87 CB LYS A 71 16.068 4.733 10.898 1.00 0.00 C ATOM 88 CG LYS A 71 15.540 5.766 11.877 1.00 0.00 C ATOM 89 CD LYS A 71 15.893 5.407 13.311 1.00 0.00 C ATOM 90 CE LYS A 71 17.248 5.972 13.709 1.00 0.00 C ATOM 91 NZ LYS A 71 18.369 5.131 13.204 1.00 0.00 N ATOM 0 H LYS A 71 15.548 2.185 9.140 1.00 0.00 H new ATOM 0 HA LYS A 71 14.625 3.287 11.572 1.00 0.00 H new ATOM 0 HB2 LYS A 71 17.002 4.324 11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 71 16.301 5.225 9.954 1.00 0.00 H new ATOM 0 HG2 LYS A 71 15.954 6.744 11.633 1.00 0.00 H new ATOM 0 HG3 LYS A 71 14.457 5.844 11.776 1.00 0.00 H new ATOM 0 HD2 LYS A 71 15.126 5.791 13.983 1.00 0.00 H new ATOM 0 HD3 LYS A 71 15.902 4.323 13.424 1.00 0.00 H new ATOM 0 HE2 LYS A 71 17.349 6.984 13.318 1.00 0.00 H new ATOM 0 HE3 LYS A 71 17.307 6.043 14.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 19.200 5.256 13.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 18.082 4.131 13.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 18.608 5.418 12.233 1.00 0.00 H new ATOM 105 N LYS A 72 12.961 4.666 10.222 1.00 0.00 N ATOM 106 CA LYS A 72 11.850 5.157 9.415 1.00 0.00 C ATOM 107 C LYS A 72 12.201 6.488 8.758 1.00 0.00 C ATOM 108 O LYS A 72 11.433 7.448 8.829 1.00 0.00 O ATOM 109 CB LYS A 72 10.597 5.318 10.279 1.00 0.00 C ATOM 110 CG LYS A 72 9.912 4.002 10.607 1.00 0.00 C ATOM 111 CD LYS A 72 8.900 3.620 9.541 1.00 0.00 C ATOM 112 CE LYS A 72 7.626 4.442 9.660 1.00 0.00 C ATOM 113 NZ LYS A 72 6.792 4.354 8.430 1.00 0.00 N ATOM 0 H LYS A 72 12.866 4.843 11.222 1.00 0.00 H new ATOM 0 HA LYS A 72 11.652 4.426 8.631 1.00 0.00 H new ATOM 0 HB2 LYS A 72 10.868 5.818 11.209 1.00 0.00 H new ATOM 0 HB3 LYS A 72 9.890 5.967 9.762 1.00 0.00 H new ATOM 0 HG2 LYS A 72 10.660 3.214 10.699 1.00 0.00 H new ATOM 0 HG3 LYS A 72 9.412 4.081 11.573 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.338 3.767 8.554 1.00 0.00 H new ATOM 0 HD3 LYS A 72 8.660 2.560 9.629 1.00 0.00 H new ATOM 0 HE2 LYS A 72 7.048 4.094 10.516 1.00 0.00 H new ATOM 0 HE3 LYS A 72 7.883 5.484 9.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 5.933 4.928 8.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 7.334 4.710 7.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 6.525 3.363 8.262 1.00 0.00 H new ATOM 127 N ASP A 73 13.364 6.538 8.118 1.00 0.00 N ATOM 128 CA ASP A 73 13.816 7.751 7.446 1.00 0.00 C ATOM 129 C ASP A 73 13.447 7.722 5.966 1.00 0.00 C ATOM 130 O ASP A 73 14.181 8.235 5.121 1.00 0.00 O ATOM 131 CB ASP A 73 15.328 7.914 7.604 1.00 0.00 C ATOM 132 CG ASP A 73 16.106 6.834 6.879 1.00 0.00 C ATOM 133 OD1 ASP A 73 15.858 5.640 7.151 1.00 0.00 O ATOM 134 OD2 ASP A 73 16.962 7.181 6.039 1.00 0.00 O ATOM 0 H ASP A 73 14.011 5.752 8.050 1.00 0.00 H new ATOM 0 HA ASP A 73 13.316 8.601 7.910 1.00 0.00 H new ATOM 0 HB2 ASP A 73 15.627 8.891 7.223 1.00 0.00 H new ATOM 0 HB3 ASP A 73 15.584 7.893 8.663 1.00 0.00 H new ATOM 139 N THR A 74 12.303 7.117 5.658 1.00 0.00 N ATOM 140 CA THR A 74 11.838 7.019 4.281 1.00 0.00 C ATOM 141 C THR A 74 11.535 8.396 3.703 1.00 0.00 C ATOM 142 O THR A 74 10.374 8.783 3.570 1.00 0.00 O ATOM 143 CB THR A 74 10.575 6.142 4.176 1.00 0.00 C ATOM 144 OG1 THR A 74 10.594 5.133 5.192 1.00 0.00 O ATOM 145 CG2 THR A 74 10.484 5.487 2.806 1.00 0.00 C ATOM 0 H THR A 74 11.682 6.688 6.344 1.00 0.00 H new ATOM 0 HA THR A 74 12.642 6.557 3.708 1.00 0.00 H new ATOM 0 HB THR A 74 9.703 6.781 4.315 1.00 0.00 H new ATOM 0 HG1 THR A 74 9.788 4.581 5.120 1.00 0.00 H new ATOM 0 HG21 THR A 74 9.585 4.873 2.755 1.00 0.00 H new ATOM 0 HG22 THR A 74 10.441 6.258 2.036 1.00 0.00 H new ATOM 0 HG23 THR A 74 11.361 4.860 2.643 1.00 0.00 H new ATOM 153 N SER A 75 12.587 9.133 3.361 1.00 0.00 N ATOM 154 CA SER A 75 12.433 10.470 2.800 1.00 0.00 C ATOM 155 C SER A 75 12.404 10.420 1.275 1.00 0.00 C ATOM 156 O SER A 75 12.971 9.516 0.663 1.00 0.00 O ATOM 157 CB SER A 75 13.572 11.378 3.269 1.00 0.00 C ATOM 158 OG SER A 75 13.517 11.580 4.671 1.00 0.00 O ATOM 0 H SER A 75 13.555 8.827 3.463 1.00 0.00 H new ATOM 0 HA SER A 75 11.485 10.877 3.152 1.00 0.00 H new ATOM 0 HB2 SER A 75 14.530 10.934 2.999 1.00 0.00 H new ATOM 0 HB3 SER A 75 13.510 12.338 2.757 1.00 0.00 H new ATOM 0 HG SER A 75 14.256 12.162 4.947 1.00 0.00 H new ATOM 164 N ASN A 76 11.739 11.398 0.669 1.00 0.00 N ATOM 165 CA ASN A 76 11.634 11.465 -0.784 1.00 0.00 C ATOM 166 C ASN A 76 11.041 10.177 -1.347 1.00 0.00 C ATOM 167 O ASN A 76 11.359 9.772 -2.466 1.00 0.00 O ATOM 168 CB ASN A 76 13.010 11.720 -1.403 1.00 0.00 C ATOM 169 CG ASN A 76 13.704 12.923 -0.796 1.00 0.00 C ATOM 170 OD1 ASN A 76 13.142 13.614 0.055 1.00 0.00 O ATOM 171 ND2 ASN A 76 14.932 13.181 -1.231 1.00 0.00 N ATOM 0 H ASN A 76 11.265 12.155 1.161 1.00 0.00 H new ATOM 0 HA ASN A 76 10.969 12.291 -1.038 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.635 10.837 -1.268 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.900 11.871 -2.477 1.00 0.00 H new ATOM 0 HD21 ASN A 76 15.448 13.978 -0.859 1.00 0.00 H new ATOM 0 HD22 ASN A 76 15.359 12.582 -1.937 1.00 0.00 H new ATOM 178 N HIS A 77 10.177 9.538 -0.565 1.00 0.00 N ATOM 179 CA HIS A 77 9.538 8.297 -0.986 1.00 0.00 C ATOM 180 C HIS A 77 8.023 8.461 -1.052 1.00 0.00 C ATOM 181 O HIS A 77 7.459 9.370 -0.442 1.00 0.00 O ATOM 182 CB HIS A 77 9.898 7.162 -0.026 1.00 0.00 C ATOM 183 CG HIS A 77 11.220 6.523 -0.322 1.00 0.00 C ATOM 184 ND1 HIS A 77 11.491 5.198 -0.058 1.00 0.00 N ATOM 185 CD2 HIS A 77 12.349 7.036 -0.865 1.00 0.00 C ATOM 186 CE1 HIS A 77 12.730 4.922 -0.424 1.00 0.00 C ATOM 187 NE2 HIS A 77 13.272 6.021 -0.917 1.00 0.00 N ATOM 0 H HIS A 77 9.903 9.859 0.364 1.00 0.00 H new ATOM 0 HA HIS A 77 9.903 8.050 -1.983 1.00 0.00 H new ATOM 0 HB2 HIS A 77 9.911 7.549 0.993 1.00 0.00 H new ATOM 0 HB3 HIS A 77 9.119 6.401 -0.068 1.00 0.00 H new ATOM 0 HD2 HIS A 77 12.496 8.054 -1.196 1.00 0.00 H new ATOM 0 HE1 HIS A 77 13.217 3.962 -0.335 1.00 0.00 H new ATOM 0 HE2 HIS A 77 14.223 6.102 -1.278 1.00 0.00 H new ATOM 195 N PHE A 78 7.368 7.577 -1.797 1.00 0.00 N ATOM 196 CA PHE A 78 5.918 7.625 -1.945 1.00 0.00 C ATOM 197 C PHE A 78 5.269 6.383 -1.342 1.00 0.00 C ATOM 198 O PHE A 78 5.431 5.274 -1.851 1.00 0.00 O ATOM 199 CB PHE A 78 5.539 7.746 -3.422 1.00 0.00 C ATOM 200 CG PHE A 78 5.985 9.034 -4.052 1.00 0.00 C ATOM 201 CD1 PHE A 78 7.302 9.208 -4.447 1.00 0.00 C ATOM 202 CD2 PHE A 78 5.088 10.072 -4.249 1.00 0.00 C ATOM 203 CE1 PHE A 78 7.716 10.392 -5.028 1.00 0.00 C ATOM 204 CE2 PHE A 78 5.497 11.258 -4.829 1.00 0.00 C ATOM 205 CZ PHE A 78 6.812 11.419 -5.218 1.00 0.00 C ATOM 0 H PHE A 78 7.819 6.818 -2.308 1.00 0.00 H new ATOM 0 HA PHE A 78 5.552 8.501 -1.410 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.977 6.912 -3.971 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.457 7.659 -3.519 1.00 0.00 H new ATOM 0 HD1 PHE A 78 8.013 8.409 -4.299 1.00 0.00 H new ATOM 0 HD2 PHE A 78 4.058 9.953 -3.946 1.00 0.00 H new ATOM 0 HE1 PHE A 78 8.745 10.514 -5.333 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.788 12.059 -4.978 1.00 0.00 H new ATOM 0 HZ PHE A 78 7.133 12.346 -5.670 1.00 0.00 H new ATOM 215 N HIS A 79 4.532 6.578 -0.252 1.00 0.00 N ATOM 216 CA HIS A 79 3.857 5.475 0.422 1.00 0.00 C ATOM 217 C HIS A 79 2.532 5.150 -0.261 1.00 0.00 C ATOM 218 O HIS A 79 1.818 6.047 -0.711 1.00 0.00 O ATOM 219 CB HIS A 79 3.616 5.818 1.892 1.00 0.00 C ATOM 220 CG HIS A 79 4.785 6.484 2.551 1.00 0.00 C ATOM 221 ND1 HIS A 79 5.968 6.750 1.895 1.00 0.00 N ATOM 222 CD2 HIS A 79 4.947 6.940 3.815 1.00 0.00 C ATOM 223 CE1 HIS A 79 6.808 7.339 2.727 1.00 0.00 C ATOM 224 NE2 HIS A 79 6.213 7.467 3.899 1.00 0.00 N ATOM 0 H HIS A 79 4.388 7.489 0.183 1.00 0.00 H new ATOM 0 HA HIS A 79 4.501 4.597 0.363 1.00 0.00 H new ATOM 0 HB2 HIS A 79 2.747 6.471 1.966 1.00 0.00 H new ATOM 0 HB3 HIS A 79 3.375 4.904 2.435 1.00 0.00 H new ATOM 0 HD2 HIS A 79 4.217 6.898 4.610 1.00 0.00 H new ATOM 0 HE1 HIS A 79 7.811 7.661 2.489 1.00 0.00 H new ATOM 0 HE2 HIS A 79 6.626 7.888 4.731 1.00 0.00 H new ATOM 232 N VAL A 80 2.209 3.863 -0.335 1.00 0.00 N ATOM 233 CA VAL A 80 0.970 3.420 -0.962 1.00 0.00 C ATOM 234 C VAL A 80 0.104 2.640 0.021 1.00 0.00 C ATOM 235 O VAL A 80 0.615 1.970 0.919 1.00 0.00 O ATOM 236 CB VAL A 80 1.248 2.539 -2.194 1.00 0.00 C ATOM 237 CG1 VAL A 80 -0.033 1.878 -2.679 1.00 0.00 C ATOM 238 CG2 VAL A 80 1.886 3.362 -3.304 1.00 0.00 C ATOM 0 H VAL A 80 2.789 3.108 0.032 1.00 0.00 H new ATOM 0 HA VAL A 80 0.438 4.317 -1.278 1.00 0.00 H new ATOM 0 HB VAL A 80 1.947 1.754 -1.907 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.184 1.260 -3.550 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.444 1.255 -1.885 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.758 2.645 -2.950 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.076 2.724 -4.167 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.213 4.170 -3.591 1.00 0.00 H new ATOM 0 HG23 VAL A 80 2.827 3.783 -2.950 1.00 0.00 H new ATOM 248 N PHE A 81 -1.210 2.732 -0.154 1.00 0.00 N ATOM 249 CA PHE A 81 -2.148 2.036 0.718 1.00 0.00 C ATOM 250 C PHE A 81 -2.665 0.763 0.055 1.00 0.00 C ATOM 251 O PHE A 81 -2.992 0.757 -1.132 1.00 0.00 O ATOM 252 CB PHE A 81 -3.321 2.951 1.076 1.00 0.00 C ATOM 253 CG PHE A 81 -4.548 2.207 1.521 1.00 0.00 C ATOM 254 CD1 PHE A 81 -4.589 1.594 2.763 1.00 0.00 C ATOM 255 CD2 PHE A 81 -5.659 2.121 0.698 1.00 0.00 C ATOM 256 CE1 PHE A 81 -5.717 0.909 3.176 1.00 0.00 C ATOM 257 CE2 PHE A 81 -6.789 1.438 1.105 1.00 0.00 C ATOM 258 CZ PHE A 81 -6.817 0.830 2.345 1.00 0.00 C ATOM 0 H PHE A 81 -1.649 3.282 -0.892 1.00 0.00 H new ATOM 0 HA PHE A 81 -1.620 1.761 1.631 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -3.011 3.632 1.869 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -3.571 3.563 0.210 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -3.730 1.652 3.416 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -5.642 2.593 -0.273 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -5.738 0.437 4.147 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -7.649 1.380 0.455 1.00 0.00 H new ATOM 0 HZ PHE A 81 -7.698 0.293 2.664 1.00 0.00 H new ATOM 268 N VAL A 82 -2.736 -0.315 0.830 1.00 0.00 N ATOM 269 CA VAL A 82 -3.214 -1.594 0.319 1.00 0.00 C ATOM 270 C VAL A 82 -4.160 -2.263 1.310 1.00 0.00 C ATOM 271 O VAL A 82 -3.739 -2.726 2.370 1.00 0.00 O ATOM 272 CB VAL A 82 -2.044 -2.550 0.017 1.00 0.00 C ATOM 273 CG1 VAL A 82 -2.504 -3.691 -0.878 1.00 0.00 C ATOM 274 CG2 VAL A 82 -0.890 -1.793 -0.622 1.00 0.00 C ATOM 0 H VAL A 82 -2.468 -0.328 1.814 1.00 0.00 H new ATOM 0 HA VAL A 82 -3.751 -1.385 -0.606 1.00 0.00 H new ATOM 0 HB VAL A 82 -1.693 -2.976 0.957 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -1.664 -4.356 -1.081 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -3.296 -4.249 -0.378 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -2.882 -3.287 -1.817 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -0.072 -2.483 -0.829 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.225 -1.338 -1.554 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -0.545 -1.014 0.058 1.00 0.00 H new ATOM 284 N GLY A 83 -5.441 -2.311 0.957 1.00 0.00 N ATOM 285 CA GLY A 83 -6.427 -2.926 1.826 1.00 0.00 C ATOM 286 C GLY A 83 -7.150 -4.078 1.158 1.00 0.00 C ATOM 287 O GLY A 83 -6.885 -4.399 -0.001 1.00 0.00 O ATOM 0 H GLY A 83 -5.813 -1.935 0.085 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.936 -3.285 2.731 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.154 -2.175 2.134 1.00 0.00 H new ATOM 291 N ASP A 84 -8.066 -4.704 1.890 1.00 0.00 N ATOM 292 CA ASP A 84 -8.830 -5.828 1.361 1.00 0.00 C ATOM 293 C ASP A 84 -7.910 -6.994 1.014 1.00 0.00 C ATOM 294 O ASP A 84 -8.061 -7.628 -0.032 1.00 0.00 O ATOM 295 CB ASP A 84 -9.619 -5.399 0.123 1.00 0.00 C ATOM 296 CG ASP A 84 -10.858 -6.244 -0.095 1.00 0.00 C ATOM 297 OD1 ASP A 84 -10.723 -7.372 -0.615 1.00 0.00 O ATOM 298 OD2 ASP A 84 -11.964 -5.778 0.252 1.00 0.00 O ATOM 0 H ASP A 84 -8.297 -4.452 2.851 1.00 0.00 H new ATOM 0 HA ASP A 84 -9.528 -6.156 2.131 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -9.909 -4.353 0.225 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -8.977 -5.467 -0.755 1.00 0.00 H new ATOM 303 N LEU A 85 -6.957 -7.273 1.896 1.00 0.00 N ATOM 304 CA LEU A 85 -6.012 -8.363 1.683 1.00 0.00 C ATOM 305 C LEU A 85 -6.372 -9.572 2.541 1.00 0.00 C ATOM 306 O LEU A 85 -6.687 -9.435 3.723 1.00 0.00 O ATOM 307 CB LEU A 85 -4.589 -7.901 2.004 1.00 0.00 C ATOM 308 CG LEU A 85 -4.182 -6.539 1.439 1.00 0.00 C ATOM 309 CD1 LEU A 85 -2.990 -5.981 2.200 1.00 0.00 C ATOM 310 CD2 LEU A 85 -3.865 -6.651 -0.045 1.00 0.00 C ATOM 0 H LEU A 85 -6.818 -6.759 2.766 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.064 -8.656 0.635 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.474 -7.872 3.087 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.892 -8.650 1.629 1.00 0.00 H new ATOM 0 HG LEU A 85 -5.019 -5.851 1.560 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.714 -5.012 1.784 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.252 -5.864 3.251 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -2.148 -6.667 2.110 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -3.577 -5.673 -0.430 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -3.044 -7.354 -0.190 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.746 -7.007 -0.579 1.00 0.00 H new ATOM 322 N SER A 86 -6.320 -10.755 1.938 1.00 0.00 N ATOM 323 CA SER A 86 -6.642 -11.988 2.646 1.00 0.00 C ATOM 324 C SER A 86 -5.827 -12.107 3.930 1.00 0.00 C ATOM 325 O SER A 86 -4.735 -11.552 4.056 1.00 0.00 O ATOM 326 CB SER A 86 -6.381 -13.200 1.749 1.00 0.00 C ATOM 327 OG SER A 86 -6.001 -14.329 2.515 1.00 0.00 O ATOM 0 H SER A 86 -6.058 -10.886 0.961 1.00 0.00 H new ATOM 0 HA SER A 86 -7.699 -11.960 2.909 1.00 0.00 H new ATOM 0 HB2 SER A 86 -7.278 -13.431 1.175 1.00 0.00 H new ATOM 0 HB3 SER A 86 -5.596 -12.963 1.031 1.00 0.00 H new ATOM 0 HG SER A 86 -6.295 -15.146 2.061 1.00 0.00 H new ATOM 333 N PRO A 87 -6.369 -12.847 4.908 1.00 0.00 N ATOM 334 CA PRO A 87 -5.709 -13.057 6.200 1.00 0.00 C ATOM 335 C PRO A 87 -4.472 -13.941 6.083 1.00 0.00 C ATOM 336 O PRO A 87 -3.636 -13.976 6.985 1.00 0.00 O ATOM 337 CB PRO A 87 -6.785 -13.752 7.039 1.00 0.00 C ATOM 338 CG PRO A 87 -7.667 -14.422 6.043 1.00 0.00 C ATOM 339 CD PRO A 87 -7.667 -13.537 4.828 1.00 0.00 C ATOM 0 HA PRO A 87 -5.350 -12.122 6.631 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -6.345 -14.474 7.728 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -7.342 -13.035 7.642 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -7.296 -15.418 5.800 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -8.676 -14.545 6.436 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -7.758 -14.116 3.909 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.498 -12.832 4.844 1.00 0.00 H new ATOM 347 N GLU A 88 -4.363 -14.652 4.966 1.00 0.00 N ATOM 348 CA GLU A 88 -3.227 -15.536 4.732 1.00 0.00 C ATOM 349 C GLU A 88 -2.087 -14.788 4.046 1.00 0.00 C ATOM 350 O GLU A 88 -0.992 -15.324 3.877 1.00 0.00 O ATOM 351 CB GLU A 88 -3.651 -16.734 3.880 1.00 0.00 C ATOM 352 CG GLU A 88 -3.567 -16.477 2.384 1.00 0.00 C ATOM 353 CD GLU A 88 -3.983 -17.681 1.561 1.00 0.00 C ATOM 354 OE1 GLU A 88 -4.600 -18.604 2.133 1.00 0.00 O ATOM 355 OE2 GLU A 88 -3.692 -17.700 0.347 1.00 0.00 O ATOM 0 H GLU A 88 -5.047 -14.634 4.209 1.00 0.00 H new ATOM 0 HA GLU A 88 -2.874 -15.894 5.699 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.021 -17.588 4.129 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.675 -17.007 4.136 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.203 -15.630 2.128 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -2.546 -16.199 2.124 1.00 0.00 H new ATOM 362 N ILE A 89 -2.354 -13.547 3.653 1.00 0.00 N ATOM 363 CA ILE A 89 -1.352 -12.725 2.986 1.00 0.00 C ATOM 364 C ILE A 89 -0.319 -12.204 3.979 1.00 0.00 C ATOM 365 O ILE A 89 -0.660 -11.791 5.088 1.00 0.00 O ATOM 366 CB ILE A 89 -1.997 -11.530 2.259 1.00 0.00 C ATOM 367 CG1 ILE A 89 -2.900 -12.022 1.126 1.00 0.00 C ATOM 368 CG2 ILE A 89 -0.924 -10.596 1.721 1.00 0.00 C ATOM 369 CD1 ILE A 89 -2.160 -12.794 0.056 1.00 0.00 C ATOM 0 H ILE A 89 -3.256 -13.089 3.785 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.858 -13.363 2.253 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.609 -10.977 2.972 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -3.682 -12.655 1.545 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -3.395 -11.165 0.668 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.395 -9.757 1.210 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.318 -10.224 2.547 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -0.289 -11.137 1.020 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -2.862 -13.112 -0.715 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.396 -12.157 -0.390 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.688 -13.670 0.500 1.00 0.00 H new ATOM 381 N THR A 90 0.947 -12.224 3.574 1.00 0.00 N ATOM 382 CA THR A 90 2.031 -11.753 4.427 1.00 0.00 C ATOM 383 C THR A 90 2.766 -10.582 3.786 1.00 0.00 C ATOM 384 O THR A 90 2.575 -10.286 2.606 1.00 0.00 O ATOM 385 CB THR A 90 3.040 -12.878 4.725 1.00 0.00 C ATOM 386 OG1 THR A 90 3.902 -12.490 5.801 1.00 0.00 O ATOM 387 CG2 THR A 90 3.872 -13.199 3.492 1.00 0.00 C ATOM 0 H THR A 90 1.247 -12.562 2.659 1.00 0.00 H new ATOM 0 HA THR A 90 1.578 -11.425 5.362 1.00 0.00 H new ATOM 0 HB THR A 90 2.483 -13.770 5.010 1.00 0.00 H new ATOM 0 HG1 THR A 90 4.540 -13.211 5.986 1.00 0.00 H new ATOM 0 HG21 THR A 90 4.577 -13.996 3.726 1.00 0.00 H new ATOM 0 HG22 THR A 90 3.215 -13.521 2.684 1.00 0.00 H new ATOM 0 HG23 THR A 90 4.420 -12.310 3.181 1.00 0.00 H new ATOM 395 N THR A 91 3.609 -9.918 4.570 1.00 0.00 N ATOM 396 CA THR A 91 4.374 -8.778 4.079 1.00 0.00 C ATOM 397 C THR A 91 5.009 -9.084 2.728 1.00 0.00 C ATOM 398 O THR A 91 4.976 -8.259 1.816 1.00 0.00 O ATOM 399 CB THR A 91 5.478 -8.372 5.073 1.00 0.00 C ATOM 400 OG1 THR A 91 4.901 -7.708 6.203 1.00 0.00 O ATOM 401 CG2 THR A 91 6.496 -7.459 4.407 1.00 0.00 C ATOM 0 H THR A 91 3.780 -10.150 5.548 1.00 0.00 H new ATOM 0 HA THR A 91 3.673 -7.950 3.969 1.00 0.00 H new ATOM 0 HB THR A 91 5.987 -9.277 5.406 1.00 0.00 H new ATOM 0 HG1 THR A 91 5.610 -7.455 6.831 1.00 0.00 H new ATOM 0 HG21 THR A 91 7.266 -7.185 5.128 1.00 0.00 H new ATOM 0 HG22 THR A 91 6.955 -7.978 3.566 1.00 0.00 H new ATOM 0 HG23 THR A 91 5.998 -6.558 4.049 1.00 0.00 H new ATOM 409 N GLU A 92 5.587 -10.275 2.607 1.00 0.00 N ATOM 410 CA GLU A 92 6.230 -10.689 1.365 1.00 0.00 C ATOM 411 C GLU A 92 5.242 -10.655 0.203 1.00 0.00 C ATOM 412 O GLU A 92 5.516 -10.065 -0.843 1.00 0.00 O ATOM 413 CB GLU A 92 6.814 -12.095 1.511 1.00 0.00 C ATOM 414 CG GLU A 92 7.799 -12.229 2.660 1.00 0.00 C ATOM 415 CD GLU A 92 8.609 -13.509 2.588 1.00 0.00 C ATOM 416 OE1 GLU A 92 9.520 -13.587 1.737 1.00 0.00 O ATOM 417 OE2 GLU A 92 8.333 -14.432 3.383 1.00 0.00 O ATOM 0 H GLU A 92 5.623 -10.970 3.353 1.00 0.00 H new ATOM 0 HA GLU A 92 7.038 -9.988 1.153 1.00 0.00 H new ATOM 0 HB2 GLU A 92 5.999 -12.804 1.657 1.00 0.00 H new ATOM 0 HB3 GLU A 92 7.313 -12.370 0.582 1.00 0.00 H new ATOM 0 HG2 GLU A 92 8.476 -11.375 2.655 1.00 0.00 H new ATOM 0 HG3 GLU A 92 7.256 -12.200 3.605 1.00 0.00 H new ATOM 424 N ASP A 93 4.092 -11.292 0.393 1.00 0.00 N ATOM 425 CA ASP A 93 3.062 -11.335 -0.638 1.00 0.00 C ATOM 426 C ASP A 93 2.874 -9.962 -1.277 1.00 0.00 C ATOM 427 O ASP A 93 2.984 -9.813 -2.494 1.00 0.00 O ATOM 428 CB ASP A 93 1.738 -11.822 -0.047 1.00 0.00 C ATOM 429 CG ASP A 93 1.587 -13.328 -0.126 1.00 0.00 C ATOM 430 OD1 ASP A 93 1.862 -13.896 -1.204 1.00 0.00 O ATOM 431 OD2 ASP A 93 1.194 -13.940 0.889 1.00 0.00 O ATOM 0 H ASP A 93 3.850 -11.786 1.252 1.00 0.00 H new ATOM 0 HA ASP A 93 3.385 -12.034 -1.410 1.00 0.00 H new ATOM 0 HB2 ASP A 93 1.671 -11.507 0.994 1.00 0.00 H new ATOM 0 HB3 ASP A 93 0.911 -11.349 -0.577 1.00 0.00 H new ATOM 436 N ILE A 94 2.589 -8.964 -0.447 1.00 0.00 N ATOM 437 CA ILE A 94 2.386 -7.604 -0.931 1.00 0.00 C ATOM 438 C ILE A 94 3.519 -7.175 -1.857 1.00 0.00 C ATOM 439 O ILE A 94 3.291 -6.829 -3.017 1.00 0.00 O ATOM 440 CB ILE A 94 2.284 -6.602 0.234 1.00 0.00 C ATOM 441 CG1 ILE A 94 1.145 -6.997 1.177 1.00 0.00 C ATOM 442 CG2 ILE A 94 2.074 -5.192 -0.297 1.00 0.00 C ATOM 443 CD1 ILE A 94 0.736 -5.892 2.126 1.00 0.00 C ATOM 0 H ILE A 94 2.494 -9.072 0.563 1.00 0.00 H new ATOM 0 HA ILE A 94 1.447 -7.603 -1.485 1.00 0.00 H new ATOM 0 HB ILE A 94 3.219 -6.623 0.795 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.280 -7.295 0.584 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.449 -7.869 1.756 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.004 -4.495 0.538 1.00 0.00 H new ATOM 0 HG22 ILE A 94 2.915 -4.913 -0.932 1.00 0.00 H new ATOM 0 HG23 ILE A 94 1.153 -5.156 -0.878 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -0.075 -6.242 2.764 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.588 -5.610 2.744 1.00 0.00 H new ATOM 0 HD13 ILE A 94 0.400 -5.027 1.554 1.00 0.00 H new ATOM 455 N LYS A 95 4.742 -7.203 -1.339 1.00 0.00 N ATOM 456 CA LYS A 95 5.913 -6.820 -2.120 1.00 0.00 C ATOM 457 C LYS A 95 5.916 -7.521 -3.475 1.00 0.00 C ATOM 458 O LYS A 95 6.233 -6.914 -4.497 1.00 0.00 O ATOM 459 CB LYS A 95 7.194 -7.159 -1.355 1.00 0.00 C ATOM 460 CG LYS A 95 7.693 -6.028 -0.472 1.00 0.00 C ATOM 461 CD LYS A 95 8.813 -6.490 0.445 1.00 0.00 C ATOM 462 CE LYS A 95 8.272 -7.006 1.769 1.00 0.00 C ATOM 463 NZ LYS A 95 9.335 -7.654 2.588 1.00 0.00 N ATOM 0 H LYS A 95 4.949 -7.487 -0.381 1.00 0.00 H new ATOM 0 HA LYS A 95 5.871 -5.744 -2.288 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.016 -8.039 -0.737 1.00 0.00 H new ATOM 0 HB3 LYS A 95 7.974 -7.423 -2.069 1.00 0.00 H new ATOM 0 HG2 LYS A 95 8.047 -5.207 -1.096 1.00 0.00 H new ATOM 0 HG3 LYS A 95 6.868 -5.641 0.126 1.00 0.00 H new ATOM 0 HD2 LYS A 95 9.386 -7.276 -0.046 1.00 0.00 H new ATOM 0 HD3 LYS A 95 9.499 -5.663 0.629 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.835 -6.180 2.329 1.00 0.00 H new ATOM 0 HE3 LYS A 95 7.472 -7.722 1.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 9.090 -7.580 3.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 9.414 -8.657 2.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 10.244 -7.178 2.417 1.00 0.00 H new ATOM 477 N ALA A 96 5.560 -8.801 -3.474 1.00 0.00 N ATOM 478 CA ALA A 96 5.519 -9.583 -4.704 1.00 0.00 C ATOM 479 C ALA A 96 4.543 -8.978 -5.707 1.00 0.00 C ATOM 480 O ALA A 96 4.745 -9.070 -6.917 1.00 0.00 O ATOM 481 CB ALA A 96 5.141 -11.025 -4.400 1.00 0.00 C ATOM 0 H ALA A 96 5.296 -9.319 -2.636 1.00 0.00 H new ATOM 0 HA ALA A 96 6.514 -9.566 -5.150 1.00 0.00 H new ATOM 0 HB1 ALA A 96 5.114 -11.597 -5.327 1.00 0.00 H new ATOM 0 HB2 ALA A 96 5.879 -11.460 -3.726 1.00 0.00 H new ATOM 0 HB3 ALA A 96 4.159 -11.052 -3.928 1.00 0.00 H new ATOM 487 N ALA A 97 3.483 -8.360 -5.195 1.00 0.00 N ATOM 488 CA ALA A 97 2.476 -7.739 -6.046 1.00 0.00 C ATOM 489 C ALA A 97 3.009 -6.460 -6.684 1.00 0.00 C ATOM 490 O ALA A 97 3.020 -6.323 -7.907 1.00 0.00 O ATOM 491 CB ALA A 97 1.216 -7.446 -5.245 1.00 0.00 C ATOM 0 H ALA A 97 3.300 -8.276 -4.195 1.00 0.00 H new ATOM 0 HA ALA A 97 2.231 -8.438 -6.846 1.00 0.00 H new ATOM 0 HB1 ALA A 97 0.472 -6.982 -5.893 1.00 0.00 H new ATOM 0 HB2 ALA A 97 0.816 -8.377 -4.842 1.00 0.00 H new ATOM 0 HB3 ALA A 97 1.455 -6.769 -4.425 1.00 0.00 H new ATOM 497 N PHE A 98 3.449 -5.527 -5.847 1.00 0.00 N ATOM 498 CA PHE A 98 3.982 -4.258 -6.330 1.00 0.00 C ATOM 499 C PHE A 98 5.454 -4.395 -6.708 1.00 0.00 C ATOM 500 O PHE A 98 6.144 -3.400 -6.928 1.00 0.00 O ATOM 501 CB PHE A 98 3.816 -3.172 -5.264 1.00 0.00 C ATOM 502 CG PHE A 98 2.400 -3.007 -4.792 1.00 0.00 C ATOM 503 CD1 PHE A 98 1.839 -3.916 -3.909 1.00 0.00 C ATOM 504 CD2 PHE A 98 1.629 -1.943 -5.231 1.00 0.00 C ATOM 505 CE1 PHE A 98 0.536 -3.766 -3.473 1.00 0.00 C ATOM 506 CE2 PHE A 98 0.326 -1.788 -4.798 1.00 0.00 C ATOM 507 CZ PHE A 98 -0.222 -2.701 -3.919 1.00 0.00 C ATOM 0 H PHE A 98 3.447 -5.625 -4.832 1.00 0.00 H new ATOM 0 HA PHE A 98 3.422 -3.972 -7.220 1.00 0.00 H new ATOM 0 HB2 PHE A 98 4.449 -3.412 -4.410 1.00 0.00 H new ATOM 0 HB3 PHE A 98 4.170 -2.222 -5.666 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.427 -4.751 -3.558 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.051 -1.226 -5.920 1.00 0.00 H new ATOM 0 HE1 PHE A 98 0.111 -4.481 -2.784 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -0.264 -0.953 -5.147 1.00 0.00 H new ATOM 0 HZ PHE A 98 -1.241 -2.583 -3.581 1.00 0.00 H new ATOM 517 N ALA A 99 5.927 -5.634 -6.780 1.00 0.00 N ATOM 518 CA ALA A 99 7.316 -5.902 -7.133 1.00 0.00 C ATOM 519 C ALA A 99 7.598 -5.520 -8.582 1.00 0.00 C ATOM 520 O ALA A 99 8.445 -4.675 -8.873 1.00 0.00 O ATOM 521 CB ALA A 99 7.646 -7.369 -6.898 1.00 0.00 C ATOM 0 H ALA A 99 5.369 -6.468 -6.599 1.00 0.00 H new ATOM 0 HA ALA A 99 7.952 -5.290 -6.493 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.686 -7.555 -7.166 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.493 -7.613 -5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.996 -7.991 -7.513 1.00 0.00 H new ATOM 527 N PRO A 100 6.873 -6.155 -9.514 1.00 0.00 N ATOM 528 CA PRO A 100 7.028 -5.898 -10.949 1.00 0.00 C ATOM 529 C PRO A 100 6.515 -4.519 -11.349 1.00 0.00 C ATOM 530 O PRO A 100 6.582 -4.135 -12.517 1.00 0.00 O ATOM 531 CB PRO A 100 6.181 -6.994 -11.600 1.00 0.00 C ATOM 532 CG PRO A 100 5.165 -7.350 -10.570 1.00 0.00 C ATOM 533 CD PRO A 100 5.846 -7.174 -9.240 1.00 0.00 C ATOM 0 HA PRO A 100 8.074 -5.912 -11.255 1.00 0.00 H new ATOM 0 HB2 PRO A 100 5.709 -6.638 -12.515 1.00 0.00 H new ATOM 0 HB3 PRO A 100 6.790 -7.857 -11.870 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.288 -6.707 -10.648 1.00 0.00 H new ATOM 0 HG3 PRO A 100 4.820 -8.376 -10.700 1.00 0.00 H new ATOM 0 HD2 PRO A 100 5.147 -6.844 -8.472 1.00 0.00 H new ATOM 0 HD3 PRO A 100 6.289 -8.106 -8.889 1.00 0.00 H new ATOM 541 N PHE A 101 6.001 -3.778 -10.373 1.00 0.00 N ATOM 542 CA PHE A 101 5.476 -2.441 -10.624 1.00 0.00 C ATOM 543 C PHE A 101 6.492 -1.374 -10.230 1.00 0.00 C ATOM 544 O PHE A 101 6.349 -0.204 -10.583 1.00 0.00 O ATOM 545 CB PHE A 101 4.172 -2.229 -9.852 1.00 0.00 C ATOM 546 CG PHE A 101 3.011 -2.999 -10.414 1.00 0.00 C ATOM 547 CD1 PHE A 101 2.830 -4.335 -10.097 1.00 0.00 C ATOM 548 CD2 PHE A 101 2.100 -2.385 -11.259 1.00 0.00 C ATOM 549 CE1 PHE A 101 1.762 -5.046 -10.613 1.00 0.00 C ATOM 550 CE2 PHE A 101 1.031 -3.091 -11.779 1.00 0.00 C ATOM 551 CZ PHE A 101 0.861 -4.422 -11.454 1.00 0.00 C ATOM 0 H PHE A 101 5.937 -4.081 -9.401 1.00 0.00 H new ATOM 0 HA PHE A 101 5.277 -2.351 -11.692 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.323 -2.521 -8.813 1.00 0.00 H new ATOM 0 HB3 PHE A 101 3.928 -1.167 -9.852 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.531 -4.827 -9.439 1.00 0.00 H new ATOM 0 HD2 PHE A 101 2.227 -1.343 -11.514 1.00 0.00 H new ATOM 0 HE1 PHE A 101 1.632 -6.088 -10.359 1.00 0.00 H new ATOM 0 HE2 PHE A 101 0.330 -2.602 -12.439 1.00 0.00 H new ATOM 0 HZ PHE A 101 0.025 -4.975 -11.857 1.00 0.00 H new ATOM 561 N GLY A 102 7.520 -1.787 -9.495 1.00 0.00 N ATOM 562 CA GLY A 102 8.546 -0.855 -9.063 1.00 0.00 C ATOM 563 C GLY A 102 9.282 -1.334 -7.828 1.00 0.00 C ATOM 564 O GLY A 102 8.747 -2.118 -7.044 1.00 0.00 O ATOM 0 H GLY A 102 7.661 -2.750 -9.191 1.00 0.00 H new ATOM 0 HA2 GLY A 102 9.260 -0.705 -9.873 1.00 0.00 H new ATOM 0 HA3 GLY A 102 8.090 0.113 -8.857 1.00 0.00 H new ATOM 568 N ARG A 103 10.512 -0.862 -7.654 1.00 0.00 N ATOM 569 CA ARG A 103 11.323 -1.250 -6.506 1.00 0.00 C ATOM 570 C ARG A 103 10.679 -0.786 -5.203 1.00 0.00 C ATOM 571 O ARG A 103 10.416 0.403 -5.018 1.00 0.00 O ATOM 572 CB ARG A 103 12.731 -0.663 -6.628 1.00 0.00 C ATOM 573 CG ARG A 103 13.711 -1.577 -7.345 1.00 0.00 C ATOM 574 CD ARG A 103 15.011 -0.856 -7.667 1.00 0.00 C ATOM 575 NE ARG A 103 16.086 -1.788 -8.000 1.00 0.00 N ATOM 576 CZ ARG A 103 16.802 -2.438 -7.090 1.00 0.00 C ATOM 577 NH1 ARG A 103 16.559 -2.259 -5.798 1.00 0.00 N ATOM 578 NH2 ARG A 103 17.764 -3.269 -7.471 1.00 0.00 N ATOM 0 H ARG A 103 10.969 -0.211 -8.293 1.00 0.00 H new ATOM 0 HA ARG A 103 11.389 -2.338 -6.491 1.00 0.00 H new ATOM 0 HB2 ARG A 103 12.675 0.286 -7.161 1.00 0.00 H new ATOM 0 HB3 ARG A 103 13.113 -0.446 -5.630 1.00 0.00 H new ATOM 0 HG2 ARG A 103 13.921 -2.447 -6.723 1.00 0.00 H new ATOM 0 HG3 ARG A 103 13.260 -1.945 -8.266 1.00 0.00 H new ATOM 0 HD2 ARG A 103 14.850 -0.175 -8.502 1.00 0.00 H new ATOM 0 HD3 ARG A 103 15.310 -0.248 -6.813 1.00 0.00 H new ATOM 0 HE ARG A 103 16.298 -1.948 -8.985 1.00 0.00 H new ATOM 0 HH11 ARG A 103 15.821 -1.621 -5.502 1.00 0.00 H new ATOM 0 HH12 ARG A 103 17.111 -2.760 -5.101 1.00 0.00 H new ATOM 0 HH21 ARG A 103 17.954 -3.409 -8.463 1.00 0.00 H new ATOM 0 HH22 ARG A 103 18.314 -3.768 -6.771 1.00 0.00 H new ATOM 592 N ILE A 104 10.427 -1.731 -4.304 1.00 0.00 N ATOM 593 CA ILE A 104 9.814 -1.419 -3.019 1.00 0.00 C ATOM 594 C ILE A 104 10.860 -1.359 -1.911 1.00 0.00 C ATOM 595 O ILE A 104 11.810 -2.142 -1.897 1.00 0.00 O ATOM 596 CB ILE A 104 8.740 -2.457 -2.641 1.00 0.00 C ATOM 597 CG1 ILE A 104 7.845 -2.759 -3.844 1.00 0.00 C ATOM 598 CG2 ILE A 104 7.910 -1.957 -1.468 1.00 0.00 C ATOM 599 CD1 ILE A 104 7.038 -4.029 -3.693 1.00 0.00 C ATOM 0 H ILE A 104 10.638 -2.719 -4.442 1.00 0.00 H new ATOM 0 HA ILE A 104 9.342 -0.442 -3.123 1.00 0.00 H new ATOM 0 HB ILE A 104 9.237 -3.380 -2.342 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.164 -1.922 -3.999 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.465 -2.836 -4.737 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.156 -2.701 -1.213 1.00 0.00 H new ATOM 0 HG22 ILE A 104 8.559 -1.789 -0.609 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.420 -1.022 -1.741 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.427 -4.180 -4.583 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.713 -4.876 -3.568 1.00 0.00 H new ATOM 0 HD13 ILE A 104 6.392 -3.948 -2.819 1.00 0.00 H new ATOM 611 N SER A 105 10.677 -0.426 -0.983 1.00 0.00 N ATOM 612 CA SER A 105 11.607 -0.261 0.129 1.00 0.00 C ATOM 613 C SER A 105 10.927 -0.581 1.457 1.00 0.00 C ATOM 614 O SER A 105 11.331 -1.501 2.168 1.00 0.00 O ATOM 615 CB SER A 105 12.157 1.166 0.155 1.00 0.00 C ATOM 616 OG SER A 105 12.996 1.369 1.278 1.00 0.00 O ATOM 0 H SER A 105 9.894 0.227 -0.978 1.00 0.00 H new ATOM 0 HA SER A 105 12.433 -0.958 -0.014 1.00 0.00 H new ATOM 0 HB2 SER A 105 12.716 1.360 -0.760 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.331 1.877 0.181 1.00 0.00 H new ATOM 0 HG SER A 105 13.336 2.288 1.270 1.00 0.00 H new ATOM 622 N ASP A 106 9.892 0.186 1.784 1.00 0.00 N ATOM 623 CA ASP A 106 9.154 -0.015 3.026 1.00 0.00 C ATOM 624 C ASP A 106 7.853 -0.768 2.768 1.00 0.00 C ATOM 625 O ASP A 106 6.866 -0.186 2.318 1.00 0.00 O ATOM 626 CB ASP A 106 8.857 1.330 3.690 1.00 0.00 C ATOM 627 CG ASP A 106 8.102 1.176 4.996 1.00 0.00 C ATOM 628 OD1 ASP A 106 8.699 0.675 5.972 1.00 0.00 O ATOM 629 OD2 ASP A 106 6.914 1.557 5.042 1.00 0.00 O ATOM 0 H ASP A 106 9.545 0.952 1.207 1.00 0.00 H new ATOM 0 HA ASP A 106 9.772 -0.613 3.696 1.00 0.00 H new ATOM 0 HB2 ASP A 106 9.794 1.855 3.875 1.00 0.00 H new ATOM 0 HB3 ASP A 106 8.274 1.948 3.007 1.00 0.00 H new ATOM 634 N ALA A 107 7.859 -2.065 3.057 1.00 0.00 N ATOM 635 CA ALA A 107 6.679 -2.898 2.858 1.00 0.00 C ATOM 636 C ALA A 107 6.369 -3.718 4.105 1.00 0.00 C ATOM 637 O ALA A 107 7.218 -4.462 4.597 1.00 0.00 O ATOM 638 CB ALA A 107 6.874 -3.812 1.657 1.00 0.00 C ATOM 0 H ALA A 107 8.668 -2.562 3.430 1.00 0.00 H new ATOM 0 HA ALA A 107 5.830 -2.242 2.667 1.00 0.00 H new ATOM 0 HB1 ALA A 107 5.985 -4.428 1.521 1.00 0.00 H new ATOM 0 HB2 ALA A 107 7.038 -3.209 0.764 1.00 0.00 H new ATOM 0 HB3 ALA A 107 7.738 -4.454 1.825 1.00 0.00 H new ATOM 644 N ARG A 108 5.149 -3.577 4.613 1.00 0.00 N ATOM 645 CA ARG A 108 4.728 -4.304 5.805 1.00 0.00 C ATOM 646 C ARG A 108 3.206 -4.348 5.906 1.00 0.00 C ATOM 647 O ARG A 108 2.513 -3.473 5.386 1.00 0.00 O ATOM 648 CB ARG A 108 5.315 -3.653 7.059 1.00 0.00 C ATOM 649 CG ARG A 108 4.597 -2.380 7.477 1.00 0.00 C ATOM 650 CD ARG A 108 4.924 -2.003 8.913 1.00 0.00 C ATOM 651 NE ARG A 108 6.280 -1.475 9.045 1.00 0.00 N ATOM 652 CZ ARG A 108 6.857 -1.218 10.213 1.00 0.00 C ATOM 653 NH1 ARG A 108 6.201 -1.438 11.344 1.00 0.00 N ATOM 654 NH2 ARG A 108 8.094 -0.739 10.252 1.00 0.00 N ATOM 0 H ARG A 108 4.434 -2.966 4.218 1.00 0.00 H new ATOM 0 HA ARG A 108 5.099 -5.326 5.727 1.00 0.00 H new ATOM 0 HB2 ARG A 108 5.277 -4.368 7.881 1.00 0.00 H new ATOM 0 HB3 ARG A 108 6.366 -3.426 6.882 1.00 0.00 H new ATOM 0 HG2 ARG A 108 4.882 -1.565 6.812 1.00 0.00 H new ATOM 0 HG3 ARG A 108 3.521 -2.516 7.371 1.00 0.00 H new ATOM 0 HD2 ARG A 108 4.209 -1.259 9.264 1.00 0.00 H new ATOM 0 HD3 ARG A 108 4.812 -2.879 9.552 1.00 0.00 H new ATOM 0 HE ARG A 108 6.812 -1.294 8.194 1.00 0.00 H new ATOM 0 HH11 ARG A 108 5.250 -1.806 11.319 1.00 0.00 H new ATOM 0 HH12 ARG A 108 6.647 -1.239 12.239 1.00 0.00 H new ATOM 0 HH21 ARG A 108 8.602 -0.568 9.384 1.00 0.00 H new ATOM 0 HH22 ARG A 108 8.536 -0.542 11.150 1.00 0.00 H new ATOM 668 N VAL A 109 2.692 -5.373 6.578 1.00 0.00 N ATOM 669 CA VAL A 109 1.253 -5.531 6.748 1.00 0.00 C ATOM 670 C VAL A 109 0.814 -5.104 8.144 1.00 0.00 C ATOM 671 O VAL A 109 1.341 -5.587 9.147 1.00 0.00 O ATOM 672 CB VAL A 109 0.816 -6.989 6.508 1.00 0.00 C ATOM 673 CG1 VAL A 109 -0.657 -7.167 6.844 1.00 0.00 C ATOM 674 CG2 VAL A 109 1.096 -7.398 5.070 1.00 0.00 C ATOM 0 H VAL A 109 3.251 -6.107 7.014 1.00 0.00 H new ATOM 0 HA VAL A 109 0.775 -4.889 6.008 1.00 0.00 H new ATOM 0 HB VAL A 109 1.395 -7.637 7.166 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.948 -8.203 6.668 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.824 -6.916 7.891 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.256 -6.510 6.213 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.781 -8.430 4.918 1.00 0.00 H new ATOM 0 HG22 VAL A 109 0.544 -6.747 4.392 1.00 0.00 H new ATOM 0 HG23 VAL A 109 2.164 -7.310 4.868 1.00 0.00 H new ATOM 684 N VAL A 110 -0.154 -4.196 8.203 1.00 0.00 N ATOM 685 CA VAL A 110 -0.666 -3.704 9.476 1.00 0.00 C ATOM 686 C VAL A 110 -1.148 -4.853 10.355 1.00 0.00 C ATOM 687 O VAL A 110 -1.764 -5.803 9.871 1.00 0.00 O ATOM 688 CB VAL A 110 -1.823 -2.709 9.270 1.00 0.00 C ATOM 689 CG1 VAL A 110 -2.311 -2.172 10.607 1.00 0.00 C ATOM 690 CG2 VAL A 110 -1.391 -1.572 8.355 1.00 0.00 C ATOM 0 H VAL A 110 -0.600 -3.786 7.383 1.00 0.00 H new ATOM 0 HA VAL A 110 0.159 -3.192 9.972 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.650 -3.235 8.793 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.129 -1.471 10.441 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.662 -2.999 11.225 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.493 -1.662 11.115 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.221 -0.878 8.220 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.547 -1.046 8.802 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.095 -1.976 7.387 1.00 0.00 H new ATOM 700 N LYS A 111 -0.865 -4.759 11.650 1.00 0.00 N ATOM 701 CA LYS A 111 -1.271 -5.789 12.599 1.00 0.00 C ATOM 702 C LYS A 111 -1.780 -5.165 13.894 1.00 0.00 C ATOM 703 O LYS A 111 -1.333 -4.090 14.294 1.00 0.00 O ATOM 704 CB LYS A 111 -0.099 -6.726 12.898 1.00 0.00 C ATOM 705 CG LYS A 111 0.101 -7.804 11.846 1.00 0.00 C ATOM 706 CD LYS A 111 1.443 -8.499 12.009 1.00 0.00 C ATOM 707 CE LYS A 111 1.885 -9.167 10.716 1.00 0.00 C ATOM 708 NZ LYS A 111 2.999 -10.129 10.941 1.00 0.00 N ATOM 0 H LYS A 111 -0.356 -3.979 12.066 1.00 0.00 H new ATOM 0 HA LYS A 111 -2.082 -6.363 12.150 1.00 0.00 H new ATOM 0 HB2 LYS A 111 0.814 -6.137 12.981 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -0.261 -7.200 13.866 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -0.701 -8.538 11.919 1.00 0.00 H new ATOM 0 HG3 LYS A 111 0.038 -7.360 10.852 1.00 0.00 H new ATOM 0 HD2 LYS A 111 2.194 -7.773 12.320 1.00 0.00 H new ATOM 0 HD3 LYS A 111 1.374 -9.245 12.800 1.00 0.00 H new ATOM 0 HE2 LYS A 111 1.039 -9.689 10.269 1.00 0.00 H new ATOM 0 HE3 LYS A 111 2.201 -8.405 10.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 3.271 -10.563 10.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 3.816 -9.626 11.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 2.689 -10.871 11.601 1.00 0.00 H new ATOM 722 N ASP A 112 -2.716 -5.846 14.546 1.00 0.00 N ATOM 723 CA ASP A 112 -3.284 -5.360 15.798 1.00 0.00 C ATOM 724 C ASP A 112 -2.215 -5.276 16.883 1.00 0.00 C ATOM 725 O ASP A 112 -1.572 -6.271 17.212 1.00 0.00 O ATOM 726 CB ASP A 112 -4.422 -6.274 16.255 1.00 0.00 C ATOM 727 CG ASP A 112 -5.250 -5.656 17.365 1.00 0.00 C ATOM 728 OD1 ASP A 112 -4.857 -4.584 17.873 1.00 0.00 O ATOM 729 OD2 ASP A 112 -6.290 -6.244 17.726 1.00 0.00 O ATOM 0 H ASP A 112 -3.098 -6.737 14.228 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.680 -4.359 15.625 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.067 -6.498 15.406 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.007 -7.221 16.599 1.00 0.00 H new ATOM 734 N MET A 113 -2.031 -4.080 17.433 1.00 0.00 N ATOM 735 CA MET A 113 -1.040 -3.866 18.481 1.00 0.00 C ATOM 736 C MET A 113 -1.483 -4.513 19.789 1.00 0.00 C ATOM 737 O MET A 113 -0.768 -4.466 20.790 1.00 0.00 O ATOM 738 CB MET A 113 -0.805 -2.369 18.693 1.00 0.00 C ATOM 739 CG MET A 113 -1.941 -1.673 19.424 1.00 0.00 C ATOM 740 SD MET A 113 -1.955 0.109 19.150 1.00 0.00 S ATOM 741 CE MET A 113 -2.500 0.186 17.446 1.00 0.00 C ATOM 0 H MET A 113 -2.555 -3.245 17.171 1.00 0.00 H new ATOM 0 HA MET A 113 -0.107 -4.332 18.164 1.00 0.00 H new ATOM 0 HB2 MET A 113 0.118 -2.231 19.257 1.00 0.00 H new ATOM 0 HB3 MET A 113 -0.661 -1.891 17.724 1.00 0.00 H new ATOM 0 HG2 MET A 113 -2.891 -2.095 19.096 1.00 0.00 H new ATOM 0 HG3 MET A 113 -1.856 -1.872 20.492 1.00 0.00 H new ATOM 0 HE1 MET A 113 -2.912 1.174 17.240 1.00 0.00 H new ATOM 0 HE2 MET A 113 -1.654 0.001 16.785 1.00 0.00 H new ATOM 0 HE3 MET A 113 -3.266 -0.570 17.275 1.00 0.00 H new ATOM 751 N ALA A 114 -2.667 -5.117 19.774 1.00 0.00 N ATOM 752 CA ALA A 114 -3.205 -5.775 20.959 1.00 0.00 C ATOM 753 C ALA A 114 -2.971 -7.281 20.904 1.00 0.00 C ATOM 754 O ALA A 114 -2.402 -7.865 21.827 1.00 0.00 O ATOM 755 CB ALA A 114 -4.689 -5.474 21.101 1.00 0.00 C ATOM 0 H ALA A 114 -3.272 -5.164 18.954 1.00 0.00 H new ATOM 0 HA ALA A 114 -2.681 -5.384 21.831 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -5.078 -5.971 21.990 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -4.835 -4.398 21.195 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -5.220 -5.837 20.221 1.00 0.00 H new ATOM 761 N THR A 115 -3.414 -7.905 19.817 1.00 0.00 N ATOM 762 CA THR A 115 -3.254 -9.343 19.643 1.00 0.00 C ATOM 763 C THR A 115 -2.067 -9.660 18.741 1.00 0.00 C ATOM 764 O THR A 115 -1.484 -10.740 18.823 1.00 0.00 O ATOM 765 CB THR A 115 -4.523 -9.981 19.046 1.00 0.00 C ATOM 766 OG1 THR A 115 -4.659 -9.605 17.671 1.00 0.00 O ATOM 767 CG2 THR A 115 -5.760 -9.551 19.820 1.00 0.00 C ATOM 0 H THR A 115 -3.887 -7.437 19.044 1.00 0.00 H new ATOM 0 HA THR A 115 -3.076 -9.763 20.633 1.00 0.00 H new ATOM 0 HB THR A 115 -4.428 -11.064 19.118 1.00 0.00 H new ATOM 0 HG1 THR A 115 -5.467 -10.016 17.298 1.00 0.00 H new ATOM 0 HG21 THR A 115 -6.643 -10.014 19.380 1.00 0.00 H new ATOM 0 HG22 THR A 115 -5.666 -9.864 20.860 1.00 0.00 H new ATOM 0 HG23 THR A 115 -5.858 -8.466 19.775 1.00 0.00 H new ATOM 775 N GLY A 116 -1.713 -8.710 17.881 1.00 0.00 N ATOM 776 CA GLY A 116 -0.596 -8.907 16.976 1.00 0.00 C ATOM 777 C GLY A 116 -0.979 -9.713 15.750 1.00 0.00 C ATOM 778 O GLY A 116 -0.138 -10.387 15.154 1.00 0.00 O ATOM 0 H GLY A 116 -2.180 -7.807 17.795 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -0.210 -7.937 16.663 1.00 0.00 H new ATOM 0 HA3 GLY A 116 0.210 -9.416 17.504 1.00 0.00 H new ATOM 782 N LYS A 117 -2.251 -9.645 15.373 1.00 0.00 N ATOM 783 CA LYS A 117 -2.744 -10.374 14.210 1.00 0.00 C ATOM 784 C LYS A 117 -2.778 -9.475 12.978 1.00 0.00 C ATOM 785 O LYS A 117 -2.690 -8.252 13.088 1.00 0.00 O ATOM 786 CB LYS A 117 -4.143 -10.930 14.487 1.00 0.00 C ATOM 787 CG LYS A 117 -4.214 -11.811 15.723 1.00 0.00 C ATOM 788 CD LYS A 117 -3.541 -13.153 15.491 1.00 0.00 C ATOM 789 CE LYS A 117 -3.596 -14.027 16.734 1.00 0.00 C ATOM 790 NZ LYS A 117 -2.983 -15.363 16.501 1.00 0.00 N ATOM 0 H LYS A 117 -2.960 -9.093 15.856 1.00 0.00 H new ATOM 0 HA LYS A 117 -2.062 -11.202 14.015 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -4.839 -10.099 14.603 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -4.474 -11.505 13.622 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.736 -11.303 16.561 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -5.257 -11.969 15.999 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -4.028 -13.667 14.662 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -2.502 -12.995 15.202 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -3.077 -13.527 17.552 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -4.633 -14.153 17.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -3.041 -15.928 17.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -3.494 -15.851 15.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -1.986 -15.245 16.230 1.00 0.00 H new ATOM 804 N SER A 118 -2.907 -10.089 11.807 1.00 0.00 N ATOM 805 CA SER A 118 -2.950 -9.344 10.554 1.00 0.00 C ATOM 806 C SER A 118 -4.210 -8.488 10.474 1.00 0.00 C ATOM 807 O SER A 118 -5.326 -9.007 10.427 1.00 0.00 O ATOM 808 CB SER A 118 -2.895 -10.304 9.363 1.00 0.00 C ATOM 809 OG SER A 118 -2.796 -9.594 8.141 1.00 0.00 O ATOM 0 H SER A 118 -2.984 -11.100 11.699 1.00 0.00 H new ATOM 0 HA SER A 118 -2.082 -8.686 10.521 1.00 0.00 H new ATOM 0 HB2 SER A 118 -2.040 -10.972 9.469 1.00 0.00 H new ATOM 0 HB3 SER A 118 -3.788 -10.928 9.353 1.00 0.00 H new ATOM 0 HG SER A 118 -2.761 -10.229 7.396 1.00 0.00 H new ATOM 815 N LYS A 119 -4.024 -7.173 10.458 1.00 0.00 N ATOM 816 CA LYS A 119 -5.143 -6.242 10.383 1.00 0.00 C ATOM 817 C LYS A 119 -5.881 -6.384 9.055 1.00 0.00 C ATOM 818 O LYS A 119 -7.110 -6.347 9.010 1.00 0.00 O ATOM 819 CB LYS A 119 -4.649 -4.803 10.552 1.00 0.00 C ATOM 820 CG LYS A 119 -4.600 -4.344 11.999 1.00 0.00 C ATOM 821 CD LYS A 119 -5.909 -3.702 12.426 1.00 0.00 C ATOM 822 CE LYS A 119 -6.036 -3.647 13.941 1.00 0.00 C ATOM 823 NZ LYS A 119 -6.675 -4.876 14.488 1.00 0.00 N ATOM 0 H LYS A 119 -3.107 -6.727 10.496 1.00 0.00 H new ATOM 0 HA LYS A 119 -5.835 -6.480 11.191 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -3.653 -4.716 10.118 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.301 -4.135 9.989 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -4.384 -5.195 12.644 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -3.785 -3.631 12.128 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -5.971 -2.693 12.018 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -6.744 -4.265 12.010 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -5.048 -3.523 14.384 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -6.624 -2.774 14.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -6.607 -4.870 15.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.676 -4.901 14.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -6.189 -5.716 14.114 1.00 0.00 H new ATOM 837 N GLY A 120 -5.122 -6.549 7.976 1.00 0.00 N ATOM 838 CA GLY A 120 -5.721 -6.696 6.663 1.00 0.00 C ATOM 839 C GLY A 120 -5.096 -5.774 5.634 1.00 0.00 C ATOM 840 O GLY A 120 -4.770 -6.200 4.526 1.00 0.00 O ATOM 0 H GLY A 120 -4.103 -6.583 7.988 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -5.615 -7.729 6.332 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -6.789 -6.490 6.729 1.00 0.00 H new ATOM 844 N TYR A 121 -4.931 -4.508 6.000 1.00 0.00 N ATOM 845 CA TYR A 121 -4.345 -3.523 5.099 1.00 0.00 C ATOM 846 C TYR A 121 -2.874 -3.289 5.429 1.00 0.00 C ATOM 847 O TYR A 121 -2.486 -3.254 6.596 1.00 0.00 O ATOM 848 CB TYR A 121 -5.114 -2.203 5.183 1.00 0.00 C ATOM 849 CG TYR A 121 -5.173 -1.625 6.578 1.00 0.00 C ATOM 850 CD1 TYR A 121 -6.075 -2.112 7.516 1.00 0.00 C ATOM 851 CD2 TYR A 121 -4.327 -0.591 6.959 1.00 0.00 C ATOM 852 CE1 TYR A 121 -6.133 -1.586 8.792 1.00 0.00 C ATOM 853 CE2 TYR A 121 -4.377 -0.059 8.234 1.00 0.00 C ATOM 854 CZ TYR A 121 -5.282 -0.560 9.146 1.00 0.00 C ATOM 855 OH TYR A 121 -5.335 -0.034 10.417 1.00 0.00 O ATOM 0 H TYR A 121 -5.195 -4.140 6.914 1.00 0.00 H new ATOM 0 HA TYR A 121 -4.413 -3.912 4.083 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -4.647 -1.477 4.517 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -6.130 -2.360 4.821 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -6.742 -2.916 7.243 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -3.618 -0.196 6.247 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -6.841 -1.976 9.508 1.00 0.00 H new ATOM 0 HE2 TYR A 121 -3.711 0.744 8.514 1.00 0.00 H new ATOM 0 HH TYR A 121 -4.669 0.680 10.504 1.00 0.00 H new ATOM 865 N GLY A 122 -2.059 -3.128 4.391 1.00 0.00 N ATOM 866 CA GLY A 122 -0.640 -2.898 4.590 1.00 0.00 C ATOM 867 C GLY A 122 -0.153 -1.641 3.897 1.00 0.00 C ATOM 868 O GLY A 122 -0.926 -0.950 3.233 1.00 0.00 O ATOM 0 H GLY A 122 -2.356 -3.153 3.416 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -0.433 -2.824 5.658 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -0.080 -3.755 4.216 1.00 0.00 H new ATOM 872 N PHE A 123 1.132 -1.342 4.053 1.00 0.00 N ATOM 873 CA PHE A 123 1.721 -0.157 3.439 1.00 0.00 C ATOM 874 C PHE A 123 2.869 -0.540 2.509 1.00 0.00 C ATOM 875 O PHE A 123 3.664 -1.427 2.819 1.00 0.00 O ATOM 876 CB PHE A 123 2.222 0.806 4.517 1.00 0.00 C ATOM 877 CG PHE A 123 1.120 1.421 5.331 1.00 0.00 C ATOM 878 CD1 PHE A 123 0.200 2.274 4.744 1.00 0.00 C ATOM 879 CD2 PHE A 123 1.004 1.146 6.684 1.00 0.00 C ATOM 880 CE1 PHE A 123 -0.816 2.841 5.490 1.00 0.00 C ATOM 881 CE2 PHE A 123 -0.010 1.709 7.436 1.00 0.00 C ATOM 882 CZ PHE A 123 -0.920 2.559 6.838 1.00 0.00 C ATOM 0 H PHE A 123 1.786 -1.903 4.599 1.00 0.00 H new ATOM 0 HA PHE A 123 0.949 0.338 2.850 1.00 0.00 H new ATOM 0 HB2 PHE A 123 2.900 0.272 5.183 1.00 0.00 H new ATOM 0 HB3 PHE A 123 2.800 1.600 4.044 1.00 0.00 H new ATOM 0 HD1 PHE A 123 0.278 2.499 3.690 1.00 0.00 H new ATOM 0 HD2 PHE A 123 1.714 0.484 7.157 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -1.527 3.504 5.020 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -0.091 1.485 8.489 1.00 0.00 H new ATOM 0 HZ PHE A 123 -1.712 3.002 7.424 1.00 0.00 H new ATOM 892 N VAL A 124 2.948 0.136 1.367 1.00 0.00 N ATOM 893 CA VAL A 124 3.998 -0.132 0.392 1.00 0.00 C ATOM 894 C VAL A 124 4.580 1.165 -0.159 1.00 0.00 C ATOM 895 O VAL A 124 3.886 1.938 -0.820 1.00 0.00 O ATOM 896 CB VAL A 124 3.472 -0.984 -0.779 1.00 0.00 C ATOM 897 CG1 VAL A 124 4.581 -1.250 -1.786 1.00 0.00 C ATOM 898 CG2 VAL A 124 2.882 -2.288 -0.266 1.00 0.00 C ATOM 0 H VAL A 124 2.297 0.873 1.095 1.00 0.00 H new ATOM 0 HA VAL A 124 4.780 -0.686 0.912 1.00 0.00 H new ATOM 0 HB VAL A 124 2.682 -0.428 -1.284 1.00 0.00 H new ATOM 0 HG11 VAL A 124 4.191 -1.853 -2.606 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.952 -0.303 -2.177 1.00 0.00 H new ATOM 0 HG13 VAL A 124 5.395 -1.785 -1.298 1.00 0.00 H new ATOM 0 HG21 VAL A 124 2.515 -2.877 -1.107 1.00 0.00 H new ATOM 0 HG22 VAL A 124 3.650 -2.851 0.264 1.00 0.00 H new ATOM 0 HG23 VAL A 124 2.057 -2.072 0.413 1.00 0.00 H new ATOM 908 N SER A 125 5.859 1.397 0.118 1.00 0.00 N ATOM 909 CA SER A 125 6.535 2.603 -0.347 1.00 0.00 C ATOM 910 C SER A 125 7.403 2.303 -1.565 1.00 0.00 C ATOM 911 O SER A 125 7.895 1.187 -1.733 1.00 0.00 O ATOM 912 CB SER A 125 7.394 3.195 0.772 1.00 0.00 C ATOM 913 OG SER A 125 8.089 4.346 0.326 1.00 0.00 O ATOM 0 H SER A 125 6.448 0.766 0.662 1.00 0.00 H new ATOM 0 HA SER A 125 5.774 3.329 -0.634 1.00 0.00 H new ATOM 0 HB2 SER A 125 6.762 3.454 1.621 1.00 0.00 H new ATOM 0 HB3 SER A 125 8.107 2.448 1.121 1.00 0.00 H new ATOM 0 HG SER A 125 8.882 4.073 -0.181 1.00 0.00 H new ATOM 919 N PHE A 126 7.587 3.309 -2.414 1.00 0.00 N ATOM 920 CA PHE A 126 8.395 3.155 -3.619 1.00 0.00 C ATOM 921 C PHE A 126 9.404 4.292 -3.746 1.00 0.00 C ATOM 922 O PHE A 126 9.143 5.419 -3.323 1.00 0.00 O ATOM 923 CB PHE A 126 7.498 3.113 -4.858 1.00 0.00 C ATOM 924 CG PHE A 126 6.422 2.067 -4.784 1.00 0.00 C ATOM 925 CD1 PHE A 126 5.439 2.133 -3.809 1.00 0.00 C ATOM 926 CD2 PHE A 126 6.394 1.018 -5.689 1.00 0.00 C ATOM 927 CE1 PHE A 126 4.449 1.172 -3.739 1.00 0.00 C ATOM 928 CE2 PHE A 126 5.405 0.054 -5.623 1.00 0.00 C ATOM 929 CZ PHE A 126 4.431 0.132 -4.648 1.00 0.00 C ATOM 0 H PHE A 126 7.188 4.239 -2.290 1.00 0.00 H new ATOM 0 HA PHE A 126 8.941 2.215 -3.542 1.00 0.00 H new ATOM 0 HB2 PHE A 126 7.035 4.090 -4.995 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.115 2.927 -5.737 1.00 0.00 H new ATOM 0 HD1 PHE A 126 5.447 2.944 -3.096 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.153 0.953 -6.454 1.00 0.00 H new ATOM 0 HE1 PHE A 126 3.689 1.234 -2.974 1.00 0.00 H new ATOM 0 HE2 PHE A 126 5.395 -0.759 -6.334 1.00 0.00 H new ATOM 0 HZ PHE A 126 3.656 -0.619 -4.596 1.00 0.00 H new ATOM 939 N PHE A 127 10.558 3.989 -4.331 1.00 0.00 N ATOM 940 CA PHE A 127 11.608 4.984 -4.513 1.00 0.00 C ATOM 941 C PHE A 127 11.152 6.088 -5.463 1.00 0.00 C ATOM 942 O PHE A 127 11.431 7.265 -5.243 1.00 0.00 O ATOM 943 CB PHE A 127 12.878 4.323 -5.053 1.00 0.00 C ATOM 944 CG PHE A 127 13.382 3.200 -4.192 1.00 0.00 C ATOM 945 CD1 PHE A 127 12.899 1.912 -4.358 1.00 0.00 C ATOM 946 CD2 PHE A 127 14.338 3.432 -3.216 1.00 0.00 C ATOM 947 CE1 PHE A 127 13.360 0.876 -3.568 1.00 0.00 C ATOM 948 CE2 PHE A 127 14.803 2.401 -2.424 1.00 0.00 C ATOM 949 CZ PHE A 127 14.313 1.121 -2.598 1.00 0.00 C ATOM 0 H PHE A 127 10.790 3.062 -4.687 1.00 0.00 H new ATOM 0 HA PHE A 127 11.824 5.430 -3.542 1.00 0.00 H new ATOM 0 HB2 PHE A 127 12.682 3.942 -6.055 1.00 0.00 H new ATOM 0 HB3 PHE A 127 13.659 5.077 -5.146 1.00 0.00 H new ATOM 0 HD1 PHE A 127 12.153 1.715 -5.114 1.00 0.00 H new ATOM 0 HD2 PHE A 127 14.724 4.431 -3.073 1.00 0.00 H new ATOM 0 HE1 PHE A 127 12.976 -0.124 -3.709 1.00 0.00 H new ATOM 0 HE2 PHE A 127 15.550 2.595 -1.668 1.00 0.00 H new ATOM 0 HZ PHE A 127 14.674 0.314 -1.977 1.00 0.00 H new ATOM 959 N ASN A 128 10.450 5.696 -6.522 1.00 0.00 N ATOM 960 CA ASN A 128 9.957 6.651 -7.507 1.00 0.00 C ATOM 961 C ASN A 128 8.435 6.748 -7.456 1.00 0.00 C ATOM 962 O ASN A 128 7.756 5.815 -7.027 1.00 0.00 O ATOM 963 CB ASN A 128 10.406 6.245 -8.912 1.00 0.00 C ATOM 964 CG ASN A 128 11.858 5.809 -8.952 1.00 0.00 C ATOM 965 OD1 ASN A 128 12.611 6.035 -8.004 1.00 0.00 O ATOM 966 ND2 ASN A 128 12.258 5.182 -10.052 1.00 0.00 N ATOM 0 H ASN A 128 10.210 4.724 -6.719 1.00 0.00 H new ATOM 0 HA ASN A 128 10.374 7.629 -7.268 1.00 0.00 H new ATOM 0 HB2 ASN A 128 9.775 5.432 -9.271 1.00 0.00 H new ATOM 0 HB3 ASN A 128 10.263 7.084 -9.593 1.00 0.00 H new ATOM 0 HD21 ASN A 128 13.224 4.866 -10.136 1.00 0.00 H new ATOM 0 HD22 ASN A 128 11.599 5.016 -10.813 1.00 0.00 H new ATOM 973 N LYS A 129 7.905 7.884 -7.896 1.00 0.00 N ATOM 974 CA LYS A 129 6.464 8.105 -7.903 1.00 0.00 C ATOM 975 C LYS A 129 5.780 7.202 -8.925 1.00 0.00 C ATOM 976 O LYS A 129 4.973 6.344 -8.566 1.00 0.00 O ATOM 977 CB LYS A 129 6.152 9.571 -8.213 1.00 0.00 C ATOM 978 CG LYS A 129 4.666 9.878 -8.272 1.00 0.00 C ATOM 979 CD LYS A 129 4.401 11.371 -8.184 1.00 0.00 C ATOM 980 CE LYS A 129 2.933 11.662 -7.915 1.00 0.00 C ATOM 981 NZ LYS A 129 2.520 12.985 -8.461 1.00 0.00 N ATOM 0 H LYS A 129 8.453 8.667 -8.253 1.00 0.00 H new ATOM 0 HA LYS A 129 6.080 7.860 -6.913 1.00 0.00 H new ATOM 0 HB2 LYS A 129 6.614 10.201 -7.453 1.00 0.00 H new ATOM 0 HB3 LYS A 129 6.607 9.837 -9.167 1.00 0.00 H new ATOM 0 HG2 LYS A 129 4.250 9.488 -9.201 1.00 0.00 H new ATOM 0 HG3 LYS A 129 4.156 9.368 -7.455 1.00 0.00 H new ATOM 0 HD2 LYS A 129 5.010 11.803 -7.390 1.00 0.00 H new ATOM 0 HD3 LYS A 129 4.703 11.851 -9.115 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.320 10.878 -8.360 1.00 0.00 H new ATOM 0 HE3 LYS A 129 2.749 11.639 -6.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 1.513 13.146 -8.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 3.087 13.736 -8.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 2.671 12.998 -9.490 1.00 0.00 H new ATOM 995 N TRP A 130 6.109 7.400 -10.196 1.00 0.00 N ATOM 996 CA TRP A 130 5.527 6.601 -11.269 1.00 0.00 C ATOM 997 C TRP A 130 5.251 5.177 -10.800 1.00 0.00 C ATOM 998 O TRP A 130 4.109 4.719 -10.815 1.00 0.00 O ATOM 999 CB TRP A 130 6.460 6.581 -12.481 1.00 0.00 C ATOM 1000 CG TRP A 130 7.464 7.694 -12.477 1.00 0.00 C ATOM 1001 CD1 TRP A 130 8.823 7.572 -12.439 1.00 0.00 C ATOM 1002 CD2 TRP A 130 7.185 9.098 -12.510 1.00 0.00 C ATOM 1003 NE1 TRP A 130 9.407 8.816 -12.447 1.00 0.00 N ATOM 1004 CE2 TRP A 130 8.424 9.769 -12.491 1.00 0.00 C ATOM 1005 CE3 TRP A 130 6.011 9.854 -12.556 1.00 0.00 C ATOM 1006 CZ2 TRP A 130 8.519 11.158 -12.515 1.00 0.00 C ATOM 1007 CZ3 TRP A 130 6.107 11.233 -12.580 1.00 0.00 C ATOM 1008 CH2 TRP A 130 7.353 11.873 -12.560 1.00 0.00 C ATOM 0 H TRP A 130 6.775 8.106 -10.509 1.00 0.00 H new ATOM 0 HA TRP A 130 4.580 7.058 -11.556 1.00 0.00 H new ATOM 0 HB2 TRP A 130 6.986 5.627 -12.510 1.00 0.00 H new ATOM 0 HB3 TRP A 130 5.863 6.643 -13.391 1.00 0.00 H new ATOM 0 HD1 TRP A 130 9.360 6.636 -12.407 1.00 0.00 H new ATOM 0 HE1 TRP A 130 10.410 9.000 -12.424 1.00 0.00 H new ATOM 0 HE3 TRP A 130 5.046 9.370 -12.573 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 9.479 11.653 -12.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 5.206 11.827 -12.615 1.00 0.00 H new ATOM 0 HH2 TRP A 130 7.394 12.952 -12.581 1.00 0.00 H new ATOM 1019 N ASP A 131 6.304 4.482 -10.384 1.00 0.00 N ATOM 1020 CA ASP A 131 6.174 3.109 -9.909 1.00 0.00 C ATOM 1021 C ASP A 131 4.888 2.930 -9.108 1.00 0.00 C ATOM 1022 O ASP A 131 4.073 2.060 -9.411 1.00 0.00 O ATOM 1023 CB ASP A 131 7.381 2.728 -9.050 1.00 0.00 C ATOM 1024 CG ASP A 131 8.570 2.291 -9.883 1.00 0.00 C ATOM 1025 OD1 ASP A 131 8.371 1.946 -11.067 1.00 0.00 O ATOM 1026 OD2 ASP A 131 9.700 2.296 -9.352 1.00 0.00 O ATOM 0 H ASP A 131 7.257 4.846 -10.366 1.00 0.00 H new ATOM 0 HA ASP A 131 6.134 2.452 -10.778 1.00 0.00 H new ATOM 0 HB2 ASP A 131 7.667 3.579 -8.433 1.00 0.00 H new ATOM 0 HB3 ASP A 131 7.101 1.922 -8.372 1.00 0.00 H new ATOM 1031 N ALA A 132 4.714 3.760 -8.085 1.00 0.00 N ATOM 1032 CA ALA A 132 3.527 3.694 -7.241 1.00 0.00 C ATOM 1033 C ALA A 132 2.260 3.927 -8.057 1.00 0.00 C ATOM 1034 O ALA A 132 1.424 3.034 -8.190 1.00 0.00 O ATOM 1035 CB ALA A 132 3.624 4.709 -6.112 1.00 0.00 C ATOM 0 H ALA A 132 5.380 4.486 -7.821 1.00 0.00 H new ATOM 0 HA ALA A 132 3.473 2.694 -6.811 1.00 0.00 H new ATOM 0 HB1 ALA A 132 2.731 4.648 -5.490 1.00 0.00 H new ATOM 0 HB2 ALA A 132 4.504 4.495 -5.505 1.00 0.00 H new ATOM 0 HB3 ALA A 132 3.707 5.712 -6.531 1.00 0.00 H new ATOM 1041 N GLU A 133 2.126 5.133 -8.601 1.00 0.00 N ATOM 1042 CA GLU A 133 0.959 5.482 -9.403 1.00 0.00 C ATOM 1043 C GLU A 133 0.538 4.314 -10.289 1.00 0.00 C ATOM 1044 O GLU A 133 -0.590 3.831 -10.204 1.00 0.00 O ATOM 1045 CB GLU A 133 1.255 6.711 -10.266 1.00 0.00 C ATOM 1046 CG GLU A 133 1.056 8.029 -9.537 1.00 0.00 C ATOM 1047 CD GLU A 133 -0.368 8.540 -9.634 1.00 0.00 C ATOM 1048 OE1 GLU A 133 -1.297 7.706 -9.655 1.00 0.00 O ATOM 1049 OE2 GLU A 133 -0.554 9.774 -9.688 1.00 0.00 O ATOM 0 H GLU A 133 2.810 5.883 -8.501 1.00 0.00 H new ATOM 0 HA GLU A 133 0.139 5.713 -8.723 1.00 0.00 H new ATOM 0 HB2 GLU A 133 2.283 6.655 -10.623 1.00 0.00 H new ATOM 0 HB3 GLU A 133 0.611 6.691 -11.145 1.00 0.00 H new ATOM 0 HG2 GLU A 133 1.322 7.903 -8.488 1.00 0.00 H new ATOM 0 HG3 GLU A 133 1.735 8.775 -9.951 1.00 0.00 H new ATOM 1056 N ASN A 134 1.454 3.865 -11.141 1.00 0.00 N ATOM 1057 CA ASN A 134 1.178 2.754 -12.045 1.00 0.00 C ATOM 1058 C ASN A 134 0.407 1.649 -11.329 1.00 0.00 C ATOM 1059 O ASN A 134 -0.621 1.179 -11.817 1.00 0.00 O ATOM 1060 CB ASN A 134 2.484 2.194 -12.612 1.00 0.00 C ATOM 1061 CG ASN A 134 2.252 1.263 -13.787 1.00 0.00 C ATOM 1062 OD1 ASN A 134 1.161 1.221 -14.354 1.00 0.00 O ATOM 1063 ND2 ASN A 134 3.282 0.510 -14.157 1.00 0.00 N ATOM 0 H ASN A 134 2.394 4.253 -11.224 1.00 0.00 H new ATOM 0 HA ASN A 134 0.565 3.129 -12.865 1.00 0.00 H new ATOM 0 HB2 ASN A 134 3.124 3.019 -12.926 1.00 0.00 H new ATOM 0 HB3 ASN A 134 3.017 1.658 -11.827 1.00 0.00 H new ATOM 0 HD21 ASN A 134 3.186 -0.136 -14.940 1.00 0.00 H new ATOM 0 HD22 ASN A 134 4.169 0.578 -13.658 1.00 0.00 H new ATOM 1070 N ALA A 135 0.909 1.240 -10.169 1.00 0.00 N ATOM 1071 CA ALA A 135 0.267 0.193 -9.385 1.00 0.00 C ATOM 1072 C ALA A 135 -1.085 0.657 -8.854 1.00 0.00 C ATOM 1073 O ALA A 135 -2.119 0.060 -9.156 1.00 0.00 O ATOM 1074 CB ALA A 135 1.169 -0.235 -8.237 1.00 0.00 C ATOM 0 H ALA A 135 1.759 1.618 -9.751 1.00 0.00 H new ATOM 0 HA ALA A 135 0.097 -0.664 -10.037 1.00 0.00 H new ATOM 0 HB1 ALA A 135 0.677 -1.018 -7.660 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.110 -0.615 -8.636 1.00 0.00 H new ATOM 0 HB3 ALA A 135 1.368 0.621 -7.592 1.00 0.00 H new ATOM 1080 N ILE A 136 -1.070 1.723 -8.061 1.00 0.00 N ATOM 1081 CA ILE A 136 -2.296 2.266 -7.489 1.00 0.00 C ATOM 1082 C ILE A 136 -3.450 2.185 -8.483 1.00 0.00 C ATOM 1083 O ILE A 136 -4.589 1.915 -8.104 1.00 0.00 O ATOM 1084 CB ILE A 136 -2.112 3.732 -7.052 1.00 0.00 C ATOM 1085 CG1 ILE A 136 -1.040 3.832 -5.965 1.00 0.00 C ATOM 1086 CG2 ILE A 136 -3.431 4.306 -6.558 1.00 0.00 C ATOM 1087 CD1 ILE A 136 -0.626 5.253 -5.654 1.00 0.00 C ATOM 0 H ILE A 136 -0.223 2.228 -7.800 1.00 0.00 H new ATOM 0 HA ILE A 136 -2.531 1.661 -6.614 1.00 0.00 H new ATOM 0 HB ILE A 136 -1.784 4.315 -7.913 1.00 0.00 H new ATOM 0 HG12 ILE A 136 -1.413 3.363 -5.054 1.00 0.00 H new ATOM 0 HG13 ILE A 136 -0.162 3.267 -6.278 1.00 0.00 H new ATOM 0 HG21 ILE A 136 -3.285 5.342 -6.253 1.00 0.00 H new ATOM 0 HG22 ILE A 136 -4.169 4.264 -7.359 1.00 0.00 H new ATOM 0 HG23 ILE A 136 -3.785 3.724 -5.708 1.00 0.00 H new ATOM 0 HD11 ILE A 136 0.136 5.248 -4.875 1.00 0.00 H new ATOM 0 HD12 ILE A 136 -0.223 5.720 -6.553 1.00 0.00 H new ATOM 0 HD13 ILE A 136 -1.493 5.817 -5.310 1.00 0.00 H new ATOM 1099 N GLN A 137 -3.146 2.419 -9.755 1.00 0.00 N ATOM 1100 CA GLN A 137 -4.158 2.370 -10.804 1.00 0.00 C ATOM 1101 C GLN A 137 -4.368 0.941 -11.292 1.00 0.00 C ATOM 1102 O GLN A 137 -5.463 0.391 -11.174 1.00 0.00 O ATOM 1103 CB GLN A 137 -3.753 3.267 -11.975 1.00 0.00 C ATOM 1104 CG GLN A 137 -3.234 4.630 -11.546 1.00 0.00 C ATOM 1105 CD GLN A 137 -2.327 5.262 -12.583 1.00 0.00 C ATOM 1106 OE1 GLN A 137 -1.349 4.499 -13.058 1.00 0.00 O flip ATOM 1107 NE2 GLN A 137 -2.502 6.423 -12.954 1.00 0.00 N flip ATOM 0 H GLN A 137 -2.207 2.644 -10.085 1.00 0.00 H new ATOM 0 HA GLN A 137 -5.097 2.733 -10.385 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -2.984 2.762 -12.560 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -4.613 3.405 -12.631 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -4.078 5.292 -11.355 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -2.690 4.528 -10.607 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -3.266 6.974 -12.563 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -1.883 6.834 -13.653 1.00 0.00 H new ATOM 1116 N GLN A 138 -3.313 0.346 -11.839 1.00 0.00 N ATOM 1117 CA GLN A 138 -3.384 -1.019 -12.346 1.00 0.00 C ATOM 1118 C GLN A 138 -3.733 -1.997 -11.229 1.00 0.00 C ATOM 1119 O GLN A 138 -4.746 -2.692 -11.293 1.00 0.00 O ATOM 1120 CB GLN A 138 -2.055 -1.416 -12.991 1.00 0.00 C ATOM 1121 CG GLN A 138 -1.605 -0.466 -14.089 1.00 0.00 C ATOM 1122 CD GLN A 138 -2.156 -0.845 -15.450 1.00 0.00 C ATOM 1123 OE1 GLN A 138 -3.363 -0.773 -15.685 1.00 0.00 O ATOM 1124 NE2 GLN A 138 -1.273 -1.250 -16.355 1.00 0.00 N ATOM 0 H GLN A 138 -2.399 0.788 -11.942 1.00 0.00 H new ATOM 0 HA GLN A 138 -4.171 -1.060 -13.099 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -1.285 -1.459 -12.221 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -2.147 -2.420 -13.406 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -1.923 0.547 -13.841 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -0.516 -0.456 -14.132 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -0.282 -1.294 -16.117 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -1.585 -1.517 -17.289 1.00 0.00 H new ATOM 1133 N MET A 139 -2.886 -2.045 -10.206 1.00 0.00 N ATOM 1134 CA MET A 139 -3.105 -2.938 -9.074 1.00 0.00 C ATOM 1135 C MET A 139 -4.458 -2.667 -8.422 1.00 0.00 C ATOM 1136 O MET A 139 -5.134 -3.589 -7.967 1.00 0.00 O ATOM 1137 CB MET A 139 -1.987 -2.773 -8.042 1.00 0.00 C ATOM 1138 CG MET A 139 -0.673 -3.411 -8.464 1.00 0.00 C ATOM 1139 SD MET A 139 -0.849 -5.157 -8.877 1.00 0.00 S ATOM 1140 CE MET A 139 -1.399 -5.823 -7.308 1.00 0.00 C ATOM 0 H MET A 139 -2.042 -1.476 -10.138 1.00 0.00 H new ATOM 0 HA MET A 139 -3.098 -3.963 -9.445 1.00 0.00 H new ATOM 0 HB2 MET A 139 -1.824 -1.711 -7.861 1.00 0.00 H new ATOM 0 HB3 MET A 139 -2.308 -3.212 -7.097 1.00 0.00 H new ATOM 0 HG2 MET A 139 -0.274 -2.876 -9.326 1.00 0.00 H new ATOM 0 HG3 MET A 139 0.054 -3.304 -7.659 1.00 0.00 H new ATOM 0 HE1 MET A 139 -1.013 -6.835 -7.187 1.00 0.00 H new ATOM 0 HE2 MET A 139 -1.031 -5.195 -6.497 1.00 0.00 H new ATOM 0 HE3 MET A 139 -2.489 -5.845 -7.284 1.00 0.00 H new ATOM 1150 N GLY A 140 -4.847 -1.396 -8.382 1.00 0.00 N ATOM 1151 CA GLY A 140 -6.116 -1.028 -7.784 1.00 0.00 C ATOM 1152 C GLY A 140 -7.276 -1.824 -8.349 1.00 0.00 C ATOM 1153 O GLY A 140 -7.726 -1.571 -9.466 1.00 0.00 O ATOM 0 H GLY A 140 -4.306 -0.615 -8.753 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -6.064 -1.182 -6.706 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -6.296 0.035 -7.946 1.00 0.00 H new ATOM 1157 N GLY A 141 -7.761 -2.791 -7.575 1.00 0.00 N ATOM 1158 CA GLY A 141 -8.870 -3.613 -8.023 1.00 0.00 C ATOM 1159 C GLY A 141 -8.460 -5.049 -8.281 1.00 0.00 C ATOM 1160 O GLY A 141 -9.255 -5.970 -8.097 1.00 0.00 O ATOM 0 H GLY A 141 -7.406 -3.019 -6.647 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -9.660 -3.593 -7.272 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -9.288 -3.188 -8.936 1.00 0.00 H new ATOM 1164 N GLN A 142 -7.216 -5.240 -8.709 1.00 0.00 N ATOM 1165 CA GLN A 142 -6.704 -6.574 -8.995 1.00 0.00 C ATOM 1166 C GLN A 142 -6.992 -7.527 -7.840 1.00 0.00 C ATOM 1167 O GLN A 142 -7.583 -7.137 -6.834 1.00 0.00 O ATOM 1168 CB GLN A 142 -5.199 -6.519 -9.263 1.00 0.00 C ATOM 1169 CG GLN A 142 -4.841 -5.893 -10.601 1.00 0.00 C ATOM 1170 CD GLN A 142 -5.493 -6.604 -11.771 1.00 0.00 C ATOM 1171 OE1 GLN A 142 -6.723 -6.218 -12.087 1.00 0.00 O flip ATOM 1172 NE2 GLN A 142 -4.897 -7.490 -12.384 1.00 0.00 N flip ATOM 0 H GLN A 142 -6.545 -4.488 -8.865 1.00 0.00 H new ATOM 0 HA GLN A 142 -7.211 -6.947 -9.885 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -4.717 -5.953 -8.466 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -4.795 -7.530 -9.225 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -5.146 -4.846 -10.601 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -3.759 -5.910 -10.728 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -3.952 -7.755 -12.107 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -5.348 -7.959 -13.169 1.00 0.00 H new ATOM 1181 N TRP A 143 -6.572 -8.778 -7.992 1.00 0.00 N ATOM 1182 CA TRP A 143 -6.786 -9.787 -6.961 1.00 0.00 C ATOM 1183 C TRP A 143 -5.458 -10.267 -6.386 1.00 0.00 C ATOM 1184 O TRP A 143 -4.563 -10.680 -7.124 1.00 0.00 O ATOM 1185 CB TRP A 143 -7.566 -10.972 -7.532 1.00 0.00 C ATOM 1186 CG TRP A 143 -9.011 -10.664 -7.785 1.00 0.00 C ATOM 1187 CD1 TRP A 143 -9.514 -9.600 -8.477 1.00 0.00 C ATOM 1188 CD2 TRP A 143 -10.140 -11.429 -7.346 1.00 0.00 C ATOM 1189 NE1 TRP A 143 -10.887 -9.656 -8.495 1.00 0.00 N ATOM 1190 CE2 TRP A 143 -11.295 -10.769 -7.809 1.00 0.00 C ATOM 1191 CE3 TRP A 143 -10.286 -12.607 -6.609 1.00 0.00 C ATOM 1192 CZ2 TRP A 143 -12.577 -11.250 -7.557 1.00 0.00 C ATOM 1193 CZ3 TRP A 143 -11.560 -13.082 -6.359 1.00 0.00 C ATOM 1194 CH2 TRP A 143 -12.691 -12.405 -6.833 1.00 0.00 C ATOM 0 H TRP A 143 -6.081 -9.118 -8.819 1.00 0.00 H new ATOM 0 HA TRP A 143 -7.366 -9.333 -6.158 1.00 0.00 H new ATOM 0 HB2 TRP A 143 -7.100 -11.289 -8.465 1.00 0.00 H new ATOM 0 HB3 TRP A 143 -7.496 -11.811 -6.840 1.00 0.00 H new ATOM 0 HD1 TRP A 143 -8.920 -8.827 -8.942 1.00 0.00 H new ATOM 0 HE1 TRP A 143 -11.502 -8.979 -8.946 1.00 0.00 H new ATOM 0 HE3 TRP A 143 -9.420 -13.137 -6.241 1.00 0.00 H new ATOM 0 HZ2 TRP A 143 -13.451 -10.730 -7.920 1.00 0.00 H new ATOM 0 HZ3 TRP A 143 -11.685 -13.990 -5.789 1.00 0.00 H new ATOM 0 HH2 TRP A 143 -13.673 -12.803 -6.623 1.00 0.00 H new ATOM 1205 N LEU A 144 -5.336 -10.211 -5.064 1.00 0.00 N ATOM 1206 CA LEU A 144 -4.116 -10.641 -4.389 1.00 0.00 C ATOM 1207 C LEU A 144 -4.417 -11.725 -3.359 1.00 0.00 C ATOM 1208 O LEU A 144 -5.271 -11.550 -2.491 1.00 0.00 O ATOM 1209 CB LEU A 144 -3.438 -9.450 -3.710 1.00 0.00 C ATOM 1210 CG LEU A 144 -2.145 -9.755 -2.955 1.00 0.00 C ATOM 1211 CD1 LEU A 144 -1.026 -10.097 -3.927 1.00 0.00 C ATOM 1212 CD2 LEU A 144 -1.749 -8.576 -2.077 1.00 0.00 C ATOM 0 H LEU A 144 -6.067 -9.872 -4.438 1.00 0.00 H new ATOM 0 HA LEU A 144 -3.442 -11.055 -5.139 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -3.223 -8.698 -4.470 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -4.146 -9.004 -3.012 1.00 0.00 H new ATOM 0 HG LEU A 144 -2.317 -10.619 -2.313 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -0.113 -10.311 -3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -1.308 -10.972 -4.513 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -0.854 -9.253 -4.595 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -0.826 -8.811 -1.547 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -1.596 -7.694 -2.699 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -2.541 -8.377 -1.355 1.00 0.00 H new ATOM 1224 N GLY A 145 -3.707 -12.845 -3.460 1.00 0.00 N ATOM 1225 CA GLY A 145 -3.912 -13.939 -2.530 1.00 0.00 C ATOM 1226 C GLY A 145 -5.228 -14.656 -2.757 1.00 0.00 C ATOM 1227 O GLY A 145 -5.505 -15.675 -2.127 1.00 0.00 O ATOM 0 H GLY A 145 -2.994 -13.014 -4.169 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -3.093 -14.651 -2.626 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -3.883 -13.555 -1.510 1.00 0.00 H new ATOM 1231 N GLY A 146 -6.043 -14.120 -3.661 1.00 0.00 N ATOM 1232 CA GLY A 146 -7.329 -14.727 -3.953 1.00 0.00 C ATOM 1233 C GLY A 146 -8.482 -13.763 -3.760 1.00 0.00 C ATOM 1234 O GLY A 146 -9.613 -14.051 -4.153 1.00 0.00 O ATOM 0 H GLY A 146 -5.836 -13.277 -4.196 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -7.331 -15.090 -4.981 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -7.473 -15.594 -3.308 1.00 0.00 H new ATOM 1238 N ARG A 147 -8.198 -12.617 -3.150 1.00 0.00 N ATOM 1239 CA ARG A 147 -9.221 -11.609 -2.902 1.00 0.00 C ATOM 1240 C ARG A 147 -8.803 -10.258 -3.475 1.00 0.00 C ATOM 1241 O ARG A 147 -7.619 -9.923 -3.499 1.00 0.00 O ATOM 1242 CB ARG A 147 -9.486 -11.478 -1.401 1.00 0.00 C ATOM 1243 CG ARG A 147 -10.571 -12.413 -0.891 1.00 0.00 C ATOM 1244 CD ARG A 147 -10.337 -12.796 0.562 1.00 0.00 C ATOM 1245 NE ARG A 147 -11.309 -13.780 1.032 1.00 0.00 N ATOM 1246 CZ ARG A 147 -12.591 -13.503 1.242 1.00 0.00 C ATOM 1247 NH1 ARG A 147 -13.053 -12.279 1.026 1.00 0.00 N ATOM 1248 NH2 ARG A 147 -13.415 -14.452 1.670 1.00 0.00 N ATOM 0 H ARG A 147 -7.267 -12.364 -2.818 1.00 0.00 H new ATOM 0 HA ARG A 147 -10.137 -11.928 -3.399 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -8.562 -11.677 -0.859 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -9.770 -10.449 -1.179 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -11.544 -11.932 -0.990 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -10.597 -13.312 -1.506 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.330 -13.199 0.673 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -10.394 -11.904 1.186 1.00 0.00 H new ATOM 0 HE ARG A 147 -10.986 -14.731 1.208 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -12.423 -11.547 0.698 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -14.038 -12.070 1.188 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -13.064 -15.395 1.838 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -14.399 -14.238 1.831 1.00 0.00 H new ATOM 1262 N GLN A 148 -9.784 -9.487 -3.936 1.00 0.00 N ATOM 1263 CA GLN A 148 -9.517 -8.174 -4.510 1.00 0.00 C ATOM 1264 C GLN A 148 -8.758 -7.292 -3.523 1.00 0.00 C ATOM 1265 O GLN A 148 -8.784 -7.532 -2.315 1.00 0.00 O ATOM 1266 CB GLN A 148 -10.827 -7.495 -4.915 1.00 0.00 C ATOM 1267 CG GLN A 148 -11.256 -7.804 -6.340 1.00 0.00 C ATOM 1268 CD GLN A 148 -12.234 -6.784 -6.889 1.00 0.00 C ATOM 1269 OE1 GLN A 148 -13.313 -6.580 -6.332 1.00 0.00 O ATOM 1270 NE2 GLN A 148 -11.862 -6.138 -7.987 1.00 0.00 N ATOM 0 H GLN A 148 -10.770 -9.749 -3.923 1.00 0.00 H new ATOM 0 HA GLN A 148 -8.898 -8.312 -5.396 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -11.616 -7.808 -4.231 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -10.717 -6.416 -4.803 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -10.375 -7.839 -6.981 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -11.713 -8.793 -6.372 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -10.958 -6.339 -8.415 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -12.480 -5.441 -8.402 1.00 0.00 H new ATOM 1279 N ILE A 149 -8.083 -6.274 -4.045 1.00 0.00 N ATOM 1280 CA ILE A 149 -7.318 -5.357 -3.209 1.00 0.00 C ATOM 1281 C ILE A 149 -7.615 -3.906 -3.570 1.00 0.00 C ATOM 1282 O ILE A 149 -7.812 -3.574 -4.740 1.00 0.00 O ATOM 1283 CB ILE A 149 -5.804 -5.607 -3.339 1.00 0.00 C ATOM 1284 CG1 ILE A 149 -5.350 -5.381 -4.783 1.00 0.00 C ATOM 1285 CG2 ILE A 149 -5.459 -7.017 -2.884 1.00 0.00 C ATOM 1286 CD1 ILE A 149 -3.864 -5.131 -4.917 1.00 0.00 C ATOM 0 H ILE A 149 -8.050 -6.063 -5.042 1.00 0.00 H new ATOM 0 HA ILE A 149 -7.621 -5.542 -2.179 1.00 0.00 H new ATOM 0 HB ILE A 149 -5.277 -4.900 -2.698 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -5.619 -6.252 -5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -5.892 -4.531 -5.197 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -4.385 -7.178 -2.982 1.00 0.00 H new ATOM 0 HG22 ILE A 149 -5.752 -7.145 -1.842 1.00 0.00 H new ATOM 0 HG23 ILE A 149 -5.992 -7.739 -3.502 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -3.614 -4.979 -5.967 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -3.592 -4.243 -4.347 1.00 0.00 H new ATOM 0 HD13 ILE A 149 -3.314 -5.991 -4.534 1.00 0.00 H new ATOM 1298 N ARG A 150 -7.645 -3.044 -2.559 1.00 0.00 N ATOM 1299 CA ARG A 150 -7.917 -1.627 -2.770 1.00 0.00 C ATOM 1300 C ARG A 150 -6.648 -0.798 -2.596 1.00 0.00 C ATOM 1301 O ARG A 150 -6.144 -0.640 -1.484 1.00 0.00 O ATOM 1302 CB ARG A 150 -8.994 -1.143 -1.797 1.00 0.00 C ATOM 1303 CG ARG A 150 -8.647 -1.382 -0.337 1.00 0.00 C ATOM 1304 CD ARG A 150 -9.826 -1.073 0.573 1.00 0.00 C ATOM 1305 NE ARG A 150 -9.842 -1.928 1.757 1.00 0.00 N ATOM 1306 CZ ARG A 150 -10.904 -2.078 2.541 1.00 0.00 C ATOM 1307 NH1 ARG A 150 -12.030 -1.435 2.267 1.00 0.00 N ATOM 1308 NH2 ARG A 150 -10.841 -2.874 3.600 1.00 0.00 N ATOM 0 H ARG A 150 -7.484 -3.302 -1.585 1.00 0.00 H new ATOM 0 HA ARG A 150 -8.276 -1.499 -3.791 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -9.160 -0.077 -1.953 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -9.932 -1.648 -2.026 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -8.342 -2.419 -0.199 1.00 0.00 H new ATOM 0 HG3 ARG A 150 -7.797 -0.760 -0.057 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -9.782 -0.028 0.881 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -10.756 -1.203 0.019 1.00 0.00 H new ATOM 0 HE ARG A 150 -8.991 -2.438 1.995 1.00 0.00 H new ATOM 0 HH11 ARG A 150 -12.083 -0.823 1.453 1.00 0.00 H new ATOM 0 HH12 ARG A 150 -12.844 -1.552 2.871 1.00 0.00 H new ATOM 0 HH21 ARG A 150 -9.977 -3.372 3.813 1.00 0.00 H new ATOM 0 HH22 ARG A 150 -11.657 -2.988 4.201 1.00 0.00 H new ATOM 1322 N THR A 151 -6.136 -0.270 -3.703 1.00 0.00 N ATOM 1323 CA THR A 151 -4.926 0.542 -3.674 1.00 0.00 C ATOM 1324 C THR A 151 -5.258 2.028 -3.743 1.00 0.00 C ATOM 1325 O THR A 151 -6.047 2.458 -4.584 1.00 0.00 O ATOM 1326 CB THR A 151 -3.981 0.184 -4.836 1.00 0.00 C ATOM 1327 OG1 THR A 151 -4.620 0.456 -6.089 1.00 0.00 O ATOM 1328 CG2 THR A 151 -3.579 -1.282 -4.775 1.00 0.00 C ATOM 0 H THR A 151 -6.541 -0.390 -4.631 1.00 0.00 H new ATOM 0 HA THR A 151 -4.426 0.328 -2.730 1.00 0.00 H new ATOM 0 HB THR A 151 -3.083 0.795 -4.746 1.00 0.00 H new ATOM 0 HG1 THR A 151 -4.563 1.415 -6.284 1.00 0.00 H new ATOM 0 HG21 THR A 151 -2.912 -1.511 -5.606 1.00 0.00 H new ATOM 0 HG22 THR A 151 -3.067 -1.480 -3.833 1.00 0.00 H new ATOM 0 HG23 THR A 151 -4.470 -1.907 -4.842 1.00 0.00 H new ATOM 1336 N ASN A 152 -4.652 2.808 -2.855 1.00 0.00 N ATOM 1337 CA ASN A 152 -4.884 4.247 -2.816 1.00 0.00 C ATOM 1338 C ASN A 152 -3.699 4.972 -2.185 1.00 0.00 C ATOM 1339 O ASN A 152 -2.775 4.342 -1.671 1.00 0.00 O ATOM 1340 CB ASN A 152 -6.161 4.558 -2.034 1.00 0.00 C ATOM 1341 CG ASN A 152 -6.655 5.972 -2.270 1.00 0.00 C ATOM 1342 OD1 ASN A 152 -7.179 6.288 -3.339 1.00 0.00 O ATOM 1343 ND2 ASN A 152 -6.489 6.831 -1.272 1.00 0.00 N ATOM 0 H ASN A 152 -3.996 2.468 -2.152 1.00 0.00 H new ATOM 0 HA ASN A 152 -4.999 4.599 -3.841 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -6.940 3.852 -2.321 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -5.976 4.414 -0.970 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -6.801 7.797 -1.373 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -6.050 6.525 -0.404 1.00 0.00 H new ATOM 1350 N TRP A 153 -3.734 6.299 -2.229 1.00 0.00 N ATOM 1351 CA TRP A 153 -2.663 7.111 -1.661 1.00 0.00 C ATOM 1352 C TRP A 153 -2.713 7.089 -0.137 1.00 0.00 C ATOM 1353 O TRP A 153 -3.704 7.500 0.466 1.00 0.00 O ATOM 1354 CB TRP A 153 -2.764 8.551 -2.167 1.00 0.00 C ATOM 1355 CG TRP A 153 -2.321 8.713 -3.589 1.00 0.00 C ATOM 1356 CD1 TRP A 153 -3.108 9.016 -4.663 1.00 0.00 C ATOM 1357 CD2 TRP A 153 -0.987 8.579 -4.092 1.00 0.00 C ATOM 1358 NE1 TRP A 153 -2.344 9.078 -5.804 1.00 0.00 N ATOM 1359 CE2 TRP A 153 -1.040 8.815 -5.480 1.00 0.00 C ATOM 1360 CE3 TRP A 153 0.246 8.285 -3.505 1.00 0.00 C ATOM 1361 CZ2 TRP A 153 0.094 8.764 -6.287 1.00 0.00 C ATOM 1362 CZ3 TRP A 153 1.371 8.235 -4.307 1.00 0.00 C ATOM 1363 CH2 TRP A 153 1.289 8.474 -5.686 1.00 0.00 C ATOM 0 H TRP A 153 -4.492 6.836 -2.652 1.00 0.00 H new ATOM 0 HA TRP A 153 -1.711 6.687 -1.980 1.00 0.00 H new ATOM 0 HB2 TRP A 153 -3.796 8.889 -2.075 1.00 0.00 H new ATOM 0 HB3 TRP A 153 -2.159 9.196 -1.530 1.00 0.00 H new ATOM 0 HD1 TRP A 153 -4.174 9.183 -4.622 1.00 0.00 H new ATOM 0 HE1 TRP A 153 -2.692 9.286 -6.740 1.00 0.00 H new ATOM 0 HE3 TRP A 153 0.319 8.100 -2.443 1.00 0.00 H new ATOM 0 HZ2 TRP A 153 0.033 8.947 -7.350 1.00 0.00 H new ATOM 0 HZ3 TRP A 153 2.329 8.008 -3.864 1.00 0.00 H new ATOM 0 HH2 TRP A 153 2.186 8.428 -6.286 1.00 0.00 H new ATOM 1374 N ALA A 154 -1.639 6.608 0.479 1.00 0.00 N ATOM 1375 CA ALA A 154 -1.560 6.536 1.933 1.00 0.00 C ATOM 1376 C ALA A 154 -1.865 7.889 2.567 1.00 0.00 C ATOM 1377 O ALA A 154 -2.805 8.022 3.351 1.00 0.00 O ATOM 1378 CB ALA A 154 -0.185 6.047 2.364 1.00 0.00 C ATOM 0 H ALA A 154 -0.811 6.262 -0.006 1.00 0.00 H new ATOM 0 HA ALA A 154 -2.311 5.825 2.278 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -0.141 5.998 3.452 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -0.005 5.055 1.949 1.00 0.00 H new ATOM 0 HB3 ALA A 154 0.577 6.737 2.000 1.00 0.00 H new ATOM 1384 N THR A 155 -1.062 8.892 2.224 1.00 0.00 N ATOM 1385 CA THR A 155 -1.245 10.235 2.761 1.00 0.00 C ATOM 1386 C THR A 155 -2.719 10.621 2.788 1.00 0.00 C ATOM 1387 O THR A 155 -3.538 10.030 2.083 1.00 0.00 O ATOM 1388 CB THR A 155 -0.467 11.279 1.939 1.00 0.00 C ATOM 1389 OG1 THR A 155 -0.663 12.585 2.495 1.00 0.00 O ATOM 1390 CG2 THR A 155 -0.917 11.268 0.486 1.00 0.00 C ATOM 0 H THR A 155 -0.279 8.799 1.577 1.00 0.00 H new ATOM 0 HA THR A 155 -0.857 10.223 3.780 1.00 0.00 H new ATOM 0 HB THR A 155 0.592 11.024 1.977 1.00 0.00 H new ATOM 0 HG1 THR A 155 -0.164 13.243 1.968 1.00 0.00 H new ATOM 0 HG21 THR A 155 -0.354 12.014 -0.075 1.00 0.00 H new ATOM 0 HG22 THR A 155 -0.740 10.281 0.058 1.00 0.00 H new ATOM 0 HG23 THR A 155 -1.980 11.501 0.433 1.00 0.00 H new ATOM 1398 N ARG A 156 -3.051 11.615 3.604 1.00 0.00 N ATOM 1399 CA ARG A 156 -4.428 12.079 3.722 1.00 0.00 C ATOM 1400 C ARG A 156 -4.505 13.597 3.578 1.00 0.00 C ATOM 1401 O ARG A 156 -3.598 14.317 3.994 1.00 0.00 O ATOM 1402 CB ARG A 156 -5.019 11.654 5.068 1.00 0.00 C ATOM 1403 CG ARG A 156 -4.184 12.084 6.263 1.00 0.00 C ATOM 1404 CD ARG A 156 -4.944 11.902 7.568 1.00 0.00 C ATOM 1405 NE ARG A 156 -4.045 11.731 8.705 1.00 0.00 N ATOM 1406 CZ ARG A 156 -4.459 11.425 9.930 1.00 0.00 C ATOM 1407 NH1 ARG A 156 -5.751 11.257 10.174 1.00 0.00 N ATOM 1408 NH2 ARG A 156 -3.579 11.286 10.914 1.00 0.00 N ATOM 0 H ARG A 156 -2.385 12.115 4.193 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.007 11.625 2.918 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -6.020 12.075 5.165 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -5.126 10.569 5.082 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.263 11.502 6.293 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -3.897 13.130 6.151 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -5.584 12.768 7.739 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -5.598 11.033 7.489 1.00 0.00 H new ATOM 0 HE ARG A 156 -3.044 11.853 8.551 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -6.430 11.363 9.420 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -6.066 11.022 11.115 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -2.584 11.414 10.730 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -3.898 11.051 11.854 1.00 0.00 H new ATOM 1422 N LYS A 157 -5.593 14.075 2.986 1.00 0.00 N ATOM 1423 CA LYS A 157 -5.790 15.506 2.787 1.00 0.00 C ATOM 1424 C LYS A 157 -7.025 15.995 3.537 1.00 0.00 C ATOM 1425 O LYS A 157 -8.076 15.355 3.536 1.00 0.00 O ATOM 1426 CB LYS A 157 -5.930 15.820 1.295 1.00 0.00 C ATOM 1427 CG LYS A 157 -5.433 17.205 0.916 1.00 0.00 C ATOM 1428 CD LYS A 157 -6.504 18.261 1.137 1.00 0.00 C ATOM 1429 CE LYS A 157 -7.614 18.154 0.102 1.00 0.00 C ATOM 1430 NZ LYS A 157 -8.362 19.433 -0.043 1.00 0.00 N ATOM 0 H LYS A 157 -6.353 13.492 2.635 1.00 0.00 H new ATOM 0 HA LYS A 157 -4.917 16.026 3.182 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -5.377 15.075 0.722 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -6.978 15.728 1.010 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -4.551 17.451 1.507 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -5.127 17.209 -0.130 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -6.925 18.150 2.136 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -6.054 19.253 1.089 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -7.187 17.872 -0.860 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -8.304 17.361 0.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -9.087 19.329 -0.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -8.819 19.672 0.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -7.703 20.192 -0.309 1.00 0.00 H new ATOM 1444 N PRO A 158 -6.897 17.158 4.193 1.00 0.00 N ATOM 1445 CA PRO A 158 -7.993 17.760 4.959 1.00 0.00 C ATOM 1446 C PRO A 158 -9.112 18.276 4.060 1.00 0.00 C ATOM 1447 O PRO A 158 -8.878 18.763 2.954 1.00 0.00 O ATOM 1448 CB PRO A 158 -7.318 18.921 5.693 1.00 0.00 C ATOM 1449 CG PRO A 158 -6.140 19.268 4.850 1.00 0.00 C ATOM 1450 CD PRO A 158 -5.673 17.976 4.238 1.00 0.00 C ATOM 0 HA PRO A 158 -8.471 17.039 5.623 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -7.994 19.770 5.798 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -7.014 18.630 6.698 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -6.411 19.989 4.079 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -5.352 19.723 5.450 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -5.256 18.130 3.243 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -4.896 17.504 4.840 1.00 0.00 H new ATOM 1458 N PRO A 159 -10.358 18.170 4.545 1.00 0.00 N ATOM 1459 CA PRO A 159 -11.538 18.622 3.802 1.00 0.00 C ATOM 1460 C PRO A 159 -11.607 20.141 3.691 1.00 0.00 C ATOM 1461 O PRO A 159 -10.881 20.856 4.382 1.00 0.00 O ATOM 1462 CB PRO A 159 -12.707 18.093 4.637 1.00 0.00 C ATOM 1463 CG PRO A 159 -12.161 17.967 6.017 1.00 0.00 C ATOM 1464 CD PRO A 159 -10.711 17.600 5.856 1.00 0.00 C ATOM 0 HA PRO A 159 -11.534 18.262 2.773 1.00 0.00 H new ATOM 0 HB2 PRO A 159 -13.555 18.777 4.608 1.00 0.00 H new ATOM 0 HB3 PRO A 159 -13.059 17.132 4.261 1.00 0.00 H new ATOM 0 HG2 PRO A 159 -12.268 18.902 6.566 1.00 0.00 H new ATOM 0 HG3 PRO A 159 -12.697 17.203 6.581 1.00 0.00 H new ATOM 0 HD2 PRO A 159 -10.099 18.020 6.655 1.00 0.00 H new ATOM 0 HD3 PRO A 159 -10.565 16.520 5.877 1.00 0.00 H new ATOM 1472 N ALA A 160 -12.483 20.627 2.819 1.00 0.00 N ATOM 1473 CA ALA A 160 -12.647 22.062 2.620 1.00 0.00 C ATOM 1474 C ALA A 160 -13.946 22.369 1.882 1.00 0.00 C ATOM 1475 O ALA A 160 -14.372 21.631 0.992 1.00 0.00 O ATOM 1476 CB ALA A 160 -11.458 22.629 1.858 1.00 0.00 C ATOM 0 H ALA A 160 -13.090 20.048 2.239 1.00 0.00 H new ATOM 0 HA ALA A 160 -12.696 22.536 3.600 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -11.594 23.701 1.717 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -10.544 22.451 2.425 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -11.383 22.142 0.886 1.00 0.00 H new ATOM 1482 N PRO A 161 -14.593 23.482 2.257 1.00 0.00 N ATOM 1483 CA PRO A 161 -15.852 23.911 1.643 1.00 0.00 C ATOM 1484 C PRO A 161 -15.664 24.388 0.207 1.00 0.00 C ATOM 1485 O PRO A 161 -14.709 25.101 -0.102 1.00 0.00 O ATOM 1486 CB PRO A 161 -16.306 25.069 2.536 1.00 0.00 C ATOM 1487 CG PRO A 161 -15.050 25.595 3.141 1.00 0.00 C ATOM 1488 CD PRO A 161 -14.143 24.408 3.311 1.00 0.00 C ATOM 0 HA PRO A 161 -16.573 23.096 1.579 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -16.819 25.837 1.958 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -17.002 24.729 3.302 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -14.592 26.347 2.498 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -15.249 26.074 4.100 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -13.095 24.681 3.185 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -14.241 23.966 4.303 1.00 0.00 H new ATOM 1496 N LYS A 162 -16.582 23.990 -0.668 1.00 0.00 N ATOM 1497 CA LYS A 162 -16.519 24.377 -2.072 1.00 0.00 C ATOM 1498 C LYS A 162 -17.907 24.356 -2.705 1.00 0.00 C ATOM 1499 O LYS A 162 -18.723 23.485 -2.405 1.00 0.00 O ATOM 1500 CB LYS A 162 -15.582 23.441 -2.840 1.00 0.00 C ATOM 1501 CG LYS A 162 -16.047 21.996 -2.857 1.00 0.00 C ATOM 1502 CD LYS A 162 -15.591 21.248 -1.615 1.00 0.00 C ATOM 1503 CE LYS A 162 -14.104 20.933 -1.668 1.00 0.00 C ATOM 1504 NZ LYS A 162 -13.759 19.740 -0.847 1.00 0.00 N ATOM 0 H LYS A 162 -17.379 23.399 -0.429 1.00 0.00 H new ATOM 0 HA LYS A 162 -16.130 25.394 -2.125 1.00 0.00 H new ATOM 0 HB2 LYS A 162 -15.488 23.796 -3.866 1.00 0.00 H new ATOM 0 HB3 LYS A 162 -14.588 23.489 -2.394 1.00 0.00 H new ATOM 0 HG2 LYS A 162 -17.134 21.964 -2.923 1.00 0.00 H new ATOM 0 HG3 LYS A 162 -15.658 21.498 -3.746 1.00 0.00 H new ATOM 0 HD2 LYS A 162 -15.806 21.846 -0.729 1.00 0.00 H new ATOM 0 HD3 LYS A 162 -16.157 20.321 -1.519 1.00 0.00 H new ATOM 0 HE2 LYS A 162 -13.806 20.760 -2.702 1.00 0.00 H new ATOM 0 HE3 LYS A 162 -13.538 21.794 -1.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 -12.837 19.366 -1.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 -13.711 20.011 0.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 -14.488 19.009 -0.973 1.00 0.00 H new ATOM 1518 N SER A 163 -18.166 25.319 -3.584 1.00 0.00 N ATOM 1519 CA SER A 163 -19.456 25.411 -4.258 1.00 0.00 C ATOM 1520 C SER A 163 -19.437 26.505 -5.321 1.00 0.00 C ATOM 1521 O SER A 163 -19.170 27.671 -5.026 1.00 0.00 O ATOM 1522 CB SER A 163 -20.566 25.691 -3.243 1.00 0.00 C ATOM 1523 OG SER A 163 -21.790 25.987 -3.894 1.00 0.00 O ATOM 0 H SER A 163 -17.500 26.046 -3.846 1.00 0.00 H new ATOM 0 HA SER A 163 -19.652 24.457 -4.747 1.00 0.00 H new ATOM 0 HB2 SER A 163 -20.696 24.825 -2.594 1.00 0.00 H new ATOM 0 HB3 SER A 163 -20.278 26.527 -2.606 1.00 0.00 H new ATOM 0 HG SER A 163 -22.483 26.161 -3.224 1.00 0.00 H new ATOM 1529 N THR A 164 -19.721 26.121 -6.562 1.00 0.00 N ATOM 1530 CA THR A 164 -19.735 27.066 -7.671 1.00 0.00 C ATOM 1531 C THR A 164 -20.760 26.663 -8.724 1.00 0.00 C ATOM 1532 O THR A 164 -20.664 25.588 -9.318 1.00 0.00 O ATOM 1533 CB THR A 164 -18.349 27.175 -8.334 1.00 0.00 C ATOM 1534 OG1 THR A 164 -18.337 28.259 -9.269 1.00 0.00 O ATOM 1535 CG2 THR A 164 -17.987 25.881 -9.046 1.00 0.00 C ATOM 0 H THR A 164 -19.945 25.161 -6.824 1.00 0.00 H new ATOM 0 HA THR A 164 -20.008 28.036 -7.256 1.00 0.00 H new ATOM 0 HB THR A 164 -17.611 27.361 -7.554 1.00 0.00 H new ATOM 0 HG1 THR A 164 -17.452 28.323 -9.685 1.00 0.00 H new ATOM 0 HG21 THR A 164 -17.004 25.982 -9.507 1.00 0.00 H new ATOM 0 HG22 THR A 164 -17.968 25.063 -8.326 1.00 0.00 H new ATOM 0 HG23 THR A 164 -18.729 25.670 -9.816 1.00 0.00 H new ATOM 1543 N TYR A 165 -21.739 27.531 -8.953 1.00 0.00 N ATOM 1544 CA TYR A 165 -22.783 27.263 -9.935 1.00 0.00 C ATOM 1545 C TYR A 165 -23.611 28.516 -10.204 1.00 0.00 C ATOM 1546 O TYR A 165 -24.362 28.973 -9.344 1.00 0.00 O ATOM 1547 CB TYR A 165 -23.692 26.133 -9.449 1.00 0.00 C ATOM 1548 CG TYR A 165 -24.623 26.543 -8.330 1.00 0.00 C ATOM 1549 CD1 TYR A 165 -24.132 26.848 -7.067 1.00 0.00 C ATOM 1550 CD2 TYR A 165 -25.995 26.627 -8.537 1.00 0.00 C ATOM 1551 CE1 TYR A 165 -24.979 27.222 -6.042 1.00 0.00 C ATOM 1552 CE2 TYR A 165 -26.850 27.002 -7.519 1.00 0.00 C ATOM 1553 CZ TYR A 165 -26.337 27.298 -6.273 1.00 0.00 C ATOM 1554 OH TYR A 165 -27.184 27.672 -5.255 1.00 0.00 O ATOM 0 H TYR A 165 -21.832 28.426 -8.472 1.00 0.00 H new ATOM 0 HA TYR A 165 -22.303 26.959 -10.865 1.00 0.00 H new ATOM 0 HB2 TYR A 165 -24.285 25.768 -10.288 1.00 0.00 H new ATOM 0 HB3 TYR A 165 -23.074 25.301 -9.110 1.00 0.00 H new ATOM 0 HD1 TYR A 165 -23.069 26.792 -6.883 1.00 0.00 H new ATOM 0 HD2 TYR A 165 -26.400 26.395 -9.511 1.00 0.00 H new ATOM 0 HE1 TYR A 165 -24.580 27.454 -5.065 1.00 0.00 H new ATOM 0 HE2 TYR A 165 -27.913 27.063 -7.697 1.00 0.00 H new ATOM 0 HH TYR A 165 -28.107 27.677 -5.583 1.00 0.00 H new ATOM 1564 N GLU A 166 -23.467 29.065 -11.407 1.00 0.00 N ATOM 1565 CA GLU A 166 -24.201 30.265 -11.790 1.00 0.00 C ATOM 1566 C GLU A 166 -25.266 29.941 -12.834 1.00 0.00 C ATOM 1567 O GLU A 166 -24.974 29.849 -14.026 1.00 0.00 O ATOM 1568 CB GLU A 166 -23.241 31.324 -12.337 1.00 0.00 C ATOM 1569 CG GLU A 166 -23.942 32.547 -12.903 1.00 0.00 C ATOM 1570 CD GLU A 166 -24.496 33.455 -11.822 1.00 0.00 C ATOM 1571 OE1 GLU A 166 -23.693 33.985 -11.025 1.00 0.00 O ATOM 1572 OE2 GLU A 166 -25.730 33.635 -11.773 1.00 0.00 O ATOM 0 H GLU A 166 -22.850 28.698 -12.131 1.00 0.00 H new ATOM 0 HA GLU A 166 -24.695 30.657 -10.901 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -22.568 31.638 -11.540 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -22.625 30.876 -13.116 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -23.242 33.109 -13.521 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -24.755 32.226 -13.554 1.00 0.00 H new ATOM 1579 N SER A 167 -26.502 29.769 -12.376 1.00 0.00 N ATOM 1580 CA SER A 167 -27.610 29.451 -13.268 1.00 0.00 C ATOM 1581 C SER A 167 -28.940 29.501 -12.521 1.00 0.00 C ATOM 1582 O SER A 167 -28.980 29.403 -11.296 1.00 0.00 O ATOM 1583 CB SER A 167 -27.413 28.066 -13.888 1.00 0.00 C ATOM 1584 OG SER A 167 -28.412 27.793 -14.855 1.00 0.00 O ATOM 0 H SER A 167 -26.761 29.845 -11.392 1.00 0.00 H new ATOM 0 HA SER A 167 -27.630 30.197 -14.062 1.00 0.00 H new ATOM 0 HB2 SER A 167 -26.428 28.009 -14.352 1.00 0.00 H new ATOM 0 HB3 SER A 167 -27.442 27.307 -13.106 1.00 0.00 H new ATOM 0 HG SER A 167 -28.263 26.903 -15.237 1.00 0.00 H new ATOM 1590 N ASN A 168 -30.027 29.654 -13.271 1.00 0.00 N ATOM 1591 CA ASN A 168 -31.359 29.718 -12.681 1.00 0.00 C ATOM 1592 C ASN A 168 -32.427 29.361 -13.710 1.00 0.00 C ATOM 1593 O ASN A 168 -32.245 29.571 -14.910 1.00 0.00 O ATOM 1594 CB ASN A 168 -31.624 31.116 -12.119 1.00 0.00 C ATOM 1595 CG ASN A 168 -31.804 32.154 -13.211 1.00 0.00 C ATOM 1596 OD1 ASN A 168 -32.926 32.451 -13.621 1.00 0.00 O ATOM 1597 ND2 ASN A 168 -30.696 32.709 -13.687 1.00 0.00 N ATOM 0 H ASN A 168 -30.011 29.736 -14.288 1.00 0.00 H new ATOM 0 HA ASN A 168 -31.405 28.992 -11.869 1.00 0.00 H new ATOM 0 HB2 ASN A 168 -32.517 31.090 -11.495 1.00 0.00 H new ATOM 0 HB3 ASN A 168 -30.794 31.409 -11.476 1.00 0.00 H new ATOM 0 HD21 ASN A 168 -30.754 33.413 -14.423 1.00 0.00 H new ATOM 0 HD22 ASN A 168 -29.787 32.432 -13.317 1.00 0.00 H new ATOM 1604 N THR A 169 -33.544 28.819 -13.233 1.00 0.00 N ATOM 1605 CA THR A 169 -34.641 28.432 -14.110 1.00 0.00 C ATOM 1606 C THR A 169 -35.979 28.917 -13.564 1.00 0.00 C ATOM 1607 O THR A 169 -36.280 28.743 -12.383 1.00 0.00 O ATOM 1608 CB THR A 169 -34.699 26.904 -14.296 1.00 0.00 C ATOM 1609 OG1 THR A 169 -34.891 26.263 -13.029 1.00 0.00 O ATOM 1610 CG2 THR A 169 -33.422 26.388 -14.942 1.00 0.00 C ATOM 0 H THR A 169 -33.712 28.638 -12.243 1.00 0.00 H new ATOM 0 HA THR A 169 -34.454 28.902 -15.076 1.00 0.00 H new ATOM 0 HB THR A 169 -35.538 26.672 -14.952 1.00 0.00 H new ATOM 0 HG1 THR A 169 -35.321 26.888 -12.408 1.00 0.00 H new ATOM 0 HG21 THR A 169 -33.487 25.307 -15.063 1.00 0.00 H new ATOM 0 HG22 THR A 169 -33.294 26.855 -15.918 1.00 0.00 H new ATOM 0 HG23 THR A 169 -32.569 26.632 -14.308 1.00 0.00 H new ATOM 1618 N LYS A 170 -36.780 29.527 -14.431 1.00 0.00 N ATOM 1619 CA LYS A 170 -38.088 30.037 -14.038 1.00 0.00 C ATOM 1620 C LYS A 170 -39.206 29.195 -14.645 1.00 0.00 C ATOM 1621 O LYS A 170 -40.164 28.834 -13.962 1.00 0.00 O ATOM 1622 CB LYS A 170 -38.242 31.496 -14.471 1.00 0.00 C ATOM 1623 CG LYS A 170 -39.149 32.308 -13.564 1.00 0.00 C ATOM 1624 CD LYS A 170 -40.605 32.195 -13.985 1.00 0.00 C ATOM 1625 CE LYS A 170 -41.503 33.075 -13.130 1.00 0.00 C ATOM 1626 NZ LYS A 170 -41.132 34.513 -13.233 1.00 0.00 N ATOM 0 H LYS A 170 -36.546 29.680 -15.412 1.00 0.00 H new ATOM 0 HA LYS A 170 -38.161 29.978 -12.952 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -37.258 31.963 -14.499 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -38.638 31.525 -15.486 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -39.039 31.964 -12.536 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -38.844 33.354 -13.585 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -40.705 32.480 -15.032 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -40.928 31.157 -13.905 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -42.540 32.945 -13.439 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -41.438 32.757 -12.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -41.895 35.098 -12.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -40.254 34.684 -12.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -40.987 34.763 -14.232 1.00 0.00 H new ATOM 1640 N GLN A 171 -39.075 28.885 -15.931 1.00 0.00 N ATOM 1641 CA GLN A 171 -40.074 28.084 -16.629 1.00 0.00 C ATOM 1642 C GLN A 171 -39.475 27.424 -17.866 1.00 0.00 C ATOM 1643 O GLN A 171 -38.965 28.102 -18.758 1.00 0.00 O ATOM 1644 CB GLN A 171 -41.268 28.954 -17.027 1.00 0.00 C ATOM 1645 CG GLN A 171 -42.359 29.010 -15.970 1.00 0.00 C ATOM 1646 CD GLN A 171 -43.599 29.739 -16.450 1.00 0.00 C ATOM 1647 OE1 GLN A 171 -43.607 30.329 -17.531 1.00 0.00 O ATOM 1648 NE2 GLN A 171 -44.655 29.702 -15.646 1.00 0.00 N ATOM 0 H GLN A 171 -38.288 29.176 -16.510 1.00 0.00 H new ATOM 0 HA GLN A 171 -40.414 27.301 -15.951 1.00 0.00 H new ATOM 0 HB2 GLN A 171 -40.918 29.966 -17.230 1.00 0.00 H new ATOM 0 HB3 GLN A 171 -41.692 28.571 -17.955 1.00 0.00 H new ATOM 0 HG2 GLN A 171 -42.629 27.995 -15.678 1.00 0.00 H new ATOM 0 HG3 GLN A 171 -41.972 29.506 -15.080 1.00 0.00 H new ATOM 0 HE21 GLN A 171 -44.603 29.201 -14.759 1.00 0.00 H new ATOM 0 HE22 GLN A 171 -45.518 30.175 -15.915 1.00 0.00 H new ATOM 1657 N SER A 172 -39.541 26.097 -17.914 1.00 0.00 N ATOM 1658 CA SER A 172 -39.001 25.345 -19.040 1.00 0.00 C ATOM 1659 C SER A 172 -40.121 24.676 -19.833 1.00 0.00 C ATOM 1660 O SER A 172 -41.021 24.064 -19.261 1.00 0.00 O ATOM 1661 CB SER A 172 -38.009 24.290 -18.548 1.00 0.00 C ATOM 1662 OG SER A 172 -38.659 23.303 -17.767 1.00 0.00 O ATOM 0 H SER A 172 -39.963 25.521 -17.186 1.00 0.00 H new ATOM 0 HA SER A 172 -38.481 26.044 -19.696 1.00 0.00 H new ATOM 0 HB2 SER A 172 -37.521 23.819 -19.401 1.00 0.00 H new ATOM 0 HB3 SER A 172 -37.227 24.769 -17.958 1.00 0.00 H new ATOM 0 HG SER A 172 -38.003 22.640 -17.466 1.00 0.00 H new ATOM 1668 N GLY A 173 -40.056 24.798 -21.155 1.00 0.00 N ATOM 1669 CA GLY A 173 -41.068 24.201 -22.006 1.00 0.00 C ATOM 1670 C GLY A 173 -42.413 24.889 -21.876 1.00 0.00 C ATOM 1671 O GLY A 173 -43.289 24.450 -21.131 1.00 0.00 O ATOM 0 H GLY A 173 -39.320 25.300 -21.652 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -40.739 24.247 -23.044 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -41.176 23.147 -21.752 1.00 0.00 H new ATOM 1675 N PRO A 174 -42.591 25.995 -22.614 1.00 0.00 N ATOM 1676 CA PRO A 174 -43.836 26.768 -22.594 1.00 0.00 C ATOM 1677 C PRO A 174 -44.991 26.024 -23.255 1.00 0.00 C ATOM 1678 O PRO A 174 -45.029 25.875 -24.476 1.00 0.00 O ATOM 1679 CB PRO A 174 -43.484 28.026 -23.392 1.00 0.00 C ATOM 1680 CG PRO A 174 -42.371 27.608 -24.289 1.00 0.00 C ATOM 1681 CD PRO A 174 -41.590 26.575 -23.525 1.00 0.00 C ATOM 0 HA PRO A 174 -44.174 26.971 -21.578 1.00 0.00 H new ATOM 0 HB2 PRO A 174 -44.340 28.384 -23.964 1.00 0.00 H new ATOM 0 HB3 PRO A 174 -43.178 28.839 -22.734 1.00 0.00 H new ATOM 0 HG2 PRO A 174 -42.755 27.196 -25.222 1.00 0.00 H new ATOM 0 HG3 PRO A 174 -41.741 28.458 -24.552 1.00 0.00 H new ATOM 0 HD2 PRO A 174 -41.165 25.821 -24.188 1.00 0.00 H new ATOM 0 HD3 PRO A 174 -40.760 27.022 -22.978 1.00 0.00 H new ATOM 1689 N SER A 175 -45.932 25.558 -22.440 1.00 0.00 N ATOM 1690 CA SER A 175 -47.087 24.826 -22.945 1.00 0.00 C ATOM 1691 C SER A 175 -48.386 25.426 -22.415 1.00 0.00 C ATOM 1692 O SER A 175 -48.570 25.565 -21.206 1.00 0.00 O ATOM 1693 CB SER A 175 -46.996 23.351 -22.550 1.00 0.00 C ATOM 1694 OG SER A 175 -48.128 22.630 -23.006 1.00 0.00 O ATOM 0 H SER A 175 -45.917 25.675 -21.427 1.00 0.00 H new ATOM 0 HA SER A 175 -47.088 24.905 -24.032 1.00 0.00 H new ATOM 0 HB2 SER A 175 -46.090 22.914 -22.969 1.00 0.00 H new ATOM 0 HB3 SER A 175 -46.919 23.266 -21.466 1.00 0.00 H new ATOM 0 HG SER A 175 -48.045 21.690 -22.742 1.00 0.00 H new ATOM 1700 N SER A 176 -49.283 25.781 -23.329 1.00 0.00 N ATOM 1701 CA SER A 176 -50.563 26.371 -22.955 1.00 0.00 C ATOM 1702 C SER A 176 -51.522 26.385 -24.141 1.00 0.00 C ATOM 1703 O SER A 176 -51.159 26.795 -25.243 1.00 0.00 O ATOM 1704 CB SER A 176 -50.360 27.794 -22.431 1.00 0.00 C ATOM 1705 OG SER A 176 -49.687 28.597 -23.386 1.00 0.00 O ATOM 0 H SER A 176 -49.147 25.670 -24.334 1.00 0.00 H new ATOM 0 HA SER A 176 -50.999 25.760 -22.165 1.00 0.00 H new ATOM 0 HB2 SER A 176 -51.326 28.239 -22.193 1.00 0.00 H new ATOM 0 HB3 SER A 176 -49.786 27.766 -21.505 1.00 0.00 H new ATOM 0 HG SER A 176 -49.846 28.240 -24.284 1.00 0.00 H new ATOM 1711 N GLY A 177 -52.751 25.933 -23.907 1.00 0.00 N ATOM 1712 CA GLY A 177 -53.744 25.902 -24.964 1.00 0.00 C ATOM 1713 C GLY A 177 -55.092 26.426 -24.510 1.00 0.00 C ATOM 1714 O GLY A 177 -55.175 27.475 -23.872 1.00 0.00 O ATOM 0 H GLY A 177 -53.076 25.588 -23.004 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -53.392 26.497 -25.807 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -53.857 24.879 -25.322 1.00 0.00 H new TER 1718 GLY A 177