USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=38 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 86 SER OG : rot 130:sc= -0.209 USER MOD Set 1.2: A 89 SER OG : rot -84:sc= 2.28 USER MOD Set 2.1: A 58 THR OG1 : rot -37:sc= -0.36 USER MOD Set 2.2: A 81 CYS SG : rot 48:sc= -4.93! USER MOD Set 3.1: A 26 ASN : amide:sc= -7.03! C(o=-15!,f=-28!) USER MOD Set 3.2: A 162 GLN : amide:sc= -8.03! C(o=-15!,f=-17!) USER MOD Set 4.1: A 17 THR OG1 : rot 180:sc= -0.109 USER MOD Set 4.2: A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 2 GLN :FLIP amide:sc= -0.375 F(o=-3.2!,f=-0.38) USER MOD Single : A 3 THR OG1 : rot 36:sc= -0.998 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 CYS SG : rot -43:sc= -0.0481 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot -94:sc= 0.661 USER MOD Single : A 23 TYR OH : rot 130:sc= -2.86! USER MOD Single : A 24 THR OG1 : rot -171:sc= -0.923 USER MOD Single : A 25 THR OG1 : rot 80:sc= -3.88! USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot -27:sc= 0.133 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc=-0.000703 K(o=-0.0007,f=-1.5!) USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 5:sc= 0.856 USER MOD Single : A 45 MET CE :methyl -119:sc= -0.0982 (180deg=-0.568) USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 17:sc= -2.12! USER MOD Single : A 74 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 75 THR OG1 : rot 34:sc= 1.24 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.564 X(o=-0.56,f=-0.51) USER MOD Single : A 94 LYS NZ :NH3+ 149:sc= -1.92 (180deg=-3.91!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -78:sc= 0.52! USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=-0.0053) USER MOD Single : A 104 HIS : no HD1:sc=-0.00765 X(o=-0.0076,f=-0.29) USER MOD Single : A 105 CYS SG : rot -95:sc= 0.98 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 8:sc= 1.05 USER MOD Single : A 115 THR OG1 : rot 100:sc= -1.08 USER MOD Single : A 116 GLN : amide:sc= -1.67 X(o=-1.7,f=-1.2) USER MOD Single : A 138 THR OG1 : rot 180:sc= -1.42 USER MOD Single : A 141 THR OG1 : rot 180:sc= -0.0671 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 147:sc= -0.286 (180deg=-1.4!) USER MOD Single : A 153 LYS NZ :NH3+ -163:sc= -3.89! (180deg=-4.91!) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 CYS SG : rot -22:sc= -5.23! USER MOD Single : A 158 SER OG : rot -150:sc= -0.0407 USER MOD Single : A 161 THR OG1 : rot 159:sc= -2.53! USER MOD Single : A 163 LYS NZ :NH3+ 159:sc= -0.049 (180deg=-0.457) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLN A 2 122.943 -2.702 13.759 1.00 0.00 N ATOM 21 CA GLN A 2 124.372 -2.992 13.772 1.00 0.00 C ATOM 22 C GLN A 2 125.008 -2.549 12.457 1.00 0.00 C ATOM 23 O GLN A 2 126.119 -2.026 12.439 1.00 0.00 O ATOM 24 CB GLN A 2 124.602 -4.492 13.981 1.00 0.00 C ATOM 25 CG GLN A 2 126.070 -4.741 14.326 1.00 0.00 C ATOM 26 CD GLN A 2 126.350 -4.297 15.757 1.00 0.00 C ATOM 27 OE1 GLN A 2 127.340 -3.482 15.998 1.00 0.00 O flip ATOM 28 NE2 GLN A 2 125.648 -4.704 16.683 1.00 0.00 N flip ATOM 0 HA GLN A 2 124.834 -2.444 14.593 1.00 0.00 H new ATOM 0 HB2 GLN A 2 123.962 -4.860 14.783 1.00 0.00 H new ATOM 0 HB3 GLN A 2 124.331 -5.041 13.079 1.00 0.00 H new ATOM 0 HG2 GLN A 2 126.305 -5.799 14.212 1.00 0.00 H new ATOM 0 HG3 GLN A 2 126.712 -4.196 13.635 1.00 0.00 H new ATOM 0 HE21 GLN A 2 124.874 -5.341 16.494 1.00 0.00 H new ATOM 0 HE22 GLN A 2 125.840 -4.404 17.639 1.00 0.00 H new ATOM 35 N THR A 3 124.289 -2.759 11.358 1.00 0.00 N ATOM 36 CA THR A 3 124.784 -2.374 10.045 1.00 0.00 C ATOM 37 C THR A 3 125.276 -0.935 10.073 1.00 0.00 C ATOM 38 O THR A 3 124.597 -0.045 10.588 1.00 0.00 O ATOM 39 CB THR A 3 123.666 -2.512 9.010 1.00 0.00 C ATOM 40 OG1 THR A 3 124.027 -1.808 7.830 1.00 0.00 O ATOM 41 CG2 THR A 3 122.369 -1.933 9.577 1.00 0.00 C ATOM 0 H THR A 3 123.366 -3.192 11.353 1.00 0.00 H new ATOM 0 HA THR A 3 125.612 -3.029 9.774 1.00 0.00 H new ATOM 0 HB THR A 3 123.516 -3.565 8.773 1.00 0.00 H new ATOM 0 HG1 THR A 3 124.991 -1.895 7.679 1.00 0.00 H new ATOM 0 HG21 THR A 3 121.573 -2.032 8.839 1.00 0.00 H new ATOM 0 HG22 THR A 3 122.094 -2.475 10.482 1.00 0.00 H new ATOM 0 HG23 THR A 3 122.514 -0.879 9.815 1.00 0.00 H new ATOM 46 N ILE A 4 126.463 -0.711 9.529 1.00 0.00 N ATOM 47 CA ILE A 4 127.036 0.625 9.512 1.00 0.00 C ATOM 48 C ILE A 4 127.426 1.032 8.097 1.00 0.00 C ATOM 49 O ILE A 4 127.840 0.199 7.292 1.00 0.00 O ATOM 50 CB ILE A 4 128.255 0.656 10.428 1.00 0.00 C ATOM 51 CG1 ILE A 4 128.699 2.101 10.656 1.00 0.00 C ATOM 52 CG2 ILE A 4 129.396 -0.133 9.782 1.00 0.00 C ATOM 53 CD1 ILE A 4 127.885 2.713 11.798 1.00 0.00 C ATOM 0 H ILE A 4 127.043 -1.430 9.097 1.00 0.00 H new ATOM 0 HA ILE A 4 126.291 1.336 9.869 1.00 0.00 H new ATOM 0 HB ILE A 4 127.995 0.207 11.387 1.00 0.00 H new ATOM 0 HG12 ILE A 4 129.762 2.132 10.896 1.00 0.00 H new ATOM 0 HG13 ILE A 4 128.561 2.683 9.745 1.00 0.00 H new ATOM 0 HG21 ILE A 4 130.268 -0.112 10.435 1.00 0.00 H new ATOM 0 HG22 ILE A 4 129.083 -1.166 9.628 1.00 0.00 H new ATOM 0 HG23 ILE A 4 129.651 0.316 8.822 1.00 0.00 H new ATOM 0 HD11 ILE A 4 128.202 3.743 11.960 1.00 0.00 H new ATOM 0 HD12 ILE A 4 126.826 2.696 11.540 1.00 0.00 H new ATOM 0 HD13 ILE A 4 128.046 2.137 12.709 1.00 0.00 H new ATOM 57 N LYS A 5 127.286 2.320 7.802 1.00 0.00 N ATOM 58 CA LYS A 5 127.620 2.828 6.479 1.00 0.00 C ATOM 59 C LYS A 5 129.070 3.289 6.429 1.00 0.00 C ATOM 60 O LYS A 5 129.593 3.861 7.390 1.00 0.00 O ATOM 61 CB LYS A 5 126.698 3.993 6.113 1.00 0.00 C ATOM 62 CG LYS A 5 125.269 3.478 5.929 1.00 0.00 C ATOM 63 CD LYS A 5 124.379 4.616 5.426 1.00 0.00 C ATOM 64 CE LYS A 5 122.936 4.121 5.305 1.00 0.00 C ATOM 65 NZ LYS A 5 122.244 4.279 6.615 1.00 0.00 N ATOM 0 H LYS A 5 126.946 3.025 8.456 1.00 0.00 H new ATOM 0 HA LYS A 5 127.484 2.020 5.760 1.00 0.00 H new ATOM 0 HB2 LYS A 5 126.724 4.751 6.896 1.00 0.00 H new ATOM 0 HB3 LYS A 5 127.044 4.470 5.196 1.00 0.00 H new ATOM 0 HG2 LYS A 5 125.257 2.651 5.219 1.00 0.00 H new ATOM 0 HG3 LYS A 5 124.885 3.092 6.873 1.00 0.00 H new ATOM 0 HD2 LYS A 5 124.428 5.461 6.113 1.00 0.00 H new ATOM 0 HD3 LYS A 5 124.735 4.970 4.459 1.00 0.00 H new ATOM 0 HE2 LYS A 5 122.411 4.685 4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 5 122.924 3.075 4.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 121.263 3.943 6.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 122.741 3.723 7.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 122.244 5.282 6.889 1.00 0.00 H new ATOM 79 N CYS A 6 129.714 3.034 5.298 1.00 0.00 N ATOM 80 CA CYS A 6 131.102 3.425 5.120 1.00 0.00 C ATOM 81 C CYS A 6 131.326 3.987 3.722 1.00 0.00 C ATOM 82 O CYS A 6 130.942 3.378 2.723 1.00 0.00 O ATOM 83 CB CYS A 6 132.016 2.218 5.340 1.00 0.00 C ATOM 84 SG CYS A 6 133.199 2.101 3.975 1.00 0.00 S ATOM 0 H CYS A 6 129.299 2.561 4.495 1.00 0.00 H new ATOM 0 HA CYS A 6 131.339 4.198 5.851 1.00 0.00 H new ATOM 0 HB2 CYS A 6 132.546 2.317 6.287 1.00 0.00 H new ATOM 0 HB3 CYS A 6 131.423 1.305 5.401 1.00 0.00 H new ATOM 0 HG CYS A 6 132.584 2.308 2.849 1.00 0.00 H new ATOM 90 N VAL A 7 131.965 5.143 3.657 1.00 0.00 N ATOM 91 CA VAL A 7 132.254 5.770 2.374 1.00 0.00 C ATOM 92 C VAL A 7 133.689 5.446 1.983 1.00 0.00 C ATOM 93 O VAL A 7 134.589 5.509 2.821 1.00 0.00 O ATOM 94 CB VAL A 7 132.059 7.287 2.481 1.00 0.00 C ATOM 95 CG1 VAL A 7 132.265 7.943 1.113 1.00 0.00 C ATOM 96 CG2 VAL A 7 130.640 7.580 2.974 1.00 0.00 C ATOM 0 H VAL A 7 132.292 5.665 4.470 1.00 0.00 H new ATOM 0 HA VAL A 7 131.575 5.389 1.611 1.00 0.00 H new ATOM 0 HB VAL A 7 132.788 7.692 3.183 1.00 0.00 H new ATOM 0 HG11 VAL A 7 132.124 9.020 1.201 1.00 0.00 H new ATOM 0 HG12 VAL A 7 133.275 7.737 0.759 1.00 0.00 H new ATOM 0 HG13 VAL A 7 131.543 7.539 0.403 1.00 0.00 H new ATOM 0 HG21 VAL A 7 130.497 8.658 3.052 1.00 0.00 H new ATOM 0 HG22 VAL A 7 129.918 7.168 2.269 1.00 0.00 H new ATOM 0 HG23 VAL A 7 130.493 7.123 3.953 1.00 0.00 H new ATOM 100 N VAL A 8 133.909 5.074 0.724 1.00 0.00 N ATOM 101 CA VAL A 8 135.251 4.725 0.297 1.00 0.00 C ATOM 102 C VAL A 8 135.915 5.892 -0.424 1.00 0.00 C ATOM 103 O VAL A 8 135.330 6.508 -1.313 1.00 0.00 O ATOM 104 CB VAL A 8 135.198 3.496 -0.614 1.00 0.00 C ATOM 105 CG1 VAL A 8 136.613 3.131 -1.062 1.00 0.00 C ATOM 106 CG2 VAL A 8 134.592 2.321 0.155 1.00 0.00 C ATOM 0 H VAL A 8 133.192 5.009 0.002 1.00 0.00 H new ATOM 0 HA VAL A 8 135.848 4.493 1.179 1.00 0.00 H new ATOM 0 HB VAL A 8 134.585 3.718 -1.488 1.00 0.00 H new ATOM 0 HG11 VAL A 8 136.575 2.256 -1.711 1.00 0.00 H new ATOM 0 HG12 VAL A 8 137.049 3.968 -1.607 1.00 0.00 H new ATOM 0 HG13 VAL A 8 137.225 2.909 -0.188 1.00 0.00 H new ATOM 0 HG21 VAL A 8 134.553 1.444 -0.492 1.00 0.00 H new ATOM 0 HG22 VAL A 8 135.207 2.101 1.028 1.00 0.00 H new ATOM 0 HG23 VAL A 8 133.583 2.579 0.478 1.00 0.00 H new ATOM 110 N VAL A 9 137.145 6.190 -0.020 1.00 0.00 N ATOM 111 CA VAL A 9 137.900 7.282 -0.619 1.00 0.00 C ATOM 112 C VAL A 9 139.290 6.800 -1.017 1.00 0.00 C ATOM 113 O VAL A 9 139.949 6.091 -0.260 1.00 0.00 O ATOM 114 CB VAL A 9 138.024 8.441 0.371 1.00 0.00 C ATOM 115 CG1 VAL A 9 138.743 9.612 -0.302 1.00 0.00 C ATOM 116 CG2 VAL A 9 136.628 8.884 0.814 1.00 0.00 C ATOM 0 H VAL A 9 137.639 5.690 0.719 1.00 0.00 H new ATOM 0 HA VAL A 9 137.371 7.625 -1.508 1.00 0.00 H new ATOM 0 HB VAL A 9 138.595 8.117 1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 9 138.832 10.438 0.403 1.00 0.00 H new ATOM 0 HG12 VAL A 9 139.737 9.296 -0.617 1.00 0.00 H new ATOM 0 HG13 VAL A 9 138.173 9.937 -1.172 1.00 0.00 H new ATOM 0 HG21 VAL A 9 136.715 9.710 1.520 1.00 0.00 H new ATOM 0 HG22 VAL A 9 136.056 9.208 -0.055 1.00 0.00 H new ATOM 0 HG23 VAL A 9 136.117 8.049 1.294 1.00 0.00 H new ATOM 120 N GLY A 10 139.731 7.187 -2.206 1.00 0.00 N ATOM 121 CA GLY A 10 141.046 6.779 -2.681 1.00 0.00 C ATOM 122 C GLY A 10 141.650 7.841 -3.588 1.00 0.00 C ATOM 123 O GLY A 10 141.094 8.928 -3.745 1.00 0.00 O ATOM 0 H GLY A 10 139.205 7.775 -2.852 1.00 0.00 H new ATOM 0 HA2 GLY A 10 141.705 6.603 -1.831 1.00 0.00 H new ATOM 0 HA3 GLY A 10 140.965 5.836 -3.222 1.00 0.00 H new ATOM 127 N ASP A 11 142.792 7.520 -4.183 1.00 0.00 N ATOM 128 CA ASP A 11 143.461 8.458 -5.074 1.00 0.00 C ATOM 129 C ASP A 11 142.809 8.430 -6.450 1.00 0.00 C ATOM 130 O ASP A 11 142.815 7.397 -7.119 1.00 0.00 O ATOM 131 CB ASP A 11 144.941 8.097 -5.204 1.00 0.00 C ATOM 132 CG ASP A 11 145.662 9.149 -6.038 1.00 0.00 C ATOM 133 OD1 ASP A 11 145.073 10.188 -6.283 1.00 0.00 O ATOM 134 OD2 ASP A 11 146.794 8.901 -6.420 1.00 0.00 O ATOM 0 H ASP A 11 143.270 6.627 -4.066 1.00 0.00 H new ATOM 0 HA ASP A 11 143.371 9.460 -4.654 1.00 0.00 H new ATOM 0 HB2 ASP A 11 145.396 8.030 -4.216 1.00 0.00 H new ATOM 0 HB3 ASP A 11 145.045 7.117 -5.670 1.00 0.00 H new ATOM 139 N GLY A 12 142.258 9.571 -6.864 1.00 0.00 N ATOM 140 CA GLY A 12 141.606 9.674 -8.169 1.00 0.00 C ATOM 141 C GLY A 12 141.006 8.338 -8.592 1.00 0.00 C ATOM 142 O GLY A 12 139.837 8.055 -8.331 1.00 0.00 O ATOM 0 H GLY A 12 142.250 10.432 -6.318 1.00 0.00 H new ATOM 0 HA2 GLY A 12 140.823 10.431 -8.128 1.00 0.00 H new ATOM 0 HA3 GLY A 12 142.329 10.003 -8.915 1.00 0.00 H new ATOM 146 N ALA A 13 141.823 7.522 -9.247 1.00 0.00 N ATOM 147 CA ALA A 13 141.376 6.212 -9.705 1.00 0.00 C ATOM 148 C ALA A 13 142.402 5.141 -9.346 1.00 0.00 C ATOM 149 O ALA A 13 143.599 5.415 -9.272 1.00 0.00 O ATOM 150 CB ALA A 13 141.163 6.233 -11.219 1.00 0.00 C ATOM 0 H ALA A 13 142.793 7.742 -9.472 1.00 0.00 H new ATOM 0 HA ALA A 13 140.434 5.976 -9.210 1.00 0.00 H new ATOM 0 HB1 ALA A 13 140.829 5.251 -11.553 1.00 0.00 H new ATOM 0 HB2 ALA A 13 140.408 6.978 -11.470 1.00 0.00 H new ATOM 0 HB3 ALA A 13 142.100 6.486 -11.715 1.00 0.00 H new ATOM 156 N VAL A 14 141.923 3.922 -9.124 1.00 0.00 N ATOM 157 CA VAL A 14 142.807 2.817 -8.773 1.00 0.00 C ATOM 158 C VAL A 14 142.199 1.482 -9.191 1.00 0.00 C ATOM 159 O VAL A 14 142.322 1.071 -10.345 1.00 0.00 O ATOM 160 CB VAL A 14 143.072 2.814 -7.266 1.00 0.00 C ATOM 161 CG1 VAL A 14 144.013 3.969 -6.912 1.00 0.00 C ATOM 162 CG2 VAL A 14 141.753 2.986 -6.510 1.00 0.00 C ATOM 0 H VAL A 14 140.935 3.675 -9.180 1.00 0.00 H new ATOM 0 HA VAL A 14 143.749 2.952 -9.305 1.00 0.00 H new ATOM 0 HB VAL A 14 143.531 1.867 -6.983 1.00 0.00 H new ATOM 0 HG11 VAL A 14 144.203 3.968 -5.839 1.00 0.00 H new ATOM 0 HG12 VAL A 14 144.955 3.848 -7.447 1.00 0.00 H new ATOM 0 HG13 VAL A 14 143.552 4.914 -7.198 1.00 0.00 H new ATOM 0 HG21 VAL A 14 141.946 2.983 -5.437 1.00 0.00 H new ATOM 0 HG22 VAL A 14 141.292 3.932 -6.794 1.00 0.00 H new ATOM 0 HG23 VAL A 14 141.081 2.165 -6.760 1.00 0.00 H new ATOM 166 N GLY A 15 141.545 0.806 -8.250 1.00 0.00 N ATOM 167 CA GLY A 15 140.932 -0.485 -8.550 1.00 0.00 C ATOM 168 C GLY A 15 139.544 -0.621 -7.922 1.00 0.00 C ATOM 169 O GLY A 15 139.040 -1.731 -7.765 1.00 0.00 O ATOM 0 H GLY A 15 141.427 1.124 -7.288 1.00 0.00 H new ATOM 0 HA2 GLY A 15 140.854 -0.607 -9.630 1.00 0.00 H new ATOM 0 HA3 GLY A 15 141.575 -1.285 -8.184 1.00 0.00 H new ATOM 173 N LYS A 16 138.925 0.502 -7.566 1.00 0.00 N ATOM 174 CA LYS A 16 137.601 0.475 -6.963 1.00 0.00 C ATOM 175 C LYS A 16 136.703 -0.582 -7.609 1.00 0.00 C ATOM 176 O LYS A 16 135.888 -1.207 -6.931 1.00 0.00 O ATOM 177 CB LYS A 16 136.958 1.851 -7.120 1.00 0.00 C ATOM 178 CG LYS A 16 136.734 2.138 -8.609 1.00 0.00 C ATOM 179 CD LYS A 16 136.282 3.589 -8.797 1.00 0.00 C ATOM 180 CE LYS A 16 135.781 3.787 -10.229 1.00 0.00 C ATOM 181 NZ LYS A 16 135.288 5.184 -10.393 1.00 0.00 N ATOM 0 H LYS A 16 139.319 1.435 -7.685 1.00 0.00 H new ATOM 0 HA LYS A 16 137.711 0.218 -5.909 1.00 0.00 H new ATOM 0 HB2 LYS A 16 136.009 1.885 -6.584 1.00 0.00 H new ATOM 0 HB3 LYS A 16 137.599 2.617 -6.683 1.00 0.00 H new ATOM 0 HG2 LYS A 16 137.654 1.959 -9.165 1.00 0.00 H new ATOM 0 HG3 LYS A 16 135.982 1.459 -9.010 1.00 0.00 H new ATOM 0 HD2 LYS A 16 135.490 3.829 -8.087 1.00 0.00 H new ATOM 0 HD3 LYS A 16 137.110 4.268 -8.593 1.00 0.00 H new ATOM 0 HE2 LYS A 16 136.585 3.588 -10.938 1.00 0.00 H new ATOM 0 HE3 LYS A 16 134.981 3.079 -10.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 134.947 5.320 -11.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 134.509 5.358 -9.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 136.063 5.850 -10.202 1.00 0.00 H new ATOM 195 N THR A 17 136.840 -0.768 -8.919 1.00 0.00 N ATOM 196 CA THR A 17 136.011 -1.742 -9.631 1.00 0.00 C ATOM 197 C THR A 17 136.300 -3.174 -9.177 1.00 0.00 C ATOM 198 O THR A 17 135.376 -3.944 -8.914 1.00 0.00 O ATOM 199 CB THR A 17 136.257 -1.628 -11.137 1.00 0.00 C ATOM 200 OG1 THR A 17 137.614 -1.939 -11.420 1.00 0.00 O ATOM 201 CG2 THR A 17 135.948 -0.204 -11.601 1.00 0.00 C ATOM 0 H THR A 17 137.507 -0.266 -9.505 1.00 0.00 H new ATOM 0 HA THR A 17 134.969 -1.519 -9.402 1.00 0.00 H new ATOM 0 HB THR A 17 135.608 -2.327 -11.665 1.00 0.00 H new ATOM 0 HG1 THR A 17 137.772 -1.868 -12.385 1.00 0.00 H new ATOM 0 HG21 THR A 17 136.124 -0.125 -12.674 1.00 0.00 H new ATOM 0 HG22 THR A 17 134.906 0.031 -11.386 1.00 0.00 H new ATOM 0 HG23 THR A 17 136.594 0.498 -11.075 1.00 0.00 H new ATOM 206 N CYS A 18 137.577 -3.530 -9.089 1.00 0.00 N ATOM 207 CA CYS A 18 137.956 -4.878 -8.670 1.00 0.00 C ATOM 208 C CYS A 18 137.870 -5.018 -7.154 1.00 0.00 C ATOM 209 O CYS A 18 137.498 -6.071 -6.633 1.00 0.00 O ATOM 210 CB CYS A 18 139.381 -5.187 -9.131 1.00 0.00 C ATOM 211 SG CYS A 18 139.438 -5.203 -10.940 1.00 0.00 S ATOM 0 H CYS A 18 138.361 -2.913 -9.299 1.00 0.00 H new ATOM 0 HA CYS A 18 137.263 -5.585 -9.127 1.00 0.00 H new ATOM 0 HB2 CYS A 18 140.071 -4.439 -8.741 1.00 0.00 H new ATOM 0 HB3 CYS A 18 139.701 -6.152 -8.738 1.00 0.00 H new ATOM 0 HG CYS A 18 140.649 -5.463 -11.334 1.00 0.00 H new ATOM 217 N LEU A 19 138.215 -3.945 -6.456 1.00 0.00 N ATOM 218 CA LEU A 19 138.179 -3.943 -5.000 1.00 0.00 C ATOM 219 C LEU A 19 136.774 -4.264 -4.500 1.00 0.00 C ATOM 220 O LEU A 19 136.606 -5.001 -3.530 1.00 0.00 O ATOM 221 CB LEU A 19 138.611 -2.570 -4.477 1.00 0.00 C ATOM 222 CG LEU A 19 138.752 -2.611 -2.954 1.00 0.00 C ATOM 223 CD1 LEU A 19 140.110 -3.208 -2.578 1.00 0.00 C ATOM 224 CD2 LEU A 19 138.653 -1.188 -2.398 1.00 0.00 C ATOM 0 H LEU A 19 138.522 -3.066 -6.873 1.00 0.00 H new ATOM 0 HA LEU A 19 138.864 -4.707 -4.632 1.00 0.00 H new ATOM 0 HB2 LEU A 19 139.559 -2.281 -4.931 1.00 0.00 H new ATOM 0 HB3 LEU A 19 137.878 -1.816 -4.762 1.00 0.00 H new ATOM 0 HG LEU A 19 137.957 -3.227 -2.533 1.00 0.00 H new ATOM 0 HD11 LEU A 19 140.207 -3.236 -1.493 1.00 0.00 H new ATOM 0 HD12 LEU A 19 140.185 -4.220 -2.975 1.00 0.00 H new ATOM 0 HD13 LEU A 19 140.906 -2.594 -2.998 1.00 0.00 H new ATOM 0 HD21 LEU A 19 138.753 -1.214 -1.313 1.00 0.00 H new ATOM 0 HD22 LEU A 19 139.449 -0.576 -2.822 1.00 0.00 H new ATOM 0 HD23 LEU A 19 137.686 -0.760 -2.663 1.00 0.00 H new ATOM 230 N LEU A 20 135.769 -3.710 -5.169 1.00 0.00 N ATOM 231 CA LEU A 20 134.385 -3.946 -4.784 1.00 0.00 C ATOM 232 C LEU A 20 134.065 -5.437 -4.840 1.00 0.00 C ATOM 233 O LEU A 20 133.334 -5.959 -3.999 1.00 0.00 O ATOM 234 CB LEU A 20 133.451 -3.190 -5.729 1.00 0.00 C ATOM 235 CG LEU A 20 132.015 -3.279 -5.209 1.00 0.00 C ATOM 236 CD1 LEU A 20 131.871 -2.440 -3.936 1.00 0.00 C ATOM 237 CD2 LEU A 20 131.060 -2.748 -6.280 1.00 0.00 C ATOM 0 H LEU A 20 135.887 -3.098 -5.976 1.00 0.00 H new ATOM 0 HA LEU A 20 134.241 -3.590 -3.764 1.00 0.00 H new ATOM 0 HB2 LEU A 20 133.758 -2.147 -5.803 1.00 0.00 H new ATOM 0 HB3 LEU A 20 133.512 -3.612 -6.732 1.00 0.00 H new ATOM 0 HG LEU A 20 131.775 -4.318 -4.982 1.00 0.00 H new ATOM 0 HD11 LEU A 20 130.846 -2.507 -3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 20 132.554 -2.815 -3.174 1.00 0.00 H new ATOM 0 HD13 LEU A 20 132.110 -1.400 -4.157 1.00 0.00 H new ATOM 0 HD21 LEU A 20 130.035 -2.809 -5.916 1.00 0.00 H new ATOM 0 HD22 LEU A 20 131.305 -1.710 -6.503 1.00 0.00 H new ATOM 0 HD23 LEU A 20 131.159 -3.347 -7.185 1.00 0.00 H new ATOM 243 N ILE A 21 134.621 -6.112 -5.840 1.00 0.00 N ATOM 244 CA ILE A 21 134.395 -7.543 -6.009 1.00 0.00 C ATOM 245 C ILE A 21 135.097 -8.338 -4.910 1.00 0.00 C ATOM 246 O ILE A 21 135.012 -9.565 -4.874 1.00 0.00 O ATOM 247 CB ILE A 21 134.911 -7.993 -7.375 1.00 0.00 C ATOM 248 CG1 ILE A 21 134.147 -7.254 -8.477 1.00 0.00 C ATOM 249 CG2 ILE A 21 134.700 -9.501 -7.529 1.00 0.00 C ATOM 250 CD1 ILE A 21 134.781 -7.563 -9.834 1.00 0.00 C ATOM 0 H ILE A 21 135.229 -5.693 -6.544 1.00 0.00 H new ATOM 0 HA ILE A 21 133.323 -7.730 -5.943 1.00 0.00 H new ATOM 0 HB ILE A 21 135.974 -7.766 -7.455 1.00 0.00 H new ATOM 0 HG12 ILE A 21 133.100 -7.558 -8.475 1.00 0.00 H new ATOM 0 HG13 ILE A 21 134.167 -6.180 -8.291 1.00 0.00 H new ATOM 0 HG21 ILE A 21 135.068 -9.822 -8.503 1.00 0.00 H new ATOM 0 HG22 ILE A 21 135.244 -10.027 -6.744 1.00 0.00 H new ATOM 0 HG23 ILE A 21 133.637 -9.730 -7.449 1.00 0.00 H new ATOM 0 HD11 ILE A 21 134.237 -7.037 -10.618 1.00 0.00 H new ATOM 0 HD12 ILE A 21 135.821 -7.237 -9.832 1.00 0.00 H new ATOM 0 HD13 ILE A 21 134.738 -8.636 -10.020 1.00 0.00 H new ATOM 254 N SER A 22 135.802 -7.627 -4.035 1.00 0.00 N ATOM 255 CA SER A 22 136.543 -8.260 -2.946 1.00 0.00 C ATOM 256 C SER A 22 135.886 -9.565 -2.502 1.00 0.00 C ATOM 257 O SER A 22 136.351 -10.647 -2.862 1.00 0.00 O ATOM 258 CB SER A 22 136.559 -7.293 -1.770 1.00 0.00 C ATOM 259 OG SER A 22 135.553 -6.308 -1.967 1.00 0.00 O ATOM 0 H SER A 22 135.876 -6.610 -4.058 1.00 0.00 H new ATOM 0 HA SER A 22 137.550 -8.492 -3.292 1.00 0.00 H new ATOM 0 HB2 SER A 22 136.382 -7.830 -0.838 1.00 0.00 H new ATOM 0 HB3 SER A 22 137.537 -6.820 -1.685 1.00 0.00 H new ATOM 0 HG SER A 22 135.945 -5.523 -2.404 1.00 0.00 H new ATOM 265 N TYR A 23 134.807 -9.472 -1.728 1.00 0.00 N ATOM 266 CA TYR A 23 134.118 -10.676 -1.265 1.00 0.00 C ATOM 267 C TYR A 23 132.899 -10.994 -2.132 1.00 0.00 C ATOM 268 O TYR A 23 132.316 -12.072 -2.016 1.00 0.00 O ATOM 269 CB TYR A 23 133.645 -10.480 0.172 1.00 0.00 C ATOM 270 CG TYR A 23 132.173 -10.149 0.163 1.00 0.00 C ATOM 271 CD1 TYR A 23 131.741 -8.883 -0.247 1.00 0.00 C ATOM 272 CD2 TYR A 23 131.240 -11.113 0.560 1.00 0.00 C ATOM 273 CE1 TYR A 23 130.374 -8.582 -0.261 1.00 0.00 C ATOM 274 CE2 TYR A 23 129.875 -10.812 0.547 1.00 0.00 C ATOM 275 CZ TYR A 23 129.441 -9.547 0.136 1.00 0.00 C ATOM 276 OH TYR A 23 128.094 -9.252 0.120 1.00 0.00 O ATOM 0 H TYR A 23 134.396 -8.593 -1.412 1.00 0.00 H new ATOM 0 HA TYR A 23 134.825 -11.503 -1.330 1.00 0.00 H new ATOM 0 HB2 TYR A 23 133.824 -11.384 0.754 1.00 0.00 H new ATOM 0 HB3 TYR A 23 134.209 -9.678 0.648 1.00 0.00 H new ATOM 0 HD1 TYR A 23 132.462 -8.139 -0.552 1.00 0.00 H new ATOM 0 HD2 TYR A 23 131.574 -12.090 0.877 1.00 0.00 H new ATOM 0 HE1 TYR A 23 130.039 -7.605 -0.578 1.00 0.00 H new ATOM 0 HE2 TYR A 23 129.155 -11.556 0.854 1.00 0.00 H new ATOM 0 HH TYR A 23 127.610 -9.960 -0.353 1.00 0.00 H new ATOM 286 N THR A 24 132.497 -10.048 -2.974 1.00 0.00 N ATOM 287 CA THR A 24 131.321 -10.248 -3.820 1.00 0.00 C ATOM 288 C THR A 24 131.375 -11.596 -4.534 1.00 0.00 C ATOM 289 O THR A 24 130.407 -12.356 -4.514 1.00 0.00 O ATOM 290 CB THR A 24 131.230 -9.133 -4.862 1.00 0.00 C ATOM 291 OG1 THR A 24 131.683 -7.913 -4.292 1.00 0.00 O ATOM 292 CG2 THR A 24 129.779 -8.973 -5.317 1.00 0.00 C ATOM 0 H THR A 24 132.959 -9.146 -3.090 1.00 0.00 H new ATOM 0 HA THR A 24 130.442 -10.229 -3.176 1.00 0.00 H new ATOM 0 HB THR A 24 131.853 -9.388 -5.719 1.00 0.00 H new ATOM 0 HG1 THR A 24 131.494 -7.174 -4.907 1.00 0.00 H new ATOM 0 HG21 THR A 24 129.716 -8.178 -6.060 1.00 0.00 H new ATOM 0 HG22 THR A 24 129.430 -9.908 -5.756 1.00 0.00 H new ATOM 0 HG23 THR A 24 129.155 -8.719 -4.460 1.00 0.00 H new ATOM 297 N THR A 25 132.508 -11.892 -5.162 1.00 0.00 N ATOM 298 CA THR A 25 132.661 -13.158 -5.871 1.00 0.00 C ATOM 299 C THR A 25 133.997 -13.802 -5.531 1.00 0.00 C ATOM 300 O THR A 25 134.207 -14.988 -5.788 1.00 0.00 O ATOM 301 CB THR A 25 132.577 -12.925 -7.381 1.00 0.00 C ATOM 302 OG1 THR A 25 133.582 -12.001 -7.771 1.00 0.00 O ATOM 303 CG2 THR A 25 131.199 -12.367 -7.737 1.00 0.00 C ATOM 0 H THR A 25 133.325 -11.282 -5.195 1.00 0.00 H new ATOM 0 HA THR A 25 131.857 -13.826 -5.561 1.00 0.00 H new ATOM 0 HB THR A 25 132.729 -13.869 -7.905 1.00 0.00 H new ATOM 0 HG1 THR A 25 134.442 -12.465 -7.845 1.00 0.00 H new ATOM 0 HG21 THR A 25 131.140 -12.201 -8.813 1.00 0.00 H new ATOM 0 HG22 THR A 25 130.430 -13.078 -7.437 1.00 0.00 H new ATOM 0 HG23 THR A 25 131.043 -11.423 -7.216 1.00 0.00 H new ATOM 308 N ASN A 26 134.899 -13.012 -4.962 1.00 0.00 N ATOM 309 CA ASN A 26 136.217 -13.510 -4.599 1.00 0.00 C ATOM 310 C ASN A 26 137.032 -13.763 -5.861 1.00 0.00 C ATOM 311 O ASN A 26 136.721 -14.659 -6.644 1.00 0.00 O ATOM 312 CB ASN A 26 136.094 -14.797 -3.769 1.00 0.00 C ATOM 313 CG ASN A 26 136.761 -15.963 -4.491 1.00 0.00 C ATOM 314 OD1 ASN A 26 137.988 -16.029 -4.567 1.00 0.00 O ATOM 315 ND2 ASN A 26 136.022 -16.892 -5.030 1.00 0.00 N ATOM 0 H ASN A 26 134.742 -12.028 -4.743 1.00 0.00 H new ATOM 0 HA ASN A 26 136.727 -12.762 -3.991 1.00 0.00 H new ATOM 0 HB2 ASN A 26 136.557 -14.653 -2.793 1.00 0.00 H new ATOM 0 HB3 ASN A 26 135.043 -15.024 -3.593 1.00 0.00 H new ATOM 0 HD21 ASN A 26 136.460 -17.675 -5.515 1.00 0.00 H new ATOM 0 HD22 ASN A 26 135.006 -16.836 -4.966 1.00 0.00 H new ATOM 320 N LYS A 27 138.065 -12.950 -6.060 1.00 0.00 N ATOM 321 CA LYS A 27 138.917 -13.077 -7.237 1.00 0.00 C ATOM 322 C LYS A 27 138.089 -12.963 -8.517 1.00 0.00 C ATOM 323 O LYS A 27 137.003 -13.532 -8.623 1.00 0.00 O ATOM 324 CB LYS A 27 139.674 -14.414 -7.191 1.00 0.00 C ATOM 325 CG LYS A 27 139.186 -15.352 -8.299 1.00 0.00 C ATOM 326 CD LYS A 27 139.868 -16.712 -8.147 1.00 0.00 C ATOM 327 CE LYS A 27 139.543 -17.586 -9.360 1.00 0.00 C ATOM 328 NZ LYS A 27 140.803 -17.947 -10.069 1.00 0.00 N ATOM 0 H LYS A 27 138.332 -12.199 -5.424 1.00 0.00 H new ATOM 0 HA LYS A 27 139.644 -12.265 -7.237 1.00 0.00 H new ATOM 0 HB2 LYS A 27 140.743 -14.236 -7.304 1.00 0.00 H new ATOM 0 HB3 LYS A 27 139.530 -14.886 -6.219 1.00 0.00 H new ATOM 0 HG2 LYS A 27 138.104 -15.467 -8.243 1.00 0.00 H new ATOM 0 HG3 LYS A 27 139.411 -14.927 -9.277 1.00 0.00 H new ATOM 0 HD2 LYS A 27 140.947 -16.582 -8.058 1.00 0.00 H new ATOM 0 HD3 LYS A 27 139.530 -17.200 -7.233 1.00 0.00 H new ATOM 0 HE2 LYS A 27 139.022 -18.489 -9.041 1.00 0.00 H new ATOM 0 HE3 LYS A 27 138.874 -17.053 -10.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 140.580 -18.541 -10.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 141.283 -17.081 -10.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 141.427 -18.472 -9.423 1.00 0.00 H new ATOM 342 N LEU A 28 138.611 -12.214 -9.485 1.00 0.00 N ATOM 343 CA LEU A 28 137.917 -12.023 -10.755 1.00 0.00 C ATOM 344 C LEU A 28 138.713 -11.071 -11.657 1.00 0.00 C ATOM 345 O LEU A 28 138.843 -9.888 -11.338 1.00 0.00 O ATOM 346 CB LEU A 28 136.525 -11.433 -10.506 1.00 0.00 C ATOM 347 CG LEU A 28 135.467 -12.339 -11.141 1.00 0.00 C ATOM 348 CD1 LEU A 28 134.073 -11.773 -10.860 1.00 0.00 C ATOM 349 CD2 LEU A 28 135.691 -12.404 -12.653 1.00 0.00 C ATOM 0 H LEU A 28 139.507 -11.732 -9.415 1.00 0.00 H new ATOM 0 HA LEU A 28 137.822 -12.991 -11.247 1.00 0.00 H new ATOM 0 HB2 LEU A 28 136.344 -11.339 -9.435 1.00 0.00 H new ATOM 0 HB3 LEU A 28 136.462 -10.430 -10.929 1.00 0.00 H new ATOM 0 HG LEU A 28 135.547 -13.340 -10.716 1.00 0.00 H new ATOM 0 HD11 LEU A 28 133.320 -12.419 -11.312 1.00 0.00 H new ATOM 0 HD12 LEU A 28 133.910 -11.725 -9.783 1.00 0.00 H new ATOM 0 HD13 LEU A 28 133.995 -10.772 -11.284 1.00 0.00 H new ATOM 0 HD21 LEU A 28 134.938 -13.049 -13.105 1.00 0.00 H new ATOM 0 HD22 LEU A 28 135.612 -11.402 -13.076 1.00 0.00 H new ATOM 0 HD23 LEU A 28 136.683 -12.807 -12.857 1.00 0.00 H new ATOM 355 N PRO A 29 139.249 -11.540 -12.763 1.00 0.00 N ATOM 356 CA PRO A 29 140.038 -10.675 -13.687 1.00 0.00 C ATOM 357 C PRO A 29 139.343 -9.346 -13.972 1.00 0.00 C ATOM 358 O PRO A 29 138.115 -9.260 -13.974 1.00 0.00 O ATOM 359 CB PRO A 29 140.156 -11.510 -14.962 1.00 0.00 C ATOM 360 CG PRO A 29 140.041 -12.928 -14.518 1.00 0.00 C ATOM 361 CD PRO A 29 139.172 -12.928 -13.258 1.00 0.00 C ATOM 0 HA PRO A 29 141.003 -10.403 -13.260 1.00 0.00 H new ATOM 0 HB2 PRO A 29 139.369 -11.256 -15.672 1.00 0.00 H new ATOM 0 HB3 PRO A 29 141.108 -11.331 -15.462 1.00 0.00 H new ATOM 0 HG2 PRO A 29 139.591 -13.542 -15.298 1.00 0.00 H new ATOM 0 HG3 PRO A 29 141.025 -13.349 -14.309 1.00 0.00 H new ATOM 0 HD2 PRO A 29 138.145 -13.214 -13.483 1.00 0.00 H new ATOM 0 HD3 PRO A 29 139.545 -13.636 -12.518 1.00 0.00 H new ATOM 369 N SER A 30 140.144 -8.314 -14.209 1.00 0.00 N ATOM 370 CA SER A 30 139.614 -6.986 -14.495 1.00 0.00 C ATOM 371 C SER A 30 138.703 -7.014 -15.719 1.00 0.00 C ATOM 372 O SER A 30 137.909 -6.097 -15.932 1.00 0.00 O ATOM 373 CB SER A 30 140.765 -6.010 -14.737 1.00 0.00 C ATOM 374 OG SER A 30 140.243 -4.697 -14.896 1.00 0.00 O ATOM 0 H SER A 30 141.162 -8.371 -14.209 1.00 0.00 H new ATOM 0 HA SER A 30 139.029 -6.659 -13.635 1.00 0.00 H new ATOM 0 HB2 SER A 30 141.462 -6.037 -13.900 1.00 0.00 H new ATOM 0 HB3 SER A 30 141.323 -6.302 -15.626 1.00 0.00 H new ATOM 0 HG SER A 30 139.329 -4.748 -15.246 1.00 0.00 H new ATOM 380 N GLU A 31 138.830 -8.062 -16.524 1.00 0.00 N ATOM 381 CA GLU A 31 138.022 -8.189 -17.732 1.00 0.00 C ATOM 382 C GLU A 31 136.535 -8.058 -17.408 1.00 0.00 C ATOM 383 O GLU A 31 135.765 -7.527 -18.208 1.00 0.00 O ATOM 384 CB GLU A 31 138.279 -9.547 -18.390 1.00 0.00 C ATOM 385 CG GLU A 31 139.741 -9.637 -18.831 1.00 0.00 C ATOM 386 CD GLU A 31 139.986 -10.958 -19.551 1.00 0.00 C ATOM 387 OE1 GLU A 31 139.094 -11.791 -19.540 1.00 0.00 O ATOM 388 OE2 GLU A 31 141.061 -11.119 -20.105 1.00 0.00 O ATOM 0 H GLU A 31 139.480 -8.832 -16.364 1.00 0.00 H new ATOM 0 HA GLU A 31 138.304 -7.389 -18.416 1.00 0.00 H new ATOM 0 HB2 GLU A 31 138.050 -10.350 -17.690 1.00 0.00 H new ATOM 0 HB3 GLU A 31 137.621 -9.676 -19.249 1.00 0.00 H new ATOM 0 HG2 GLU A 31 139.983 -8.803 -19.490 1.00 0.00 H new ATOM 0 HG3 GLU A 31 140.397 -9.558 -17.964 1.00 0.00 H new ATOM 395 N TYR A 32 136.135 -8.542 -16.236 1.00 0.00 N ATOM 396 CA TYR A 32 134.734 -8.466 -15.834 1.00 0.00 C ATOM 397 C TYR A 32 134.581 -7.658 -14.549 1.00 0.00 C ATOM 398 O TYR A 32 135.231 -7.945 -13.543 1.00 0.00 O ATOM 399 CB TYR A 32 134.176 -9.872 -15.618 1.00 0.00 C ATOM 400 CG TYR A 32 132.705 -9.783 -15.289 1.00 0.00 C ATOM 401 CD1 TYR A 32 131.759 -9.751 -16.319 1.00 0.00 C ATOM 402 CD2 TYR A 32 132.289 -9.734 -13.954 1.00 0.00 C ATOM 403 CE1 TYR A 32 130.395 -9.668 -16.015 1.00 0.00 C ATOM 404 CE2 TYR A 32 130.925 -9.651 -13.649 1.00 0.00 C ATOM 405 CZ TYR A 32 129.978 -9.619 -14.680 1.00 0.00 C ATOM 406 OH TYR A 32 128.634 -9.538 -14.379 1.00 0.00 O ATOM 0 H TYR A 32 136.752 -8.986 -15.555 1.00 0.00 H new ATOM 0 HA TYR A 32 134.179 -7.969 -16.629 1.00 0.00 H new ATOM 0 HB2 TYR A 32 134.324 -10.475 -16.514 1.00 0.00 H new ATOM 0 HB3 TYR A 32 134.712 -10.367 -14.808 1.00 0.00 H new ATOM 0 HD1 TYR A 32 132.081 -9.790 -17.349 1.00 0.00 H new ATOM 0 HD2 TYR A 32 133.020 -9.760 -13.159 1.00 0.00 H new ATOM 0 HE1 TYR A 32 129.665 -9.642 -16.810 1.00 0.00 H new ATOM 0 HE2 TYR A 32 130.603 -9.612 -12.619 1.00 0.00 H new ATOM 0 HH TYR A 32 128.518 -9.514 -13.406 1.00 0.00 H new ATOM 416 N VAL A 33 133.710 -6.652 -14.588 1.00 0.00 N ATOM 417 CA VAL A 33 133.471 -5.810 -13.420 1.00 0.00 C ATOM 418 C VAL A 33 132.034 -5.287 -13.426 1.00 0.00 C ATOM 419 O VAL A 33 131.396 -5.219 -14.477 1.00 0.00 O ATOM 420 CB VAL A 33 134.447 -4.632 -13.419 1.00 0.00 C ATOM 421 CG1 VAL A 33 135.626 -4.939 -12.492 1.00 0.00 C ATOM 422 CG2 VAL A 33 134.966 -4.400 -14.840 1.00 0.00 C ATOM 0 H VAL A 33 133.161 -6.402 -15.411 1.00 0.00 H new ATOM 0 HA VAL A 33 133.625 -6.408 -12.522 1.00 0.00 H new ATOM 0 HB VAL A 33 133.933 -3.738 -13.066 1.00 0.00 H new ATOM 0 HG11 VAL A 33 136.319 -4.098 -12.494 1.00 0.00 H new ATOM 0 HG12 VAL A 33 135.259 -5.104 -11.479 1.00 0.00 H new ATOM 0 HG13 VAL A 33 136.141 -5.834 -12.842 1.00 0.00 H new ATOM 0 HG21 VAL A 33 135.662 -3.561 -14.841 1.00 0.00 H new ATOM 0 HG22 VAL A 33 135.478 -5.296 -15.191 1.00 0.00 H new ATOM 0 HG23 VAL A 33 134.129 -4.178 -15.501 1.00 0.00 H new ATOM 426 N PRO A 34 131.520 -4.915 -12.281 1.00 0.00 N ATOM 427 CA PRO A 34 130.130 -4.383 -12.156 1.00 0.00 C ATOM 428 C PRO A 34 130.006 -2.971 -12.728 1.00 0.00 C ATOM 429 O PRO A 34 129.763 -2.010 -11.997 1.00 0.00 O ATOM 430 CB PRO A 34 129.877 -4.388 -10.646 1.00 0.00 C ATOM 431 CG PRO A 34 131.228 -4.282 -10.020 1.00 0.00 C ATOM 432 CD PRO A 34 132.207 -4.960 -10.979 1.00 0.00 C ATOM 0 HA PRO A 34 129.408 -4.979 -12.714 1.00 0.00 H new ATOM 0 HB2 PRO A 34 129.240 -3.554 -10.351 1.00 0.00 H new ATOM 0 HB3 PRO A 34 129.370 -5.301 -10.335 1.00 0.00 H new ATOM 0 HG2 PRO A 34 131.501 -3.239 -9.861 1.00 0.00 H new ATOM 0 HG3 PRO A 34 131.242 -4.767 -9.044 1.00 0.00 H new ATOM 0 HD2 PRO A 34 133.161 -4.434 -11.013 1.00 0.00 H new ATOM 0 HD3 PRO A 34 132.419 -5.985 -10.675 1.00 0.00 H new ATOM 440 N THR A 35 130.181 -2.855 -14.041 1.00 0.00 N ATOM 441 CA THR A 35 130.094 -1.559 -14.706 1.00 0.00 C ATOM 442 C THR A 35 128.643 -1.115 -14.863 1.00 0.00 C ATOM 443 O THR A 35 128.370 0.054 -15.135 1.00 0.00 O ATOM 444 CB THR A 35 130.756 -1.636 -16.084 1.00 0.00 C ATOM 445 OG1 THR A 35 130.000 -2.496 -16.924 1.00 0.00 O ATOM 446 CG2 THR A 35 132.176 -2.182 -15.940 1.00 0.00 C ATOM 0 H THR A 35 130.383 -3.638 -14.663 1.00 0.00 H new ATOM 0 HA THR A 35 130.613 -0.827 -14.087 1.00 0.00 H new ATOM 0 HB THR A 35 130.795 -0.640 -16.524 1.00 0.00 H new ATOM 0 HG1 THR A 35 130.422 -2.545 -17.807 1.00 0.00 H new ATOM 0 HG21 THR A 35 132.646 -2.236 -16.922 1.00 0.00 H new ATOM 0 HG22 THR A 35 132.756 -1.521 -15.296 1.00 0.00 H new ATOM 0 HG23 THR A 35 132.140 -3.178 -15.499 1.00 0.00 H new ATOM 451 N VAL A 36 127.713 -2.052 -14.701 1.00 0.00 N ATOM 452 CA VAL A 36 126.296 -1.733 -14.842 1.00 0.00 C ATOM 453 C VAL A 36 125.876 -0.668 -13.832 1.00 0.00 C ATOM 454 O VAL A 36 125.171 0.279 -14.180 1.00 0.00 O ATOM 455 CB VAL A 36 125.452 -2.992 -14.636 1.00 0.00 C ATOM 456 CG1 VAL A 36 123.968 -2.617 -14.631 1.00 0.00 C ATOM 457 CG2 VAL A 36 125.723 -3.978 -15.774 1.00 0.00 C ATOM 0 H VAL A 36 127.911 -3.027 -14.475 1.00 0.00 H new ATOM 0 HA VAL A 36 126.134 -1.345 -15.848 1.00 0.00 H new ATOM 0 HB VAL A 36 125.714 -3.453 -13.684 1.00 0.00 H new ATOM 0 HG11 VAL A 36 123.367 -3.514 -14.484 1.00 0.00 H new ATOM 0 HG12 VAL A 36 123.773 -1.913 -13.822 1.00 0.00 H new ATOM 0 HG13 VAL A 36 123.706 -2.156 -15.583 1.00 0.00 H new ATOM 0 HG21 VAL A 36 125.122 -4.876 -15.628 1.00 0.00 H new ATOM 0 HG22 VAL A 36 125.461 -3.516 -16.726 1.00 0.00 H new ATOM 0 HG23 VAL A 36 126.780 -4.246 -15.780 1.00 0.00 H new ATOM 461 N PHE A 37 126.314 -0.825 -12.587 1.00 0.00 N ATOM 462 CA PHE A 37 125.972 0.136 -11.542 1.00 0.00 C ATOM 463 C PHE A 37 126.690 -0.206 -10.239 1.00 0.00 C ATOM 464 O PHE A 37 126.573 -1.321 -9.729 1.00 0.00 O ATOM 465 CB PHE A 37 124.459 0.137 -11.309 1.00 0.00 C ATOM 466 CG PHE A 37 124.093 1.237 -10.344 1.00 0.00 C ATOM 467 CD1 PHE A 37 123.933 2.550 -10.804 1.00 0.00 C ATOM 468 CD2 PHE A 37 123.910 0.944 -8.987 1.00 0.00 C ATOM 469 CE1 PHE A 37 123.590 3.569 -9.908 1.00 0.00 C ATOM 470 CE2 PHE A 37 123.567 1.964 -8.090 1.00 0.00 C ATOM 471 CZ PHE A 37 123.406 3.276 -8.551 1.00 0.00 C ATOM 0 H PHE A 37 126.901 -1.600 -12.278 1.00 0.00 H new ATOM 0 HA PHE A 37 126.291 1.126 -11.868 1.00 0.00 H new ATOM 0 HB2 PHE A 37 123.936 0.281 -12.254 1.00 0.00 H new ATOM 0 HB3 PHE A 37 124.142 -0.828 -10.913 1.00 0.00 H new ATOM 0 HD1 PHE A 37 124.074 2.776 -11.851 1.00 0.00 H new ATOM 0 HD2 PHE A 37 124.033 -0.068 -8.632 1.00 0.00 H new ATOM 0 HE1 PHE A 37 123.467 4.582 -10.263 1.00 0.00 H new ATOM 0 HE2 PHE A 37 123.427 1.738 -7.043 1.00 0.00 H new ATOM 0 HZ PHE A 37 123.140 4.062 -7.860 1.00 0.00 H new ATOM 481 N ASP A 38 127.431 0.760 -9.705 1.00 0.00 N ATOM 482 CA ASP A 38 128.165 0.553 -8.461 1.00 0.00 C ATOM 483 C ASP A 38 127.213 0.538 -7.267 1.00 0.00 C ATOM 484 O ASP A 38 126.220 1.266 -7.244 1.00 0.00 O ATOM 485 CB ASP A 38 129.204 1.661 -8.278 1.00 0.00 C ATOM 486 CG ASP A 38 130.280 1.545 -9.352 1.00 0.00 C ATOM 487 OD1 ASP A 38 130.295 0.538 -10.042 1.00 0.00 O ATOM 488 OD2 ASP A 38 131.073 2.465 -9.472 1.00 0.00 O ATOM 0 H ASP A 38 127.539 1.689 -10.112 1.00 0.00 H new ATOM 0 HA ASP A 38 128.669 -0.412 -8.516 1.00 0.00 H new ATOM 0 HB2 ASP A 38 128.722 2.637 -8.337 1.00 0.00 H new ATOM 0 HB3 ASP A 38 129.656 1.588 -7.289 1.00 0.00 H new ATOM 493 N ASN A 39 127.520 -0.299 -6.280 1.00 0.00 N ATOM 494 CA ASN A 39 126.681 -0.406 -5.091 1.00 0.00 C ATOM 495 C ASN A 39 127.400 0.147 -3.862 1.00 0.00 C ATOM 496 O ASN A 39 128.602 0.408 -3.896 1.00 0.00 O ATOM 497 CB ASN A 39 126.304 -1.869 -4.853 1.00 0.00 C ATOM 498 CG ASN A 39 125.447 -2.378 -6.008 1.00 0.00 C ATOM 499 OD1 ASN A 39 124.883 -1.584 -6.759 1.00 0.00 O ATOM 500 ND2 ASN A 39 125.314 -3.663 -6.195 1.00 0.00 N ATOM 0 H ASN A 39 128.338 -0.909 -6.279 1.00 0.00 H new ATOM 0 HA ASN A 39 125.778 0.183 -5.255 1.00 0.00 H new ATOM 0 HB2 ASN A 39 127.205 -2.476 -4.762 1.00 0.00 H new ATOM 0 HB3 ASN A 39 125.759 -1.965 -3.914 1.00 0.00 H new ATOM 0 HD21 ASN A 39 124.742 -4.010 -6.965 1.00 0.00 H new ATOM 0 HD22 ASN A 39 125.782 -4.320 -5.571 1.00 0.00 H new ATOM 505 N TYR A 40 126.650 0.316 -2.777 1.00 0.00 N ATOM 506 CA TYR A 40 127.202 0.830 -1.539 1.00 0.00 C ATOM 507 C TYR A 40 126.340 0.369 -0.373 1.00 0.00 C ATOM 508 O TYR A 40 126.148 1.092 0.603 1.00 0.00 O ATOM 509 CB TYR A 40 127.257 2.360 -1.577 1.00 0.00 C ATOM 510 CG TYR A 40 125.863 2.922 -1.431 1.00 0.00 C ATOM 511 CD1 TYR A 40 125.004 2.955 -2.536 1.00 0.00 C ATOM 512 CD2 TYR A 40 125.428 3.407 -0.191 1.00 0.00 C ATOM 513 CE1 TYR A 40 123.710 3.473 -2.401 1.00 0.00 C ATOM 514 CE2 TYR A 40 124.135 3.924 -0.057 1.00 0.00 C ATOM 515 CZ TYR A 40 123.276 3.957 -1.160 1.00 0.00 C ATOM 516 OH TYR A 40 122.000 4.466 -1.027 1.00 0.00 O ATOM 0 H TYR A 40 125.654 0.102 -2.736 1.00 0.00 H new ATOM 0 HA TYR A 40 128.216 0.450 -1.414 1.00 0.00 H new ATOM 0 HB2 TYR A 40 127.895 2.731 -0.775 1.00 0.00 H new ATOM 0 HB3 TYR A 40 127.698 2.695 -2.516 1.00 0.00 H new ATOM 0 HD1 TYR A 40 125.339 2.581 -3.492 1.00 0.00 H new ATOM 0 HD2 TYR A 40 126.091 3.382 0.661 1.00 0.00 H new ATOM 0 HE1 TYR A 40 123.047 3.499 -3.253 1.00 0.00 H new ATOM 0 HE2 TYR A 40 123.800 4.298 0.899 1.00 0.00 H new ATOM 0 HH TYR A 40 121.859 4.758 -0.102 1.00 0.00 H new ATOM 526 N ALA A 41 125.818 -0.848 -0.494 1.00 0.00 N ATOM 527 CA ALA A 41 124.979 -1.422 0.548 1.00 0.00 C ATOM 528 C ALA A 41 124.698 -2.892 0.251 1.00 0.00 C ATOM 529 O ALA A 41 123.795 -3.218 -0.520 1.00 0.00 O ATOM 530 CB ALA A 41 123.658 -0.653 0.634 1.00 0.00 C ATOM 0 H ALA A 41 125.962 -1.453 -1.302 1.00 0.00 H new ATOM 0 HA ALA A 41 125.504 -1.347 1.500 1.00 0.00 H new ATOM 0 HB1 ALA A 41 123.034 -1.087 1.415 1.00 0.00 H new ATOM 0 HB2 ALA A 41 123.860 0.392 0.870 1.00 0.00 H new ATOM 0 HB3 ALA A 41 123.138 -0.715 -0.322 1.00 0.00 H new ATOM 536 N VAL A 42 125.472 -3.776 0.871 1.00 0.00 N ATOM 537 CA VAL A 42 125.293 -5.210 0.669 1.00 0.00 C ATOM 538 C VAL A 42 125.215 -5.929 2.011 1.00 0.00 C ATOM 539 O VAL A 42 126.033 -5.696 2.900 1.00 0.00 O ATOM 540 CB VAL A 42 126.453 -5.778 -0.146 1.00 0.00 C ATOM 541 CG1 VAL A 42 126.153 -7.233 -0.511 1.00 0.00 C ATOM 542 CG2 VAL A 42 126.631 -4.955 -1.425 1.00 0.00 C ATOM 0 H VAL A 42 126.224 -3.528 1.513 1.00 0.00 H new ATOM 0 HA VAL A 42 124.361 -5.366 0.125 1.00 0.00 H new ATOM 0 HB VAL A 42 127.369 -5.732 0.443 1.00 0.00 H new ATOM 0 HG11 VAL A 42 126.980 -7.640 -1.093 1.00 0.00 H new ATOM 0 HG12 VAL A 42 126.028 -7.818 0.400 1.00 0.00 H new ATOM 0 HG13 VAL A 42 125.237 -7.279 -1.101 1.00 0.00 H new ATOM 0 HG21 VAL A 42 127.459 -5.361 -2.006 1.00 0.00 H new ATOM 0 HG22 VAL A 42 125.716 -4.999 -2.016 1.00 0.00 H new ATOM 0 HG23 VAL A 42 126.845 -3.918 -1.164 1.00 0.00 H new ATOM 546 N THR A 43 124.229 -6.804 2.150 1.00 0.00 N ATOM 547 CA THR A 43 124.055 -7.542 3.395 1.00 0.00 C ATOM 548 C THR A 43 124.559 -8.976 3.262 1.00 0.00 C ATOM 549 O THR A 43 124.258 -9.668 2.291 1.00 0.00 O ATOM 550 CB THR A 43 122.579 -7.556 3.792 1.00 0.00 C ATOM 551 OG1 THR A 43 122.471 -7.739 5.197 1.00 0.00 O ATOM 552 CG2 THR A 43 121.863 -8.699 3.070 1.00 0.00 C ATOM 0 H THR A 43 123.544 -7.019 1.426 1.00 0.00 H new ATOM 0 HA THR A 43 124.639 -7.041 4.167 1.00 0.00 H new ATOM 0 HB THR A 43 122.118 -6.609 3.511 1.00 0.00 H new ATOM 0 HG1 THR A 43 123.365 -7.731 5.598 1.00 0.00 H new ATOM 0 HG21 THR A 43 120.811 -8.707 3.355 1.00 0.00 H new ATOM 0 HG22 THR A 43 121.946 -8.557 1.992 1.00 0.00 H new ATOM 0 HG23 THR A 43 122.321 -9.648 3.348 1.00 0.00 H new ATOM 557 N VAL A 44 125.322 -9.411 4.259 1.00 0.00 N ATOM 558 CA VAL A 44 125.864 -10.764 4.271 1.00 0.00 C ATOM 559 C VAL A 44 125.627 -11.407 5.632 1.00 0.00 C ATOM 560 O VAL A 44 125.459 -10.710 6.632 1.00 0.00 O ATOM 561 CB VAL A 44 127.362 -10.730 3.972 1.00 0.00 C ATOM 562 CG1 VAL A 44 127.601 -10.017 2.641 1.00 0.00 C ATOM 563 CG2 VAL A 44 128.087 -9.977 5.089 1.00 0.00 C ATOM 0 H VAL A 44 125.579 -8.846 5.069 1.00 0.00 H new ATOM 0 HA VAL A 44 125.360 -11.352 3.504 1.00 0.00 H new ATOM 0 HB VAL A 44 127.743 -11.749 3.912 1.00 0.00 H new ATOM 0 HG11 VAL A 44 128.670 -9.993 2.428 1.00 0.00 H new ATOM 0 HG12 VAL A 44 127.084 -10.551 1.844 1.00 0.00 H new ATOM 0 HG13 VAL A 44 127.220 -8.998 2.701 1.00 0.00 H new ATOM 0 HG21 VAL A 44 129.156 -9.952 4.877 1.00 0.00 H new ATOM 0 HG22 VAL A 44 127.705 -8.958 5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 44 127.917 -10.484 6.039 1.00 0.00 H new ATOM 567 N MET A 45 125.610 -12.735 5.670 1.00 0.00 N ATOM 568 CA MET A 45 125.388 -13.442 6.926 1.00 0.00 C ATOM 569 C MET A 45 126.636 -14.211 7.348 1.00 0.00 C ATOM 570 O MET A 45 127.142 -15.051 6.603 1.00 0.00 O ATOM 571 CB MET A 45 124.217 -14.414 6.773 1.00 0.00 C ATOM 572 CG MET A 45 122.976 -13.647 6.312 1.00 0.00 C ATOM 573 SD MET A 45 122.896 -13.665 4.503 1.00 0.00 S ATOM 574 CE MET A 45 122.358 -15.382 4.313 1.00 0.00 C ATOM 0 H MET A 45 125.745 -13.337 4.858 1.00 0.00 H new ATOM 0 HA MET A 45 125.158 -12.706 7.696 1.00 0.00 H new ATOM 0 HB2 MET A 45 124.467 -15.191 6.050 1.00 0.00 H new ATOM 0 HB3 MET A 45 124.018 -14.913 7.721 1.00 0.00 H new ATOM 0 HG2 MET A 45 122.078 -14.101 6.731 1.00 0.00 H new ATOM 0 HG3 MET A 45 123.014 -12.620 6.675 1.00 0.00 H new ATOM 0 HE1 MET A 45 123.105 -15.936 3.745 1.00 0.00 H new ATOM 0 HE2 MET A 45 122.239 -15.837 5.296 1.00 0.00 H new ATOM 0 HE3 MET A 45 121.406 -15.408 3.783 1.00 0.00 H new ATOM 584 N ILE A 46 127.114 -13.930 8.556 1.00 0.00 N ATOM 585 CA ILE A 46 128.289 -14.612 9.084 1.00 0.00 C ATOM 586 C ILE A 46 128.042 -15.041 10.527 1.00 0.00 C ATOM 587 O ILE A 46 127.484 -14.282 11.317 1.00 0.00 O ATOM 588 CB ILE A 46 129.507 -13.690 9.021 1.00 0.00 C ATOM 589 CG1 ILE A 46 130.753 -14.457 9.473 1.00 0.00 C ATOM 590 CG2 ILE A 46 129.285 -12.489 9.941 1.00 0.00 C ATOM 591 CD1 ILE A 46 131.018 -15.621 8.515 1.00 0.00 C ATOM 0 H ILE A 46 126.707 -13.238 9.185 1.00 0.00 H new ATOM 0 HA ILE A 46 128.481 -15.496 8.477 1.00 0.00 H new ATOM 0 HB ILE A 46 129.647 -13.342 7.997 1.00 0.00 H new ATOM 0 HG12 ILE A 46 131.614 -13.789 9.496 1.00 0.00 H new ATOM 0 HG13 ILE A 46 130.613 -14.832 10.487 1.00 0.00 H new ATOM 0 HG21 ILE A 46 130.153 -11.831 9.897 1.00 0.00 H new ATOM 0 HG22 ILE A 46 128.399 -11.943 9.618 1.00 0.00 H new ATOM 0 HG23 ILE A 46 129.145 -12.836 10.965 1.00 0.00 H new ATOM 0 HD11 ILE A 46 131.905 -16.165 8.840 1.00 0.00 H new ATOM 0 HD12 ILE A 46 130.160 -16.294 8.514 1.00 0.00 H new ATOM 0 HD13 ILE A 46 131.177 -15.235 7.508 1.00 0.00 H new ATOM 595 N GLY A 47 128.461 -16.255 10.865 1.00 0.00 N ATOM 596 CA GLY A 47 128.282 -16.767 12.220 1.00 0.00 C ATOM 597 C GLY A 47 126.983 -16.256 12.843 1.00 0.00 C ATOM 598 O GLY A 47 126.880 -16.126 14.063 1.00 0.00 O ATOM 0 H GLY A 47 128.924 -16.900 10.225 1.00 0.00 H new ATOM 0 HA2 GLY A 47 128.274 -17.857 12.200 1.00 0.00 H new ATOM 0 HA3 GLY A 47 129.127 -16.466 12.839 1.00 0.00 H new ATOM 602 N GLY A 48 125.992 -15.973 12.000 1.00 0.00 N ATOM 603 CA GLY A 48 124.705 -15.484 12.486 1.00 0.00 C ATOM 604 C GLY A 48 124.736 -13.980 12.745 1.00 0.00 C ATOM 605 O GLY A 48 124.273 -13.512 13.786 1.00 0.00 O ATOM 0 H GLY A 48 126.054 -16.073 10.987 1.00 0.00 H new ATOM 0 HA2 GLY A 48 123.929 -15.712 11.755 1.00 0.00 H new ATOM 0 HA3 GLY A 48 124.440 -16.007 13.405 1.00 0.00 H new ATOM 609 N GLU A 49 125.270 -13.226 11.789 1.00 0.00 N ATOM 610 CA GLU A 49 125.340 -11.774 11.921 1.00 0.00 C ATOM 611 C GLU A 49 124.744 -11.101 10.679 1.00 0.00 C ATOM 612 O GLU A 49 125.466 -10.736 9.750 1.00 0.00 O ATOM 613 CB GLU A 49 126.796 -11.330 12.118 1.00 0.00 C ATOM 614 CG GLU A 49 126.895 -10.465 13.375 1.00 0.00 C ATOM 615 CD GLU A 49 126.708 -11.329 14.617 1.00 0.00 C ATOM 616 OE1 GLU A 49 126.404 -12.500 14.458 1.00 0.00 O ATOM 617 OE2 GLU A 49 126.872 -10.808 15.707 1.00 0.00 O ATOM 0 H GLU A 49 125.658 -13.593 10.920 1.00 0.00 H new ATOM 0 HA GLU A 49 124.761 -11.473 12.794 1.00 0.00 H new ATOM 0 HB2 GLU A 49 127.445 -12.201 12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 49 127.138 -10.769 11.248 1.00 0.00 H new ATOM 0 HG2 GLU A 49 127.865 -9.969 13.410 1.00 0.00 H new ATOM 0 HG3 GLU A 49 126.137 -9.682 13.349 1.00 0.00 H new ATOM 624 N PRO A 50 123.444 -10.946 10.637 1.00 0.00 N ATOM 625 CA PRO A 50 122.751 -10.320 9.477 1.00 0.00 C ATOM 626 C PRO A 50 122.846 -8.796 9.487 1.00 0.00 C ATOM 627 O PRO A 50 122.095 -8.119 10.190 1.00 0.00 O ATOM 628 CB PRO A 50 121.303 -10.782 9.634 1.00 0.00 C ATOM 629 CG PRO A 50 121.113 -11.028 11.096 1.00 0.00 C ATOM 630 CD PRO A 50 122.491 -11.348 11.687 1.00 0.00 C ATOM 0 HA PRO A 50 123.200 -10.614 8.528 1.00 0.00 H new ATOM 0 HB2 PRO A 50 120.609 -10.024 9.271 1.00 0.00 H new ATOM 0 HB3 PRO A 50 121.116 -11.688 9.057 1.00 0.00 H new ATOM 0 HG2 PRO A 50 120.681 -10.152 11.580 1.00 0.00 H new ATOM 0 HG3 PRO A 50 120.423 -11.856 11.260 1.00 0.00 H new ATOM 0 HD2 PRO A 50 122.664 -10.798 12.612 1.00 0.00 H new ATOM 0 HD3 PRO A 50 122.585 -12.408 11.924 1.00 0.00 H new ATOM 638 N TYR A 51 123.769 -8.267 8.691 1.00 0.00 N ATOM 639 CA TYR A 51 123.955 -6.821 8.598 1.00 0.00 C ATOM 640 C TYR A 51 124.605 -6.451 7.270 1.00 0.00 C ATOM 641 O TYR A 51 124.910 -7.325 6.458 1.00 0.00 O ATOM 642 CB TYR A 51 124.797 -6.320 9.770 1.00 0.00 C ATOM 643 CG TYR A 51 124.045 -6.576 11.055 1.00 0.00 C ATOM 644 CD1 TYR A 51 122.825 -5.929 11.294 1.00 0.00 C ATOM 645 CD2 TYR A 51 124.564 -7.461 12.007 1.00 0.00 C ATOM 646 CE1 TYR A 51 122.127 -6.167 12.484 1.00 0.00 C ATOM 647 CE2 TYR A 51 123.867 -7.699 13.197 1.00 0.00 C ATOM 648 CZ TYR A 51 122.648 -7.052 13.436 1.00 0.00 C ATOM 649 OH TYR A 51 121.961 -7.285 14.609 1.00 0.00 O ATOM 0 H TYR A 51 124.398 -8.814 8.103 1.00 0.00 H new ATOM 0 HA TYR A 51 122.978 -6.340 8.644 1.00 0.00 H new ATOM 0 HB2 TYR A 51 125.760 -6.831 9.788 1.00 0.00 H new ATOM 0 HB3 TYR A 51 125.003 -5.255 9.659 1.00 0.00 H new ATOM 0 HD1 TYR A 51 122.423 -5.246 10.560 1.00 0.00 H new ATOM 0 HD2 TYR A 51 125.504 -7.961 11.823 1.00 0.00 H new ATOM 0 HE1 TYR A 51 121.187 -5.668 12.668 1.00 0.00 H new ATOM 0 HE2 TYR A 51 124.269 -8.382 13.931 1.00 0.00 H new ATOM 0 HH TYR A 51 122.460 -7.925 15.159 1.00 0.00 H new ATOM 659 N THR A 52 124.793 -5.154 7.034 1.00 0.00 N ATOM 660 CA THR A 52 125.382 -4.710 5.773 1.00 0.00 C ATOM 661 C THR A 52 126.368 -3.558 5.957 1.00 0.00 C ATOM 662 O THR A 52 126.213 -2.721 6.846 1.00 0.00 O ATOM 663 CB THR A 52 124.262 -4.257 4.832 1.00 0.00 C ATOM 664 OG1 THR A 52 124.814 -3.901 3.573 1.00 0.00 O ATOM 665 CG2 THR A 52 123.538 -3.051 5.436 1.00 0.00 C ATOM 0 H THR A 52 124.552 -4.406 7.684 1.00 0.00 H new ATOM 0 HA THR A 52 125.934 -5.552 5.356 1.00 0.00 H new ATOM 0 HB THR A 52 123.551 -5.073 4.698 1.00 0.00 H new ATOM 0 HG1 THR A 52 125.720 -4.268 3.497 1.00 0.00 H new ATOM 0 HG21 THR A 52 122.742 -2.731 4.764 1.00 0.00 H new ATOM 0 HG22 THR A 52 123.110 -3.328 6.399 1.00 0.00 H new ATOM 0 HG23 THR A 52 124.246 -2.234 5.575 1.00 0.00 H new ATOM 670 N LEU A 53 127.359 -3.508 5.067 1.00 0.00 N ATOM 671 CA LEU A 53 128.352 -2.441 5.080 1.00 0.00 C ATOM 672 C LEU A 53 128.262 -1.668 3.769 1.00 0.00 C ATOM 673 O LEU A 53 128.284 -2.264 2.692 1.00 0.00 O ATOM 674 CB LEU A 53 129.763 -3.015 5.233 1.00 0.00 C ATOM 675 CG LEU A 53 130.766 -1.862 5.390 1.00 0.00 C ATOM 676 CD1 LEU A 53 130.670 -1.272 6.800 1.00 0.00 C ATOM 677 CD2 LEU A 53 132.186 -2.380 5.151 1.00 0.00 C ATOM 0 H LEU A 53 127.493 -4.197 4.327 1.00 0.00 H new ATOM 0 HA LEU A 53 128.153 -1.782 5.925 1.00 0.00 H new ATOM 0 HB2 LEU A 53 129.808 -3.672 6.101 1.00 0.00 H new ATOM 0 HB3 LEU A 53 130.019 -3.619 4.362 1.00 0.00 H new ATOM 0 HG LEU A 53 130.532 -1.087 4.660 1.00 0.00 H new ATOM 0 HD11 LEU A 53 131.385 -0.455 6.902 1.00 0.00 H new ATOM 0 HD12 LEU A 53 129.661 -0.895 6.969 1.00 0.00 H new ATOM 0 HD13 LEU A 53 130.896 -2.045 7.534 1.00 0.00 H new ATOM 0 HD21 LEU A 53 132.896 -1.560 5.263 1.00 0.00 H new ATOM 0 HD22 LEU A 53 132.416 -3.160 5.876 1.00 0.00 H new ATOM 0 HD23 LEU A 53 132.259 -2.789 4.143 1.00 0.00 H new ATOM 683 N GLY A 54 128.149 -0.349 3.855 1.00 0.00 N ATOM 684 CA GLY A 54 128.043 0.462 2.647 1.00 0.00 C ATOM 685 C GLY A 54 129.414 0.825 2.086 1.00 0.00 C ATOM 686 O GLY A 54 130.325 1.173 2.835 1.00 0.00 O ATOM 0 H GLY A 54 128.128 0.175 4.730 1.00 0.00 H new ATOM 0 HA2 GLY A 54 127.474 -0.082 1.893 1.00 0.00 H new ATOM 0 HA3 GLY A 54 127.488 1.374 2.869 1.00 0.00 H new ATOM 690 N LEU A 55 129.550 0.749 0.760 1.00 0.00 N ATOM 691 CA LEU A 55 130.821 1.086 0.113 1.00 0.00 C ATOM 692 C LEU A 55 130.616 2.166 -0.944 1.00 0.00 C ATOM 693 O LEU A 55 129.774 2.023 -1.829 1.00 0.00 O ATOM 694 CB LEU A 55 131.423 -0.159 -0.542 1.00 0.00 C ATOM 695 CG LEU A 55 131.608 -1.253 0.509 1.00 0.00 C ATOM 696 CD1 LEU A 55 132.197 -2.501 -0.152 1.00 0.00 C ATOM 697 CD2 LEU A 55 132.567 -0.761 1.595 1.00 0.00 C ATOM 0 H LEU A 55 128.808 0.462 0.121 1.00 0.00 H new ATOM 0 HA LEU A 55 131.503 1.462 0.875 1.00 0.00 H new ATOM 0 HB2 LEU A 55 130.771 -0.514 -1.340 1.00 0.00 H new ATOM 0 HB3 LEU A 55 132.382 0.086 -0.999 1.00 0.00 H new ATOM 0 HG LEU A 55 130.642 -1.493 0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 55 132.329 -3.282 0.597 1.00 0.00 H new ATOM 0 HD12 LEU A 55 131.520 -2.855 -0.929 1.00 0.00 H new ATOM 0 HD13 LEU A 55 133.162 -2.257 -0.595 1.00 0.00 H new ATOM 0 HD21 LEU A 55 132.699 -1.541 2.345 1.00 0.00 H new ATOM 0 HD22 LEU A 55 133.531 -0.521 1.147 1.00 0.00 H new ATOM 0 HD23 LEU A 55 132.155 0.130 2.068 1.00 0.00 H new ATOM 703 N PHE A 56 131.384 3.248 -0.854 1.00 0.00 N ATOM 704 CA PHE A 56 131.249 4.332 -1.821 1.00 0.00 C ATOM 705 C PHE A 56 132.441 4.398 -2.776 1.00 0.00 C ATOM 706 O PHE A 56 132.830 5.482 -3.188 1.00 0.00 O ATOM 707 CB PHE A 56 131.090 5.673 -1.100 1.00 0.00 C ATOM 708 CG PHE A 56 130.645 6.724 -2.089 1.00 0.00 C ATOM 709 CD1 PHE A 56 129.303 6.790 -2.482 1.00 0.00 C ATOM 710 CD2 PHE A 56 131.573 7.634 -2.610 1.00 0.00 C ATOM 711 CE1 PHE A 56 128.890 7.764 -3.399 1.00 0.00 C ATOM 712 CE2 PHE A 56 131.160 8.608 -3.525 1.00 0.00 C ATOM 713 CZ PHE A 56 129.818 8.674 -3.920 1.00 0.00 C ATOM 0 H PHE A 56 132.093 3.397 -0.136 1.00 0.00 H new ATOM 0 HA PHE A 56 130.357 4.127 -2.412 1.00 0.00 H new ATOM 0 HB2 PHE A 56 130.360 5.582 -0.296 1.00 0.00 H new ATOM 0 HB3 PHE A 56 132.034 5.966 -0.641 1.00 0.00 H new ATOM 0 HD1 PHE A 56 128.587 6.090 -2.078 1.00 0.00 H new ATOM 0 HD2 PHE A 56 132.608 7.584 -2.305 1.00 0.00 H new ATOM 0 HE1 PHE A 56 127.855 7.813 -3.705 1.00 0.00 H new ATOM 0 HE2 PHE A 56 131.876 9.309 -3.927 1.00 0.00 H new ATOM 0 HZ PHE A 56 129.499 9.426 -4.626 1.00 0.00 H new ATOM 723 N ASP A 57 132.988 3.230 -3.136 1.00 0.00 N ATOM 724 CA ASP A 57 134.120 3.136 -4.081 1.00 0.00 C ATOM 725 C ASP A 57 135.141 4.274 -3.935 1.00 0.00 C ATOM 726 O ASP A 57 134.985 5.170 -3.115 1.00 0.00 O ATOM 727 CB ASP A 57 133.569 3.140 -5.504 1.00 0.00 C ATOM 728 CG ASP A 57 132.930 1.792 -5.818 1.00 0.00 C ATOM 729 OD1 ASP A 57 133.078 0.887 -5.013 1.00 0.00 O ATOM 730 OD2 ASP A 57 132.302 1.683 -6.858 1.00 0.00 O ATOM 0 H ASP A 57 132.665 2.328 -2.787 1.00 0.00 H new ATOM 0 HA ASP A 57 134.650 2.211 -3.854 1.00 0.00 H new ATOM 0 HB2 ASP A 57 132.833 3.936 -5.616 1.00 0.00 H new ATOM 0 HB3 ASP A 57 134.371 3.346 -6.213 1.00 0.00 H new ATOM 735 N THR A 58 136.206 4.232 -4.747 1.00 0.00 N ATOM 736 CA THR A 58 137.224 5.277 -4.676 1.00 0.00 C ATOM 737 C THR A 58 136.640 6.624 -5.088 1.00 0.00 C ATOM 738 O THR A 58 135.968 6.734 -6.113 1.00 0.00 O ATOM 739 CB THR A 58 138.401 4.937 -5.591 1.00 0.00 C ATOM 740 OG1 THR A 58 138.992 3.714 -5.171 1.00 0.00 O ATOM 741 CG2 THR A 58 139.435 6.062 -5.527 1.00 0.00 C ATOM 0 H THR A 58 136.379 3.505 -5.441 1.00 0.00 H new ATOM 0 HA THR A 58 137.573 5.338 -3.645 1.00 0.00 H new ATOM 0 HB THR A 58 138.048 4.830 -6.617 1.00 0.00 H new ATOM 0 HG1 THR A 58 138.979 3.664 -4.192 1.00 0.00 H new ATOM 0 HG21 THR A 58 140.275 5.822 -6.179 1.00 0.00 H new ATOM 0 HG22 THR A 58 138.978 6.996 -5.854 1.00 0.00 H new ATOM 0 HG23 THR A 58 139.790 6.172 -4.502 1.00 0.00 H new ATOM 746 N ALA A 59 136.904 7.647 -4.280 1.00 0.00 N ATOM 747 CA ALA A 59 136.401 8.987 -4.569 1.00 0.00 C ATOM 748 C ALA A 59 137.550 9.932 -4.903 1.00 0.00 C ATOM 749 O ALA A 59 138.661 9.776 -4.396 1.00 0.00 O ATOM 750 CB ALA A 59 135.630 9.526 -3.364 1.00 0.00 C ATOM 0 H ALA A 59 137.459 7.576 -3.427 1.00 0.00 H new ATOM 0 HA ALA A 59 135.735 8.926 -5.430 1.00 0.00 H new ATOM 0 HB1 ALA A 59 135.258 10.526 -3.588 1.00 0.00 H new ATOM 0 HB2 ALA A 59 134.790 8.867 -3.145 1.00 0.00 H new ATOM 0 HB3 ALA A 59 136.292 9.570 -2.499 1.00 0.00 H new ATOM 756 N GLY A 60 137.275 10.912 -5.756 1.00 0.00 N ATOM 757 CA GLY A 60 138.293 11.879 -6.147 1.00 0.00 C ATOM 758 C GLY A 60 138.180 12.220 -7.629 1.00 0.00 C ATOM 759 O GLY A 60 137.625 11.451 -8.413 1.00 0.00 O ATOM 0 H GLY A 60 136.362 11.057 -6.187 1.00 0.00 H new ATOM 0 HA2 GLY A 60 138.186 12.786 -5.552 1.00 0.00 H new ATOM 0 HA3 GLY A 60 139.283 11.475 -5.937 1.00 0.00 H new ATOM 972 N GLN A 74 124.703 9.346 6.924 1.00 0.00 N ATOM 973 CA GLN A 74 125.216 8.983 8.239 1.00 0.00 C ATOM 974 C GLN A 74 126.266 7.883 8.118 1.00 0.00 C ATOM 975 O GLN A 74 125.989 6.800 7.602 1.00 0.00 O ATOM 976 CB GLN A 74 124.070 8.504 9.132 1.00 0.00 C ATOM 977 CG GLN A 74 124.593 8.258 10.548 1.00 0.00 C ATOM 978 CD GLN A 74 123.456 7.798 11.455 1.00 0.00 C ATOM 979 OE1 GLN A 74 122.293 7.816 11.050 1.00 0.00 O ATOM 980 NE2 GLN A 74 123.722 7.383 12.664 1.00 0.00 N ATOM 0 HA GLN A 74 125.679 9.863 8.685 1.00 0.00 H new ATOM 0 HB2 GLN A 74 123.275 9.249 9.151 1.00 0.00 H new ATOM 0 HB3 GLN A 74 123.639 7.588 8.728 1.00 0.00 H new ATOM 0 HG2 GLN A 74 125.380 7.504 10.527 1.00 0.00 H new ATOM 0 HG3 GLN A 74 125.037 9.171 10.944 1.00 0.00 H new ATOM 0 HE21 GLN A 74 124.686 7.369 12.998 1.00 0.00 H new ATOM 0 HE22 GLN A 74 122.966 7.073 13.275 1.00 0.00 H new ATOM 987 N THR A 75 127.471 8.168 8.601 1.00 0.00 N ATOM 988 CA THR A 75 128.557 7.197 8.545 1.00 0.00 C ATOM 989 C THR A 75 129.394 7.260 9.817 1.00 0.00 C ATOM 990 O THR A 75 129.426 8.287 10.496 1.00 0.00 O ATOM 991 CB THR A 75 129.444 7.479 7.332 1.00 0.00 C ATOM 992 OG1 THR A 75 130.252 6.342 7.063 1.00 0.00 O ATOM 993 CG2 THR A 75 130.338 8.685 7.624 1.00 0.00 C ATOM 0 H THR A 75 127.719 9.058 9.033 1.00 0.00 H new ATOM 0 HA THR A 75 128.127 6.199 8.456 1.00 0.00 H new ATOM 0 HB THR A 75 128.819 7.693 6.465 1.00 0.00 H new ATOM 0 HG1 THR A 75 129.752 5.527 7.279 1.00 0.00 H new ATOM 0 HG21 THR A 75 130.971 8.887 6.760 1.00 0.00 H new ATOM 0 HG22 THR A 75 129.717 9.557 7.830 1.00 0.00 H new ATOM 0 HG23 THR A 75 130.964 8.472 8.490 1.00 0.00 H new ATOM 998 N ASP A 76 130.075 6.162 10.134 1.00 0.00 N ATOM 999 CA ASP A 76 130.910 6.121 11.331 1.00 0.00 C ATOM 1000 C ASP A 76 132.356 5.773 10.981 1.00 0.00 C ATOM 1001 O ASP A 76 133.287 6.246 11.631 1.00 0.00 O ATOM 1002 CB ASP A 76 130.361 5.094 12.321 1.00 0.00 C ATOM 1003 CG ASP A 76 129.025 5.572 12.882 1.00 0.00 C ATOM 1004 OD1 ASP A 76 128.688 6.724 12.656 1.00 0.00 O ATOM 1005 OD2 ASP A 76 128.360 4.783 13.530 1.00 0.00 O ATOM 0 H ASP A 76 130.066 5.301 9.588 1.00 0.00 H new ATOM 0 HA ASP A 76 130.893 7.111 11.787 1.00 0.00 H new ATOM 0 HB2 ASP A 76 130.233 4.131 11.826 1.00 0.00 H new ATOM 0 HB3 ASP A 76 131.072 4.943 13.133 1.00 0.00 H new ATOM 1010 N VAL A 77 132.540 4.949 9.953 1.00 0.00 N ATOM 1011 CA VAL A 77 133.887 4.560 9.542 1.00 0.00 C ATOM 1012 C VAL A 77 134.048 4.714 8.036 1.00 0.00 C ATOM 1013 O VAL A 77 133.072 4.626 7.290 1.00 0.00 O ATOM 1014 CB VAL A 77 134.156 3.109 9.943 1.00 0.00 C ATOM 1015 CG1 VAL A 77 134.002 2.960 11.457 1.00 0.00 C ATOM 1016 CG2 VAL A 77 133.154 2.192 9.238 1.00 0.00 C ATOM 0 H VAL A 77 131.788 4.543 9.397 1.00 0.00 H new ATOM 0 HA VAL A 77 134.604 5.211 10.041 1.00 0.00 H new ATOM 0 HB VAL A 77 135.170 2.834 9.652 1.00 0.00 H new ATOM 0 HG11 VAL A 77 134.194 1.926 11.742 1.00 0.00 H new ATOM 0 HG12 VAL A 77 134.714 3.613 11.961 1.00 0.00 H new ATOM 0 HG13 VAL A 77 132.988 3.235 11.748 1.00 0.00 H new ATOM 0 HG21 VAL A 77 133.345 1.157 9.523 1.00 0.00 H new ATOM 0 HG22 VAL A 77 132.141 2.468 9.530 1.00 0.00 H new ATOM 0 HG23 VAL A 77 133.262 2.297 8.158 1.00 0.00 H new ATOM 1020 N PHE A 78 135.277 4.951 7.583 1.00 0.00 N ATOM 1021 CA PHE A 78 135.529 5.120 6.158 1.00 0.00 C ATOM 1022 C PHE A 78 136.525 4.073 5.677 1.00 0.00 C ATOM 1023 O PHE A 78 137.258 3.494 6.476 1.00 0.00 O ATOM 1024 CB PHE A 78 136.108 6.514 5.897 1.00 0.00 C ATOM 1025 CG PHE A 78 135.112 7.569 6.309 1.00 0.00 C ATOM 1026 CD1 PHE A 78 134.836 7.784 7.665 1.00 0.00 C ATOM 1027 CD2 PHE A 78 134.472 8.342 5.334 1.00 0.00 C ATOM 1028 CE1 PHE A 78 133.917 8.769 8.044 1.00 0.00 C ATOM 1029 CE2 PHE A 78 133.552 9.326 5.713 1.00 0.00 C ATOM 1030 CZ PHE A 78 133.274 9.540 7.068 1.00 0.00 C ATOM 0 H PHE A 78 136.104 5.029 8.176 1.00 0.00 H new ATOM 0 HA PHE A 78 134.589 5.003 5.619 1.00 0.00 H new ATOM 0 HB2 PHE A 78 137.037 6.641 6.453 1.00 0.00 H new ATOM 0 HB3 PHE A 78 136.351 6.624 4.840 1.00 0.00 H new ATOM 0 HD1 PHE A 78 135.332 7.190 8.418 1.00 0.00 H new ATOM 0 HD2 PHE A 78 134.688 8.179 4.288 1.00 0.00 H new ATOM 0 HE1 PHE A 78 133.704 8.935 9.090 1.00 0.00 H new ATOM 0 HE2 PHE A 78 133.056 9.920 4.960 1.00 0.00 H new ATOM 0 HZ PHE A 78 132.564 10.299 7.361 1.00 0.00 H new ATOM 1040 N LEU A 79 136.554 3.837 4.371 1.00 0.00 N ATOM 1041 CA LEU A 79 137.480 2.861 3.811 1.00 0.00 C ATOM 1042 C LEU A 79 138.429 3.538 2.826 1.00 0.00 C ATOM 1043 O LEU A 79 137.992 4.159 1.857 1.00 0.00 O ATOM 1044 CB LEU A 79 136.699 1.748 3.100 1.00 0.00 C ATOM 1045 CG LEU A 79 137.618 0.549 2.807 1.00 0.00 C ATOM 1046 CD1 LEU A 79 136.778 -0.728 2.759 1.00 0.00 C ATOM 1047 CD2 LEU A 79 138.325 0.731 1.457 1.00 0.00 C ATOM 0 H LEU A 79 135.956 4.301 3.688 1.00 0.00 H new ATOM 0 HA LEU A 79 138.065 2.427 4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 79 135.862 1.429 3.721 1.00 0.00 H new ATOM 0 HB3 LEU A 79 136.279 2.128 2.169 1.00 0.00 H new ATOM 0 HG LEU A 79 138.368 0.480 3.595 1.00 0.00 H new ATOM 0 HD11 LEU A 79 137.424 -1.581 2.552 1.00 0.00 H new ATOM 0 HD12 LEU A 79 136.282 -0.873 3.719 1.00 0.00 H new ATOM 0 HD13 LEU A 79 136.028 -0.641 1.972 1.00 0.00 H new ATOM 0 HD21 LEU A 79 138.971 -0.126 1.266 1.00 0.00 H new ATOM 0 HD22 LEU A 79 137.581 0.809 0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 79 138.926 1.640 1.481 1.00 0.00 H new ATOM 1053 N VAL A 80 139.727 3.410 3.072 1.00 0.00 N ATOM 1054 CA VAL A 80 140.722 4.008 2.189 1.00 0.00 C ATOM 1055 C VAL A 80 141.328 2.937 1.288 1.00 0.00 C ATOM 1056 O VAL A 80 141.690 1.856 1.753 1.00 0.00 O ATOM 1057 CB VAL A 80 141.824 4.674 3.016 1.00 0.00 C ATOM 1058 CG1 VAL A 80 141.233 5.842 3.806 1.00 0.00 C ATOM 1059 CG2 VAL A 80 142.420 3.653 3.988 1.00 0.00 C ATOM 0 H VAL A 80 140.113 2.902 3.868 1.00 0.00 H new ATOM 0 HA VAL A 80 140.237 4.763 1.570 1.00 0.00 H new ATOM 0 HB VAL A 80 142.605 5.042 2.350 1.00 0.00 H new ATOM 0 HG11 VAL A 80 142.018 6.317 4.395 1.00 0.00 H new ATOM 0 HG12 VAL A 80 140.807 6.570 3.115 1.00 0.00 H new ATOM 0 HG13 VAL A 80 140.452 5.473 4.471 1.00 0.00 H new ATOM 0 HG21 VAL A 80 143.205 4.127 4.577 1.00 0.00 H new ATOM 0 HG22 VAL A 80 141.639 3.285 4.653 1.00 0.00 H new ATOM 0 HG23 VAL A 80 142.841 2.819 3.427 1.00 0.00 H new ATOM 1063 N CYS A 81 141.427 3.236 -0.005 1.00 0.00 N ATOM 1064 CA CYS A 81 141.980 2.275 -0.953 1.00 0.00 C ATOM 1065 C CYS A 81 142.987 2.931 -1.891 1.00 0.00 C ATOM 1066 O CYS A 81 142.744 4.011 -2.438 1.00 0.00 O ATOM 1067 CB CYS A 81 140.853 1.653 -1.779 1.00 0.00 C ATOM 1068 SG CYS A 81 139.400 2.729 -1.724 1.00 0.00 S ATOM 0 H CYS A 81 141.136 4.123 -0.415 1.00 0.00 H new ATOM 0 HA CYS A 81 142.495 1.503 -0.381 1.00 0.00 H new ATOM 0 HB2 CYS A 81 141.177 1.515 -2.810 1.00 0.00 H new ATOM 0 HB3 CYS A 81 140.603 0.667 -1.388 1.00 0.00 H new ATOM 0 HG CYS A 81 139.758 3.955 -1.968 1.00 0.00 H new ATOM 1074 N PHE A 82 144.116 2.258 -2.083 1.00 0.00 N ATOM 1075 CA PHE A 82 145.159 2.758 -2.967 1.00 0.00 C ATOM 1076 C PHE A 82 145.804 1.598 -3.715 1.00 0.00 C ATOM 1077 O PHE A 82 145.823 0.473 -3.226 1.00 0.00 O ATOM 1078 CB PHE A 82 146.228 3.489 -2.153 1.00 0.00 C ATOM 1079 CG PHE A 82 147.003 2.482 -1.337 1.00 0.00 C ATOM 1080 CD1 PHE A 82 146.514 2.061 -0.094 1.00 0.00 C ATOM 1081 CD2 PHE A 82 148.209 1.967 -1.825 1.00 0.00 C ATOM 1082 CE1 PHE A 82 147.232 1.125 0.659 1.00 0.00 C ATOM 1083 CE2 PHE A 82 148.927 1.030 -1.071 1.00 0.00 C ATOM 1084 CZ PHE A 82 148.438 0.610 0.171 1.00 0.00 C ATOM 0 H PHE A 82 144.331 1.366 -1.638 1.00 0.00 H new ATOM 0 HA PHE A 82 144.712 3.449 -3.682 1.00 0.00 H new ATOM 0 HB2 PHE A 82 146.900 4.032 -2.817 1.00 0.00 H new ATOM 0 HB3 PHE A 82 145.763 4.226 -1.498 1.00 0.00 H new ATOM 0 HD1 PHE A 82 145.583 2.458 0.283 1.00 0.00 H new ATOM 0 HD2 PHE A 82 148.586 2.292 -2.783 1.00 0.00 H new ATOM 0 HE1 PHE A 82 146.855 0.800 1.617 1.00 0.00 H new ATOM 0 HE2 PHE A 82 149.857 0.632 -1.448 1.00 0.00 H new ATOM 0 HZ PHE A 82 148.992 -0.112 0.753 1.00 0.00 H new ATOM 1094 N SER A 83 146.353 1.874 -4.887 1.00 0.00 N ATOM 1095 CA SER A 83 147.008 0.830 -5.664 1.00 0.00 C ATOM 1096 C SER A 83 148.504 0.855 -5.385 1.00 0.00 C ATOM 1097 O SER A 83 149.108 1.927 -5.360 1.00 0.00 O ATOM 1098 CB SER A 83 146.751 1.059 -7.153 1.00 0.00 C ATOM 1099 OG SER A 83 147.272 2.327 -7.528 1.00 0.00 O ATOM 0 H SER A 83 146.360 2.798 -5.318 1.00 0.00 H new ATOM 0 HA SER A 83 146.606 -0.142 -5.380 1.00 0.00 H new ATOM 0 HB2 SER A 83 147.222 0.271 -7.741 1.00 0.00 H new ATOM 0 HB3 SER A 83 145.682 1.016 -7.360 1.00 0.00 H new ATOM 0 HG SER A 83 147.111 2.477 -8.483 1.00 0.00 H new ATOM 1105 N VAL A 84 149.113 -0.311 -5.162 1.00 0.00 N ATOM 1106 CA VAL A 84 150.552 -0.317 -4.874 1.00 0.00 C ATOM 1107 C VAL A 84 151.307 0.522 -5.908 1.00 0.00 C ATOM 1108 O VAL A 84 151.859 1.575 -5.579 1.00 0.00 O ATOM 1109 CB VAL A 84 151.103 -1.741 -4.861 1.00 0.00 C ATOM 1110 CG1 VAL A 84 150.756 -2.443 -6.172 1.00 0.00 C ATOM 1111 CG2 VAL A 84 152.623 -1.695 -4.698 1.00 0.00 C ATOM 0 H VAL A 84 148.660 -1.225 -5.173 1.00 0.00 H new ATOM 0 HA VAL A 84 150.697 0.119 -3.885 1.00 0.00 H new ATOM 0 HB VAL A 84 150.660 -2.290 -4.030 1.00 0.00 H new ATOM 0 HG11 VAL A 84 151.152 -3.459 -6.157 1.00 0.00 H new ATOM 0 HG12 VAL A 84 149.673 -2.477 -6.291 1.00 0.00 H new ATOM 0 HG13 VAL A 84 151.195 -1.895 -7.006 1.00 0.00 H new ATOM 0 HG21 VAL A 84 153.019 -2.711 -4.688 1.00 0.00 H new ATOM 0 HG22 VAL A 84 153.061 -1.142 -5.529 1.00 0.00 H new ATOM 0 HG23 VAL A 84 152.874 -1.199 -3.760 1.00 0.00 H new ATOM 1115 N VAL A 85 151.340 0.039 -7.150 1.00 0.00 N ATOM 1116 CA VAL A 85 152.037 0.745 -8.223 1.00 0.00 C ATOM 1117 C VAL A 85 151.505 2.168 -8.361 1.00 0.00 C ATOM 1118 O VAL A 85 150.636 2.440 -9.190 1.00 0.00 O ATOM 1119 CB VAL A 85 151.864 -0.002 -9.548 1.00 0.00 C ATOM 1120 CG1 VAL A 85 150.376 -0.175 -9.855 1.00 0.00 C ATOM 1121 CG2 VAL A 85 152.523 0.801 -10.672 1.00 0.00 C ATOM 0 H VAL A 85 150.895 -0.833 -7.436 1.00 0.00 H new ATOM 0 HA VAL A 85 153.097 0.788 -7.973 1.00 0.00 H new ATOM 0 HB VAL A 85 152.333 -0.983 -9.472 1.00 0.00 H new ATOM 0 HG11 VAL A 85 150.259 -0.707 -10.799 1.00 0.00 H new ATOM 0 HG12 VAL A 85 149.904 -0.746 -9.056 1.00 0.00 H new ATOM 0 HG13 VAL A 85 149.904 0.804 -9.930 1.00 0.00 H new ATOM 0 HG21 VAL A 85 152.401 0.272 -11.617 1.00 0.00 H new ATOM 0 HG22 VAL A 85 152.053 1.782 -10.743 1.00 0.00 H new ATOM 0 HG23 VAL A 85 153.585 0.922 -10.458 1.00 0.00 H new ATOM 1125 N SER A 86 152.033 3.074 -7.543 1.00 0.00 N ATOM 1126 CA SER A 86 151.606 4.470 -7.579 1.00 0.00 C ATOM 1127 C SER A 86 151.919 5.158 -6.254 1.00 0.00 C ATOM 1128 O SER A 86 151.046 5.309 -5.400 1.00 0.00 O ATOM 1129 CB SER A 86 150.103 4.549 -7.854 1.00 0.00 C ATOM 1130 OG SER A 86 149.564 5.678 -7.179 1.00 0.00 O ATOM 0 H SER A 86 152.753 2.869 -6.851 1.00 0.00 H new ATOM 0 HA SER A 86 152.148 4.977 -8.377 1.00 0.00 H new ATOM 0 HB2 SER A 86 149.921 4.630 -8.926 1.00 0.00 H new ATOM 0 HB3 SER A 86 149.610 3.638 -7.515 1.00 0.00 H new ATOM 0 HG SER A 86 149.026 6.207 -7.805 1.00 0.00 H new ATOM 1136 N PRO A 87 153.145 5.574 -6.070 1.00 0.00 N ATOM 1137 CA PRO A 87 153.579 6.259 -4.820 1.00 0.00 C ATOM 1138 C PRO A 87 152.739 7.497 -4.524 1.00 0.00 C ATOM 1139 O PRO A 87 152.458 7.811 -3.367 1.00 0.00 O ATOM 1140 CB PRO A 87 155.035 6.656 -5.085 1.00 0.00 C ATOM 1141 CG PRO A 87 155.489 5.840 -6.252 1.00 0.00 C ATOM 1142 CD PRO A 87 154.242 5.432 -7.035 1.00 0.00 C ATOM 0 HA PRO A 87 153.464 5.610 -3.952 1.00 0.00 H new ATOM 0 HB2 PRO A 87 155.114 7.721 -5.302 1.00 0.00 H new ATOM 0 HB3 PRO A 87 155.656 6.462 -4.210 1.00 0.00 H new ATOM 0 HG2 PRO A 87 156.167 6.415 -6.882 1.00 0.00 H new ATOM 0 HG3 PRO A 87 156.036 4.960 -5.915 1.00 0.00 H new ATOM 0 HD2 PRO A 87 154.092 6.071 -7.905 1.00 0.00 H new ATOM 0 HD3 PRO A 87 154.320 4.408 -7.401 1.00 0.00 H new ATOM 1150 N SER A 88 152.351 8.200 -5.580 1.00 0.00 N ATOM 1151 CA SER A 88 151.556 9.411 -5.429 1.00 0.00 C ATOM 1152 C SER A 88 150.256 9.128 -4.680 1.00 0.00 C ATOM 1153 O SER A 88 149.805 9.944 -3.877 1.00 0.00 O ATOM 1154 CB SER A 88 151.234 9.995 -6.806 1.00 0.00 C ATOM 1155 OG SER A 88 152.443 10.192 -7.528 1.00 0.00 O ATOM 0 H SER A 88 152.572 7.954 -6.545 1.00 0.00 H new ATOM 0 HA SER A 88 152.138 10.128 -4.850 1.00 0.00 H new ATOM 0 HB2 SER A 88 150.575 9.321 -7.354 1.00 0.00 H new ATOM 0 HB3 SER A 88 150.704 10.941 -6.697 1.00 0.00 H new ATOM 0 HG SER A 88 152.240 10.564 -8.411 1.00 0.00 H new ATOM 1161 N SER A 89 149.652 7.974 -4.949 1.00 0.00 N ATOM 1162 CA SER A 89 148.399 7.610 -4.295 1.00 0.00 C ATOM 1163 C SER A 89 148.614 7.273 -2.821 1.00 0.00 C ATOM 1164 O SER A 89 147.751 7.539 -1.987 1.00 0.00 O ATOM 1165 CB SER A 89 147.778 6.407 -5.003 1.00 0.00 C ATOM 1166 OG SER A 89 148.613 5.270 -4.815 1.00 0.00 O ATOM 0 H SER A 89 150.005 7.281 -5.609 1.00 0.00 H new ATOM 0 HA SER A 89 147.729 8.468 -4.356 1.00 0.00 H new ATOM 0 HB2 SER A 89 146.782 6.211 -4.606 1.00 0.00 H new ATOM 0 HB3 SER A 89 147.662 6.616 -6.066 1.00 0.00 H new ATOM 0 HG SER A 89 149.329 5.276 -5.484 1.00 0.00 H new ATOM 1172 N PHE A 90 149.760 6.679 -2.509 1.00 0.00 N ATOM 1173 CA PHE A 90 150.065 6.298 -1.132 1.00 0.00 C ATOM 1174 C PHE A 90 150.326 7.520 -0.262 1.00 0.00 C ATOM 1175 O PHE A 90 149.854 7.599 0.873 1.00 0.00 O ATOM 1176 CB PHE A 90 151.286 5.376 -1.104 1.00 0.00 C ATOM 1177 CG PHE A 90 152.369 5.984 -0.243 1.00 0.00 C ATOM 1178 CD1 PHE A 90 152.221 6.018 1.149 1.00 0.00 C ATOM 1179 CD2 PHE A 90 153.523 6.507 -0.836 1.00 0.00 C ATOM 1180 CE1 PHE A 90 153.227 6.577 1.947 1.00 0.00 C ATOM 1181 CE2 PHE A 90 154.530 7.065 -0.038 1.00 0.00 C ATOM 1182 CZ PHE A 90 154.381 7.100 1.352 1.00 0.00 C ATOM 0 H PHE A 90 150.490 6.451 -3.184 1.00 0.00 H new ATOM 0 HA PHE A 90 149.199 5.773 -0.730 1.00 0.00 H new ATOM 0 HB2 PHE A 90 151.005 4.398 -0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 90 151.659 5.220 -2.116 1.00 0.00 H new ATOM 0 HD1 PHE A 90 151.331 5.613 1.607 1.00 0.00 H new ATOM 0 HD2 PHE A 90 153.638 6.481 -1.910 1.00 0.00 H new ATOM 0 HE1 PHE A 90 153.112 6.605 3.021 1.00 0.00 H new ATOM 0 HE2 PHE A 90 155.421 7.468 -0.496 1.00 0.00 H new ATOM 0 HZ PHE A 90 155.157 7.531 1.967 1.00 0.00 H new ATOM 1192 N GLU A 91 151.092 8.464 -0.791 1.00 0.00 N ATOM 1193 CA GLU A 91 151.423 9.669 -0.043 1.00 0.00 C ATOM 1194 C GLU A 91 150.175 10.471 0.310 1.00 0.00 C ATOM 1195 O GLU A 91 150.121 11.106 1.362 1.00 0.00 O ATOM 1196 CB GLU A 91 152.370 10.549 -0.863 1.00 0.00 C ATOM 1197 CG GLU A 91 153.700 9.823 -1.068 1.00 0.00 C ATOM 1198 CD GLU A 91 154.677 10.725 -1.816 1.00 0.00 C ATOM 1199 OE1 GLU A 91 154.251 11.764 -2.288 1.00 0.00 O ATOM 1200 OE2 GLU A 91 155.839 10.360 -1.903 1.00 0.00 O ATOM 0 H GLU A 91 151.493 8.420 -1.728 1.00 0.00 H new ATOM 0 HA GLU A 91 151.907 9.359 0.883 1.00 0.00 H new ATOM 0 HB2 GLU A 91 151.920 10.783 -1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 91 152.537 11.496 -0.350 1.00 0.00 H new ATOM 0 HG2 GLU A 91 154.121 9.538 -0.104 1.00 0.00 H new ATOM 0 HG3 GLU A 91 153.539 8.903 -1.630 1.00 0.00 H new ATOM 1207 N ASN A 92 149.179 10.460 -0.567 1.00 0.00 N ATOM 1208 CA ASN A 92 147.962 11.218 -0.316 1.00 0.00 C ATOM 1209 C ASN A 92 146.923 10.396 0.442 1.00 0.00 C ATOM 1210 O ASN A 92 146.526 10.747 1.552 1.00 0.00 O ATOM 1211 CB ASN A 92 147.367 11.684 -1.646 1.00 0.00 C ATOM 1212 CG ASN A 92 148.358 12.583 -2.376 1.00 0.00 C ATOM 1213 OD1 ASN A 92 148.628 12.379 -3.560 1.00 0.00 O ATOM 1214 ND2 ASN A 92 148.918 13.575 -1.739 1.00 0.00 N ATOM 0 H ASN A 92 149.189 9.942 -1.446 1.00 0.00 H new ATOM 0 HA ASN A 92 148.227 12.075 0.303 1.00 0.00 H new ATOM 0 HB2 ASN A 92 147.122 10.822 -2.266 1.00 0.00 H new ATOM 0 HB3 ASN A 92 146.437 12.224 -1.468 1.00 0.00 H new ATOM 0 HD21 ASN A 92 149.580 14.182 -2.222 1.00 0.00 H new ATOM 0 HD22 ASN A 92 148.694 13.743 -0.758 1.00 0.00 H new ATOM 1219 N VAL A 93 146.459 9.324 -0.186 1.00 0.00 N ATOM 1220 CA VAL A 93 145.433 8.476 0.405 1.00 0.00 C ATOM 1221 C VAL A 93 145.588 8.350 1.913 1.00 0.00 C ATOM 1222 O VAL A 93 144.694 8.714 2.677 1.00 0.00 O ATOM 1223 CB VAL A 93 145.513 7.078 -0.199 1.00 0.00 C ATOM 1224 CG1 VAL A 93 144.708 6.113 0.668 1.00 0.00 C ATOM 1225 CG2 VAL A 93 144.941 7.101 -1.617 1.00 0.00 C ATOM 0 H VAL A 93 146.778 9.021 -1.106 1.00 0.00 H new ATOM 0 HA VAL A 93 144.471 8.943 0.193 1.00 0.00 H new ATOM 0 HB VAL A 93 146.552 6.751 -0.239 1.00 0.00 H new ATOM 0 HG11 VAL A 93 144.761 5.111 0.242 1.00 0.00 H new ATOM 0 HG12 VAL A 93 145.120 6.101 1.677 1.00 0.00 H new ATOM 0 HG13 VAL A 93 143.668 6.438 0.704 1.00 0.00 H new ATOM 0 HG21 VAL A 93 144.998 6.102 -2.049 1.00 0.00 H new ATOM 0 HG22 VAL A 93 143.900 7.423 -1.584 1.00 0.00 H new ATOM 0 HG23 VAL A 93 145.516 7.795 -2.230 1.00 0.00 H new ATOM 1229 N LYS A 94 146.708 7.786 2.324 1.00 0.00 N ATOM 1230 CA LYS A 94 146.971 7.550 3.733 1.00 0.00 C ATOM 1231 C LYS A 94 147.232 8.827 4.535 1.00 0.00 C ATOM 1232 O LYS A 94 147.148 8.798 5.763 1.00 0.00 O ATOM 1233 CB LYS A 94 148.158 6.598 3.871 1.00 0.00 C ATOM 1234 CG LYS A 94 147.769 5.228 3.308 1.00 0.00 C ATOM 1235 CD LYS A 94 148.932 4.251 3.484 1.00 0.00 C ATOM 1236 CE LYS A 94 148.583 2.917 2.823 1.00 0.00 C ATOM 1237 NZ LYS A 94 148.540 1.844 3.858 1.00 0.00 N ATOM 0 H LYS A 94 147.454 7.481 1.699 1.00 0.00 H new ATOM 0 HA LYS A 94 146.067 7.109 4.153 1.00 0.00 H new ATOM 0 HB2 LYS A 94 149.021 6.993 3.336 1.00 0.00 H new ATOM 0 HB3 LYS A 94 148.447 6.506 4.918 1.00 0.00 H new ATOM 0 HG2 LYS A 94 146.884 4.851 3.820 1.00 0.00 H new ATOM 0 HG3 LYS A 94 147.512 5.317 2.252 1.00 0.00 H new ATOM 0 HD2 LYS A 94 149.838 4.663 3.039 1.00 0.00 H new ATOM 0 HD3 LYS A 94 149.137 4.101 4.544 1.00 0.00 H new ATOM 0 HE2 LYS A 94 147.619 2.990 2.320 1.00 0.00 H new ATOM 0 HE3 LYS A 94 149.323 2.672 2.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 147.844 1.122 3.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 149.479 1.405 3.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 148.267 2.255 4.773 1.00 0.00 H new ATOM 1251 N GLU A 95 147.587 9.930 3.872 1.00 0.00 N ATOM 1252 CA GLU A 95 147.890 11.159 4.621 1.00 0.00 C ATOM 1253 C GLU A 95 147.068 12.376 4.184 1.00 0.00 C ATOM 1254 O GLU A 95 146.444 13.030 5.016 1.00 0.00 O ATOM 1255 CB GLU A 95 149.377 11.487 4.478 1.00 0.00 C ATOM 1256 CG GLU A 95 149.742 12.631 5.426 1.00 0.00 C ATOM 1257 CD GLU A 95 151.202 13.026 5.229 1.00 0.00 C ATOM 1258 OE1 GLU A 95 151.842 12.444 4.369 1.00 0.00 O ATOM 1259 OE2 GLU A 95 151.658 13.905 5.942 1.00 0.00 O ATOM 0 H GLU A 95 147.671 10.003 2.858 1.00 0.00 H new ATOM 0 HA GLU A 95 147.622 10.957 5.658 1.00 0.00 H new ATOM 0 HB2 GLU A 95 149.978 10.606 4.706 1.00 0.00 H new ATOM 0 HB3 GLU A 95 149.601 11.768 3.449 1.00 0.00 H new ATOM 0 HG2 GLU A 95 149.096 13.489 5.239 1.00 0.00 H new ATOM 0 HG3 GLU A 95 149.576 12.325 6.459 1.00 0.00 H new ATOM 1266 N LYS A 96 147.115 12.719 2.905 1.00 0.00 N ATOM 1267 CA LYS A 96 146.409 13.909 2.421 1.00 0.00 C ATOM 1268 C LYS A 96 144.891 13.721 2.313 1.00 0.00 C ATOM 1269 O LYS A 96 144.155 14.705 2.219 1.00 0.00 O ATOM 1270 CB LYS A 96 146.962 14.319 1.054 1.00 0.00 C ATOM 1271 CG LYS A 96 146.540 15.757 0.740 1.00 0.00 C ATOM 1272 CD LYS A 96 147.076 16.161 -0.634 1.00 0.00 C ATOM 1273 CE LYS A 96 146.842 17.657 -0.851 1.00 0.00 C ATOM 1274 NZ LYS A 96 146.170 17.873 -2.163 1.00 0.00 N ATOM 0 H LYS A 96 147.625 12.203 2.188 1.00 0.00 H new ATOM 0 HA LYS A 96 146.581 14.689 3.162 1.00 0.00 H new ATOM 0 HB2 LYS A 96 148.049 14.239 1.051 1.00 0.00 H new ATOM 0 HB3 LYS A 96 146.591 13.644 0.283 1.00 0.00 H new ATOM 0 HG2 LYS A 96 145.453 15.839 0.756 1.00 0.00 H new ATOM 0 HG3 LYS A 96 146.922 16.434 1.504 1.00 0.00 H new ATOM 0 HD2 LYS A 96 148.140 15.934 -0.702 1.00 0.00 H new ATOM 0 HD3 LYS A 96 146.577 15.587 -1.415 1.00 0.00 H new ATOM 0 HE2 LYS A 96 146.228 18.060 -0.046 1.00 0.00 H new ATOM 0 HE3 LYS A 96 147.792 18.191 -0.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 146.012 18.891 -2.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 146.772 17.503 -2.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 145.256 17.376 -2.171 1.00 0.00 H new ATOM 1288 N TRP A 97 144.402 12.487 2.329 1.00 0.00 N ATOM 1289 CA TRP A 97 142.960 12.282 2.218 1.00 0.00 C ATOM 1290 C TRP A 97 142.297 12.112 3.582 1.00 0.00 C ATOM 1291 O TRP A 97 141.292 12.765 3.866 1.00 0.00 O ATOM 1292 CB TRP A 97 142.661 11.067 1.343 1.00 0.00 C ATOM 1293 CG TRP A 97 142.714 11.466 -0.101 1.00 0.00 C ATOM 1294 CD1 TRP A 97 143.796 11.352 -0.903 1.00 0.00 C ATOM 1295 CD2 TRP A 97 141.657 12.042 -0.926 1.00 0.00 C ATOM 1296 NE1 TRP A 97 143.476 11.813 -2.164 1.00 0.00 N ATOM 1297 CE2 TRP A 97 142.168 12.250 -2.230 1.00 0.00 C ATOM 1298 CE3 TRP A 97 140.321 12.396 -0.672 1.00 0.00 C ATOM 1299 CZ2 TRP A 97 141.380 12.793 -3.245 1.00 0.00 C ATOM 1300 CZ3 TRP A 97 139.524 12.943 -1.692 1.00 0.00 C ATOM 1301 CH2 TRP A 97 140.053 13.141 -2.976 1.00 0.00 C ATOM 0 H TRP A 97 144.960 11.637 2.415 1.00 0.00 H new ATOM 0 HA TRP A 97 142.544 13.177 1.755 1.00 0.00 H new ATOM 0 HB2 TRP A 97 143.385 10.277 1.540 1.00 0.00 H new ATOM 0 HB3 TRP A 97 141.677 10.665 1.584 1.00 0.00 H new ATOM 0 HD1 TRP A 97 144.758 10.962 -0.605 1.00 0.00 H new ATOM 0 HE1 TRP A 97 144.126 11.829 -2.950 1.00 0.00 H new ATOM 0 HE3 TRP A 97 139.904 12.247 0.313 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 141.792 12.944 -4.232 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 138.499 13.212 -1.486 1.00 0.00 H new ATOM 0 HH2 TRP A 97 139.436 13.562 -3.756 1.00 0.00 H new ATOM 1312 N VAL A 98 142.830 11.226 4.421 1.00 0.00 N ATOM 1313 CA VAL A 98 142.226 11.000 5.727 1.00 0.00 C ATOM 1314 C VAL A 98 141.824 12.320 6.388 1.00 0.00 C ATOM 1315 O VAL A 98 140.713 12.437 6.901 1.00 0.00 O ATOM 1316 CB VAL A 98 143.171 10.207 6.639 1.00 0.00 C ATOM 1317 CG1 VAL A 98 142.366 9.148 7.396 1.00 0.00 C ATOM 1318 CG2 VAL A 98 144.244 9.510 5.796 1.00 0.00 C ATOM 0 H VAL A 98 143.659 10.666 4.225 1.00 0.00 H new ATOM 0 HA VAL A 98 141.322 10.410 5.574 1.00 0.00 H new ATOM 0 HB VAL A 98 143.649 10.889 7.343 1.00 0.00 H new ATOM 0 HG11 VAL A 98 143.032 8.581 8.046 1.00 0.00 H new ATOM 0 HG12 VAL A 98 141.599 9.635 7.998 1.00 0.00 H new ATOM 0 HG13 VAL A 98 141.893 8.473 6.683 1.00 0.00 H new ATOM 0 HG21 VAL A 98 144.912 8.949 6.449 1.00 0.00 H new ATOM 0 HG22 VAL A 98 143.767 8.828 5.092 1.00 0.00 H new ATOM 0 HG23 VAL A 98 144.817 10.257 5.247 1.00 0.00 H new ATOM 1322 N PRO A 99 142.685 13.313 6.392 1.00 0.00 N ATOM 1323 CA PRO A 99 142.371 14.631 7.018 1.00 0.00 C ATOM 1324 C PRO A 99 141.247 15.364 6.293 1.00 0.00 C ATOM 1325 O PRO A 99 140.397 15.991 6.925 1.00 0.00 O ATOM 1326 CB PRO A 99 143.683 15.423 6.925 1.00 0.00 C ATOM 1327 CG PRO A 99 144.739 14.431 6.563 1.00 0.00 C ATOM 1328 CD PRO A 99 144.033 13.306 5.813 1.00 0.00 C ATOM 0 HA PRO A 99 142.019 14.509 8.043 1.00 0.00 H new ATOM 0 HB2 PRO A 99 143.612 16.209 6.173 1.00 0.00 H new ATOM 0 HB3 PRO A 99 143.913 15.909 7.873 1.00 0.00 H new ATOM 0 HG2 PRO A 99 145.507 14.891 5.941 1.00 0.00 H new ATOM 0 HG3 PRO A 99 145.237 14.051 7.455 1.00 0.00 H new ATOM 0 HD2 PRO A 99 144.011 13.490 4.739 1.00 0.00 H new ATOM 0 HD3 PRO A 99 144.531 12.348 5.962 1.00 0.00 H new ATOM 1336 N GLU A 100 141.247 15.291 4.962 1.00 0.00 N ATOM 1337 CA GLU A 100 140.218 15.965 4.178 1.00 0.00 C ATOM 1338 C GLU A 100 138.831 15.393 4.469 1.00 0.00 C ATOM 1339 O GLU A 100 137.845 16.129 4.486 1.00 0.00 O ATOM 1340 CB GLU A 100 140.525 15.832 2.687 1.00 0.00 C ATOM 1341 CG GLU A 100 141.782 16.636 2.352 1.00 0.00 C ATOM 1342 CD GLU A 100 142.087 16.532 0.862 1.00 0.00 C ATOM 1343 OE1 GLU A 100 141.444 15.734 0.200 1.00 0.00 O ATOM 1344 OE2 GLU A 100 142.959 17.253 0.404 1.00 0.00 O ATOM 0 H GLU A 100 141.938 14.780 4.413 1.00 0.00 H new ATOM 0 HA GLU A 100 140.219 17.018 4.461 1.00 0.00 H new ATOM 0 HB2 GLU A 100 140.671 14.784 2.427 1.00 0.00 H new ATOM 0 HB3 GLU A 100 139.682 16.192 2.098 1.00 0.00 H new ATOM 0 HG2 GLU A 100 141.640 17.680 2.630 1.00 0.00 H new ATOM 0 HG3 GLU A 100 142.627 16.263 2.931 1.00 0.00 H new ATOM 1351 N ILE A 101 138.756 14.084 4.692 1.00 0.00 N ATOM 1352 CA ILE A 101 137.469 13.451 4.971 1.00 0.00 C ATOM 1353 C ILE A 101 137.169 13.441 6.472 1.00 0.00 C ATOM 1354 O ILE A 101 136.009 13.526 6.877 1.00 0.00 O ATOM 1355 CB ILE A 101 137.450 12.025 4.407 1.00 0.00 C ATOM 1356 CG1 ILE A 101 138.396 11.128 5.207 1.00 0.00 C ATOM 1357 CG2 ILE A 101 137.899 12.052 2.945 1.00 0.00 C ATOM 1358 CD1 ILE A 101 138.365 9.707 4.635 1.00 0.00 C ATOM 0 H ILE A 101 139.555 13.450 4.686 1.00 0.00 H new ATOM 0 HA ILE A 101 136.689 14.035 4.482 1.00 0.00 H new ATOM 0 HB ILE A 101 136.437 11.629 4.478 1.00 0.00 H new ATOM 0 HG12 ILE A 101 139.410 11.525 5.167 1.00 0.00 H new ATOM 0 HG13 ILE A 101 138.100 11.115 6.256 1.00 0.00 H new ATOM 0 HG21 ILE A 101 137.886 11.039 2.542 1.00 0.00 H new ATOM 0 HG22 ILE A 101 137.221 12.681 2.368 1.00 0.00 H new ATOM 0 HG23 ILE A 101 138.910 12.455 2.882 1.00 0.00 H new ATOM 0 HD11 ILE A 101 139.040 9.070 5.207 1.00 0.00 H new ATOM 0 HD12 ILE A 101 137.351 9.311 4.699 1.00 0.00 H new ATOM 0 HD13 ILE A 101 138.682 9.728 3.592 1.00 0.00 H new ATOM 1362 N THR A 102 138.211 13.335 7.296 1.00 0.00 N ATOM 1363 CA THR A 102 138.022 13.314 8.748 1.00 0.00 C ATOM 1364 C THR A 102 138.298 14.686 9.358 1.00 0.00 C ATOM 1365 O THR A 102 138.516 14.799 10.565 1.00 0.00 O ATOM 1366 CB THR A 102 138.947 12.282 9.400 1.00 0.00 C ATOM 1367 OG1 THR A 102 140.299 12.623 9.136 1.00 0.00 O ATOM 1368 CG2 THR A 102 138.648 10.889 8.848 1.00 0.00 C ATOM 0 H THR A 102 139.181 13.263 6.990 1.00 0.00 H new ATOM 0 HA THR A 102 136.984 13.042 8.937 1.00 0.00 H new ATOM 0 HB THR A 102 138.778 12.279 10.477 1.00 0.00 H new ATOM 0 HG1 THR A 102 140.529 12.362 8.220 1.00 0.00 H new ATOM 0 HG21 THR A 102 139.311 10.162 9.317 1.00 0.00 H new ATOM 0 HG22 THR A 102 137.612 10.627 9.062 1.00 0.00 H new ATOM 0 HG23 THR A 102 138.808 10.883 7.770 1.00 0.00 H new ATOM 1373 N HIS A 103 138.296 15.722 8.528 1.00 0.00 N ATOM 1374 CA HIS A 103 138.556 17.070 9.023 1.00 0.00 C ATOM 1375 C HIS A 103 137.605 17.412 10.166 1.00 0.00 C ATOM 1376 O HIS A 103 138.026 17.924 11.203 1.00 0.00 O ATOM 1377 CB HIS A 103 138.384 18.089 7.896 1.00 0.00 C ATOM 1378 CG HIS A 103 138.817 19.444 8.382 1.00 0.00 C ATOM 1379 ND1 HIS A 103 140.141 19.737 8.667 1.00 0.00 N ATOM 1380 CD2 HIS A 103 138.115 20.594 8.644 1.00 0.00 C ATOM 1381 CE1 HIS A 103 140.195 21.017 9.079 1.00 0.00 C ATOM 1382 NE2 HIS A 103 138.987 21.586 9.085 1.00 0.00 N ATOM 0 H HIS A 103 138.120 15.659 7.525 1.00 0.00 H new ATOM 0 HA HIS A 103 139.582 17.107 9.390 1.00 0.00 H new ATOM 0 HB2 HIS A 103 138.976 17.794 7.030 1.00 0.00 H new ATOM 0 HB3 HIS A 103 137.343 18.121 7.574 1.00 0.00 H new ATOM 0 HD2 HIS A 103 137.048 20.712 8.526 1.00 0.00 H new ATOM 0 HE1 HIS A 103 141.104 21.522 9.369 1.00 0.00 H new ATOM 0 HE2 HIS A 103 138.753 22.542 9.355 1.00 0.00 H new ATOM 1390 N HIS A 104 136.322 17.121 9.972 1.00 0.00 N ATOM 1391 CA HIS A 104 135.326 17.399 11.000 1.00 0.00 C ATOM 1392 C HIS A 104 135.632 16.608 12.267 1.00 0.00 C ATOM 1393 O HIS A 104 135.524 17.126 13.378 1.00 0.00 O ATOM 1394 CB HIS A 104 133.932 17.027 10.489 1.00 0.00 C ATOM 1395 CG HIS A 104 132.895 17.507 11.466 1.00 0.00 C ATOM 1396 ND1 HIS A 104 132.436 16.716 12.506 1.00 0.00 N ATOM 1397 CD2 HIS A 104 132.215 18.695 11.570 1.00 0.00 C ATOM 1398 CE1 HIS A 104 131.520 17.431 13.187 1.00 0.00 C ATOM 1399 NE2 HIS A 104 131.348 18.645 12.658 1.00 0.00 N ATOM 0 H HIS A 104 135.951 16.697 9.122 1.00 0.00 H new ATOM 0 HA HIS A 104 135.356 18.464 11.232 1.00 0.00 H new ATOM 0 HB2 HIS A 104 133.760 17.475 9.510 1.00 0.00 H new ATOM 0 HB3 HIS A 104 133.856 15.947 10.363 1.00 0.00 H new ATOM 0 HD2 HIS A 104 132.335 19.540 10.908 1.00 0.00 H new ATOM 0 HE1 HIS A 104 130.990 17.067 14.055 1.00 0.00 H new ATOM 0 HE2 HIS A 104 130.717 19.378 12.982 1.00 0.00 H new ATOM 1407 N CYS A 105 136.013 15.347 12.087 1.00 0.00 N ATOM 1408 CA CYS A 105 136.333 14.480 13.217 1.00 0.00 C ATOM 1409 C CYS A 105 137.712 13.849 13.031 1.00 0.00 C ATOM 1410 O CYS A 105 137.829 12.751 12.489 1.00 0.00 O ATOM 1411 CB CYS A 105 135.282 13.374 13.336 1.00 0.00 C ATOM 1412 SG CYS A 105 135.207 12.798 15.050 1.00 0.00 S ATOM 0 H CYS A 105 136.108 14.904 11.173 1.00 0.00 H new ATOM 0 HA CYS A 105 136.337 15.082 14.126 1.00 0.00 H new ATOM 0 HB2 CYS A 105 134.307 13.748 13.024 1.00 0.00 H new ATOM 0 HB3 CYS A 105 135.533 12.546 12.673 1.00 0.00 H new ATOM 0 HG CYS A 105 135.958 11.746 15.187 1.00 0.00 H new ATOM 1418 N PRO A 106 138.753 14.516 13.460 1.00 0.00 N ATOM 1419 CA PRO A 106 140.145 13.997 13.322 1.00 0.00 C ATOM 1420 C PRO A 106 140.271 12.555 13.805 1.00 0.00 C ATOM 1421 O PRO A 106 141.121 11.802 13.326 1.00 0.00 O ATOM 1422 CB PRO A 106 140.974 14.942 14.195 1.00 0.00 C ATOM 1423 CG PRO A 106 140.198 16.215 14.246 1.00 0.00 C ATOM 1424 CD PRO A 106 138.722 15.833 14.119 1.00 0.00 C ATOM 0 HA PRO A 106 140.473 13.975 12.283 1.00 0.00 H new ATOM 0 HB2 PRO A 106 141.119 14.529 15.194 1.00 0.00 H new ATOM 0 HB3 PRO A 106 141.965 15.102 13.770 1.00 0.00 H new ATOM 0 HG2 PRO A 106 140.382 16.744 15.181 1.00 0.00 H new ATOM 0 HG3 PRO A 106 140.496 16.883 13.438 1.00 0.00 H new ATOM 0 HD2 PRO A 106 138.237 15.781 15.094 1.00 0.00 H new ATOM 0 HD3 PRO A 106 138.170 16.563 13.527 1.00 0.00 H new ATOM 1432 N LYS A 107 139.415 12.172 14.746 1.00 0.00 N ATOM 1433 CA LYS A 107 139.437 10.813 15.275 1.00 0.00 C ATOM 1434 C LYS A 107 138.288 9.999 14.687 1.00 0.00 C ATOM 1435 O LYS A 107 137.118 10.328 14.887 1.00 0.00 O ATOM 1436 CB LYS A 107 139.318 10.844 16.801 1.00 0.00 C ATOM 1437 CG LYS A 107 140.549 11.532 17.395 1.00 0.00 C ATOM 1438 CD LYS A 107 140.470 11.492 18.923 1.00 0.00 C ATOM 1439 CE LYS A 107 141.649 12.267 19.515 1.00 0.00 C ATOM 1440 NZ LYS A 107 141.145 13.272 20.495 1.00 0.00 N ATOM 0 H LYS A 107 138.703 12.777 15.155 1.00 0.00 H new ATOM 0 HA LYS A 107 140.382 10.345 14.997 1.00 0.00 H new ATOM 0 HB2 LYS A 107 138.413 11.376 17.095 1.00 0.00 H new ATOM 0 HB3 LYS A 107 139.232 9.830 17.190 1.00 0.00 H new ATOM 0 HG2 LYS A 107 141.457 11.034 17.054 1.00 0.00 H new ATOM 0 HG3 LYS A 107 140.603 12.565 17.050 1.00 0.00 H new ATOM 0 HD2 LYS A 107 139.529 11.926 19.261 1.00 0.00 H new ATOM 0 HD3 LYS A 107 140.488 10.459 19.272 1.00 0.00 H new ATOM 0 HE2 LYS A 107 142.339 11.580 20.005 1.00 0.00 H new ATOM 0 HE3 LYS A 107 142.205 12.765 18.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 141.947 13.798 20.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 140.503 13.934 20.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 140.633 12.786 21.259 1.00 0.00 H new ATOM 1454 N THR A 108 138.624 8.940 13.957 1.00 0.00 N ATOM 1455 CA THR A 108 137.606 8.095 13.344 1.00 0.00 C ATOM 1456 C THR A 108 138.233 6.827 12.752 1.00 0.00 C ATOM 1457 O THR A 108 138.817 6.876 11.670 1.00 0.00 O ATOM 1458 CB THR A 108 136.897 8.877 12.234 1.00 0.00 C ATOM 1459 OG1 THR A 108 135.973 9.787 12.816 1.00 0.00 O ATOM 1460 CG2 THR A 108 136.151 7.907 11.317 1.00 0.00 C ATOM 0 H THR A 108 139.585 8.649 13.777 1.00 0.00 H new ATOM 0 HA THR A 108 136.890 7.802 14.112 1.00 0.00 H new ATOM 0 HB THR A 108 137.634 9.428 11.650 1.00 0.00 H new ATOM 0 HG1 THR A 108 136.094 9.799 13.788 1.00 0.00 H new ATOM 0 HG21 THR A 108 135.648 8.466 10.528 1.00 0.00 H new ATOM 0 HG22 THR A 108 136.860 7.209 10.871 1.00 0.00 H new ATOM 0 HG23 THR A 108 135.413 7.353 11.897 1.00 0.00 H new ATOM 1465 N PRO A 109 138.128 5.701 13.422 1.00 0.00 N ATOM 1466 CA PRO A 109 138.705 4.420 12.914 1.00 0.00 C ATOM 1467 C PRO A 109 138.312 4.151 11.464 1.00 0.00 C ATOM 1468 O PRO A 109 137.229 4.539 11.020 1.00 0.00 O ATOM 1469 CB PRO A 109 138.119 3.356 13.844 1.00 0.00 C ATOM 1470 CG PRO A 109 137.780 4.075 15.108 1.00 0.00 C ATOM 1471 CD PRO A 109 137.459 5.520 14.722 1.00 0.00 C ATOM 0 HA PRO A 109 139.795 4.435 12.916 1.00 0.00 H new ATOM 0 HB2 PRO A 109 137.234 2.895 13.405 1.00 0.00 H new ATOM 0 HB3 PRO A 109 138.837 2.557 14.027 1.00 0.00 H new ATOM 0 HG2 PRO A 109 136.928 3.608 15.602 1.00 0.00 H new ATOM 0 HG3 PRO A 109 138.614 4.038 15.809 1.00 0.00 H new ATOM 0 HD2 PRO A 109 136.384 5.682 14.643 1.00 0.00 H new ATOM 0 HD3 PRO A 109 137.834 6.224 15.465 1.00 0.00 H new ATOM 1479 N PHE A 110 139.198 3.491 10.724 1.00 0.00 N ATOM 1480 CA PHE A 110 138.916 3.190 9.325 1.00 0.00 C ATOM 1481 C PHE A 110 139.564 1.883 8.891 1.00 0.00 C ATOM 1482 O PHE A 110 140.486 1.385 9.537 1.00 0.00 O ATOM 1483 CB PHE A 110 139.424 4.322 8.428 1.00 0.00 C ATOM 1484 CG PHE A 110 140.903 4.538 8.651 1.00 0.00 C ATOM 1485 CD1 PHE A 110 141.838 3.639 8.115 1.00 0.00 C ATOM 1486 CD2 PHE A 110 141.340 5.645 9.387 1.00 0.00 C ATOM 1487 CE1 PHE A 110 143.205 3.852 8.317 1.00 0.00 C ATOM 1488 CE2 PHE A 110 142.710 5.857 9.586 1.00 0.00 C ATOM 1489 CZ PHE A 110 143.642 4.962 9.050 1.00 0.00 C ATOM 0 H PHE A 110 140.102 3.160 11.062 1.00 0.00 H new ATOM 0 HA PHE A 110 137.835 3.091 9.225 1.00 0.00 H new ATOM 0 HB2 PHE A 110 139.238 4.079 7.382 1.00 0.00 H new ATOM 0 HB3 PHE A 110 138.878 5.240 8.644 1.00 0.00 H new ATOM 0 HD1 PHE A 110 141.502 2.784 7.547 1.00 0.00 H new ATOM 0 HD2 PHE A 110 140.621 6.336 9.802 1.00 0.00 H new ATOM 0 HE1 PHE A 110 143.925 3.159 7.907 1.00 0.00 H new ATOM 0 HE2 PHE A 110 143.047 6.712 10.154 1.00 0.00 H new ATOM 0 HZ PHE A 110 144.698 5.127 9.202 1.00 0.00 H new ATOM 1499 N LEU A 111 139.093 1.346 7.774 1.00 0.00 N ATOM 1500 CA LEU A 111 139.654 0.110 7.245 1.00 0.00 C ATOM 1501 C LEU A 111 140.779 0.429 6.275 1.00 0.00 C ATOM 1502 O LEU A 111 140.619 1.247 5.368 1.00 0.00 O ATOM 1503 CB LEU A 111 138.573 -0.711 6.541 1.00 0.00 C ATOM 1504 CG LEU A 111 137.614 -1.282 7.588 1.00 0.00 C ATOM 1505 CD1 LEU A 111 136.803 -0.147 8.223 1.00 0.00 C ATOM 1506 CD2 LEU A 111 136.659 -2.278 6.923 1.00 0.00 C ATOM 0 H LEU A 111 138.332 1.741 7.221 1.00 0.00 H new ATOM 0 HA LEU A 111 140.050 -0.477 8.074 1.00 0.00 H new ATOM 0 HB2 LEU A 111 138.028 -0.086 5.833 1.00 0.00 H new ATOM 0 HB3 LEU A 111 139.028 -1.519 5.968 1.00 0.00 H new ATOM 0 HG LEU A 111 138.191 -1.790 8.360 1.00 0.00 H new ATOM 0 HD11 LEU A 111 136.122 -0.559 8.968 1.00 0.00 H new ATOM 0 HD12 LEU A 111 137.480 0.560 8.702 1.00 0.00 H new ATOM 0 HD13 LEU A 111 136.229 0.366 7.451 1.00 0.00 H new ATOM 0 HD21 LEU A 111 135.977 -2.683 7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 111 136.086 -1.770 6.147 1.00 0.00 H new ATOM 0 HD23 LEU A 111 137.233 -3.090 6.477 1.00 0.00 H new ATOM 1512 N LEU A 112 141.921 -0.213 6.477 1.00 0.00 N ATOM 1513 CA LEU A 112 143.069 0.022 5.615 1.00 0.00 C ATOM 1514 C LEU A 112 143.119 -1.019 4.507 1.00 0.00 C ATOM 1515 O LEU A 112 143.175 -2.221 4.765 1.00 0.00 O ATOM 1516 CB LEU A 112 144.358 -0.025 6.438 1.00 0.00 C ATOM 1517 CG LEU A 112 145.553 0.351 5.557 1.00 0.00 C ATOM 1518 CD1 LEU A 112 145.490 1.838 5.196 1.00 0.00 C ATOM 1519 CD2 LEU A 112 146.852 0.071 6.319 1.00 0.00 C ATOM 0 H LEU A 112 142.076 -0.893 7.221 1.00 0.00 H new ATOM 0 HA LEU A 112 142.972 1.009 5.162 1.00 0.00 H new ATOM 0 HB2 LEU A 112 144.287 0.662 7.281 1.00 0.00 H new ATOM 0 HB3 LEU A 112 144.500 -1.024 6.851 1.00 0.00 H new ATOM 0 HG LEU A 112 145.524 -0.242 4.643 1.00 0.00 H new ATOM 0 HD11 LEU A 112 146.344 2.097 4.569 1.00 0.00 H new ATOM 0 HD12 LEU A 112 144.567 2.042 4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 112 145.515 2.435 6.108 1.00 0.00 H new ATOM 0 HD21 LEU A 112 147.705 0.338 5.695 1.00 0.00 H new ATOM 0 HD22 LEU A 112 146.872 0.664 7.233 1.00 0.00 H new ATOM 0 HD23 LEU A 112 146.904 -0.988 6.572 1.00 0.00 H new ATOM 1525 N VAL A 113 143.094 -0.540 3.273 1.00 0.00 N ATOM 1526 CA VAL A 113 143.132 -1.417 2.114 1.00 0.00 C ATOM 1527 C VAL A 113 144.102 -0.867 1.080 1.00 0.00 C ATOM 1528 O VAL A 113 144.537 0.280 1.178 1.00 0.00 O ATOM 1529 CB VAL A 113 141.736 -1.533 1.501 1.00 0.00 C ATOM 1530 CG1 VAL A 113 141.763 -2.551 0.360 1.00 0.00 C ATOM 1531 CG2 VAL A 113 140.748 -1.996 2.575 1.00 0.00 C ATOM 0 H VAL A 113 143.047 0.454 3.048 1.00 0.00 H new ATOM 0 HA VAL A 113 143.467 -2.405 2.429 1.00 0.00 H new ATOM 0 HB VAL A 113 141.426 -0.563 1.113 1.00 0.00 H new ATOM 0 HG11 VAL A 113 140.768 -2.634 -0.077 1.00 0.00 H new ATOM 0 HG12 VAL A 113 142.469 -2.223 -0.403 1.00 0.00 H new ATOM 0 HG13 VAL A 113 142.072 -3.522 0.746 1.00 0.00 H new ATOM 0 HG21 VAL A 113 139.752 -2.080 2.141 1.00 0.00 H new ATOM 0 HG22 VAL A 113 141.059 -2.967 2.961 1.00 0.00 H new ATOM 0 HG23 VAL A 113 140.729 -1.271 3.389 1.00 0.00 H new ATOM 1535 N GLY A 114 144.422 -1.671 0.075 1.00 0.00 N ATOM 1536 CA GLY A 114 145.322 -1.215 -0.971 1.00 0.00 C ATOM 1537 C GLY A 114 145.092 -1.979 -2.270 1.00 0.00 C ATOM 1538 O GLY A 114 145.592 -3.088 -2.447 1.00 0.00 O ATOM 0 H GLY A 114 144.078 -2.625 -0.036 1.00 0.00 H new ATOM 0 HA2 GLY A 114 145.174 -0.149 -1.142 1.00 0.00 H new ATOM 0 HA3 GLY A 114 146.355 -1.345 -0.648 1.00 0.00 H new ATOM 1542 N THR A 115 144.327 -1.381 -3.173 1.00 0.00 N ATOM 1543 CA THR A 115 144.036 -2.020 -4.449 1.00 0.00 C ATOM 1544 C THR A 115 145.327 -2.474 -5.123 1.00 0.00 C ATOM 1545 O THR A 115 146.422 -2.253 -4.606 1.00 0.00 O ATOM 1546 CB THR A 115 143.293 -1.055 -5.374 1.00 0.00 C ATOM 1547 OG1 THR A 115 144.234 -0.224 -6.039 1.00 0.00 O ATOM 1548 CG2 THR A 115 142.329 -0.191 -4.555 1.00 0.00 C ATOM 0 H THR A 115 143.900 -0.463 -3.048 1.00 0.00 H new ATOM 0 HA THR A 115 143.406 -2.888 -4.257 1.00 0.00 H new ATOM 0 HB THR A 115 142.724 -1.623 -6.110 1.00 0.00 H new ATOM 0 HG1 THR A 115 144.388 -0.564 -6.945 1.00 0.00 H new ATOM 0 HG21 THR A 115 141.802 0.495 -5.218 1.00 0.00 H new ATOM 0 HG22 THR A 115 141.608 -0.832 -4.048 1.00 0.00 H new ATOM 0 HG23 THR A 115 142.891 0.379 -3.815 1.00 0.00 H new ATOM 1553 N GLN A 116 145.186 -3.110 -6.278 1.00 0.00 N ATOM 1554 CA GLN A 116 146.341 -3.593 -7.030 1.00 0.00 C ATOM 1555 C GLN A 116 147.318 -4.346 -6.115 1.00 0.00 C ATOM 1556 O GLN A 116 148.518 -4.357 -6.368 1.00 0.00 O ATOM 1557 CB GLN A 116 147.041 -2.407 -7.693 1.00 0.00 C ATOM 1558 CG GLN A 116 147.914 -2.894 -8.853 1.00 0.00 C ATOM 1559 CD GLN A 116 147.035 -3.312 -10.025 1.00 0.00 C ATOM 1560 OE1 GLN A 116 146.040 -2.650 -10.321 1.00 0.00 O ATOM 1561 NE2 GLN A 116 147.341 -4.377 -10.714 1.00 0.00 N ATOM 0 H GLN A 116 144.286 -3.304 -6.716 1.00 0.00 H new ATOM 0 HA GLN A 116 145.998 -4.290 -7.795 1.00 0.00 H new ATOM 0 HB2 GLN A 116 146.301 -1.695 -8.058 1.00 0.00 H new ATOM 0 HB3 GLN A 116 147.655 -1.881 -6.961 1.00 0.00 H new ATOM 0 HG2 GLN A 116 148.596 -2.102 -9.163 1.00 0.00 H new ATOM 0 HG3 GLN A 116 148.528 -3.735 -8.530 1.00 0.00 H new ATOM 0 HE21 GLN A 116 148.166 -4.924 -10.468 1.00 0.00 H new ATOM 0 HE22 GLN A 116 146.756 -4.662 -11.499 1.00 0.00 H new ATOM 1568 N ILE A 117 146.786 -4.980 -5.061 1.00 0.00 N ATOM 1569 CA ILE A 117 147.595 -5.740 -4.117 1.00 0.00 C ATOM 1570 C ILE A 117 149.016 -5.184 -4.067 1.00 0.00 C ATOM 1571 O ILE A 117 149.196 -3.972 -4.137 1.00 0.00 O ATOM 1572 CB ILE A 117 147.562 -7.228 -4.500 1.00 0.00 C ATOM 1573 CG1 ILE A 117 147.944 -8.084 -3.290 1.00 0.00 C ATOM 1574 CG2 ILE A 117 148.497 -7.519 -5.672 1.00 0.00 C ATOM 1575 CD1 ILE A 117 147.706 -9.560 -3.611 1.00 0.00 C ATOM 0 H ILE A 117 145.789 -4.977 -4.846 1.00 0.00 H new ATOM 0 HA ILE A 117 147.183 -5.644 -3.112 1.00 0.00 H new ATOM 0 HB ILE A 117 146.548 -7.479 -4.813 1.00 0.00 H new ATOM 0 HG12 ILE A 117 148.991 -7.921 -3.033 1.00 0.00 H new ATOM 0 HG13 ILE A 117 147.353 -7.790 -2.423 1.00 0.00 H new ATOM 0 HG21 ILE A 117 148.451 -8.580 -5.919 1.00 0.00 H new ATOM 0 HG22 ILE A 117 148.190 -6.931 -6.537 1.00 0.00 H new ATOM 0 HG23 ILE A 117 149.518 -7.254 -5.397 1.00 0.00 H new ATOM 0 HD11 ILE A 117 147.978 -10.168 -2.749 1.00 0.00 H new ATOM 0 HD12 ILE A 117 146.653 -9.716 -3.847 1.00 0.00 H new ATOM 0 HD13 ILE A 117 148.316 -9.849 -4.466 1.00 0.00 H new ATOM 1579 N ASP A 118 150.018 -6.042 -3.949 1.00 0.00 N ATOM 1580 CA ASP A 118 151.390 -5.564 -3.896 1.00 0.00 C ATOM 1581 C ASP A 118 151.952 -5.446 -5.306 1.00 0.00 C ATOM 1582 O ASP A 118 153.119 -5.108 -5.492 1.00 0.00 O ATOM 1583 CB ASP A 118 152.254 -6.514 -3.066 1.00 0.00 C ATOM 1584 CG ASP A 118 151.798 -6.499 -1.611 1.00 0.00 C ATOM 1585 OD1 ASP A 118 151.030 -5.618 -1.261 1.00 0.00 O ATOM 1586 OD2 ASP A 118 152.220 -7.370 -0.869 1.00 0.00 O ATOM 0 H ASP A 118 149.911 -7.055 -3.889 1.00 0.00 H new ATOM 0 HA ASP A 118 151.401 -4.582 -3.424 1.00 0.00 H new ATOM 0 HB2 ASP A 118 152.185 -7.525 -3.467 1.00 0.00 H new ATOM 0 HB3 ASP A 118 153.301 -6.217 -3.131 1.00 0.00 H new ATOM 1591 N LEU A 119 151.081 -5.726 -6.277 1.00 0.00 N ATOM 1592 CA LEU A 119 151.402 -5.665 -7.706 1.00 0.00 C ATOM 1593 C LEU A 119 150.803 -6.873 -8.414 1.00 0.00 C ATOM 1594 O LEU A 119 151.436 -7.921 -8.499 1.00 0.00 O ATOM 1595 CB LEU A 119 152.915 -5.599 -7.953 1.00 0.00 C ATOM 1596 CG LEU A 119 153.211 -5.807 -9.441 1.00 0.00 C ATOM 1597 CD1 LEU A 119 152.364 -4.842 -10.271 1.00 0.00 C ATOM 1598 CD2 LEU A 119 154.694 -5.528 -9.704 1.00 0.00 C ATOM 0 H LEU A 119 150.118 -6.006 -6.091 1.00 0.00 H new ATOM 0 HA LEU A 119 150.970 -4.749 -8.110 1.00 0.00 H new ATOM 0 HB2 LEU A 119 153.303 -4.634 -7.628 1.00 0.00 H new ATOM 0 HB3 LEU A 119 153.422 -6.362 -7.363 1.00 0.00 H new ATOM 0 HG LEU A 119 152.972 -6.834 -9.719 1.00 0.00 H new ATOM 0 HD11 LEU A 119 152.575 -4.991 -11.330 1.00 0.00 H new ATOM 0 HD12 LEU A 119 151.307 -5.031 -10.082 1.00 0.00 H new ATOM 0 HD13 LEU A 119 152.605 -3.816 -9.994 1.00 0.00 H new ATOM 0 HD21 LEU A 119 154.910 -5.675 -10.762 1.00 0.00 H new ATOM 0 HD22 LEU A 119 154.926 -4.500 -9.426 1.00 0.00 H new ATOM 0 HD23 LEU A 119 155.303 -6.210 -9.111 1.00 0.00 H new ATOM 1604 N ARG A 120 149.566 -6.703 -8.902 1.00 0.00 N ATOM 1605 CA ARG A 120 148.835 -7.768 -9.601 1.00 0.00 C ATOM 1606 C ARG A 120 149.479 -9.126 -9.360 1.00 0.00 C ATOM 1607 O ARG A 120 149.898 -9.802 -10.301 1.00 0.00 O ATOM 1608 CB ARG A 120 148.806 -7.483 -11.104 1.00 0.00 C ATOM 1609 CG ARG A 120 147.789 -8.407 -11.779 1.00 0.00 C ATOM 1610 CD ARG A 120 147.890 -8.255 -13.298 1.00 0.00 C ATOM 1611 NE ARG A 120 147.639 -6.872 -13.685 1.00 0.00 N ATOM 1612 CZ ARG A 120 147.570 -6.520 -14.964 1.00 0.00 C ATOM 1613 NH1 ARG A 120 147.720 -7.420 -15.897 1.00 0.00 N ATOM 1614 NH2 ARG A 120 147.352 -5.274 -15.287 1.00 0.00 N ATOM 0 H ARG A 120 149.047 -5.828 -8.824 1.00 0.00 H new ATOM 0 HA ARG A 120 147.818 -7.790 -9.209 1.00 0.00 H new ATOM 0 HB2 ARG A 120 148.541 -6.441 -11.282 1.00 0.00 H new ATOM 0 HB3 ARG A 120 149.796 -7.638 -11.534 1.00 0.00 H new ATOM 0 HG2 ARG A 120 147.977 -9.442 -11.493 1.00 0.00 H new ATOM 0 HG3 ARG A 120 146.781 -8.162 -11.445 1.00 0.00 H new ATOM 0 HD2 ARG A 120 148.880 -8.561 -13.636 1.00 0.00 H new ATOM 0 HD3 ARG A 120 147.170 -8.913 -13.785 1.00 0.00 H new ATOM 0 HE ARG A 120 147.514 -6.163 -12.962 1.00 0.00 H new ATOM 0 HH11 ARG A 120 147.890 -8.393 -15.644 1.00 0.00 H new ATOM 0 HH12 ARG A 120 147.667 -7.150 -16.879 1.00 0.00 H new ATOM 0 HH21 ARG A 120 147.235 -4.571 -14.557 1.00 0.00 H new ATOM 0 HH22 ARG A 120 147.299 -5.003 -16.269 1.00 0.00 H new ATOM 1866 N ILE A 137 154.765 1.444 -2.743 1.00 0.00 N ATOM 1867 CA ILE A 137 154.726 1.254 -1.294 1.00 0.00 C ATOM 1868 C ILE A 137 154.399 -0.193 -0.940 1.00 0.00 C ATOM 1869 O ILE A 137 153.288 -0.671 -1.169 1.00 0.00 O ATOM 1870 CB ILE A 137 153.689 2.184 -0.664 1.00 0.00 C ATOM 1871 CG1 ILE A 137 153.479 1.777 0.797 1.00 0.00 C ATOM 1872 CG2 ILE A 137 152.367 2.078 -1.425 1.00 0.00 C ATOM 1873 CD1 ILE A 137 152.836 2.933 1.563 1.00 0.00 C ATOM 0 HA ILE A 137 155.713 1.494 -0.899 1.00 0.00 H new ATOM 0 HB ILE A 137 154.042 3.214 -0.713 1.00 0.00 H new ATOM 0 HG12 ILE A 137 152.843 0.893 0.851 1.00 0.00 H new ATOM 0 HG13 ILE A 137 154.433 1.512 1.252 1.00 0.00 H new ATOM 0 HG21 ILE A 137 151.632 2.743 -0.972 1.00 0.00 H new ATOM 0 HG22 ILE A 137 152.522 2.364 -2.465 1.00 0.00 H new ATOM 0 HG23 ILE A 137 152.003 1.051 -1.381 1.00 0.00 H new ATOM 0 HD11 ILE A 137 152.687 2.642 2.603 1.00 0.00 H new ATOM 0 HD12 ILE A 137 153.488 3.805 1.520 1.00 0.00 H new ATOM 0 HD13 ILE A 137 151.874 3.177 1.113 1.00 0.00 H new ATOM 1877 N THR A 138 155.379 -0.875 -0.359 1.00 0.00 N ATOM 1878 CA THR A 138 155.203 -2.262 0.055 1.00 0.00 C ATOM 1879 C THR A 138 155.769 -2.498 1.446 1.00 0.00 C ATOM 1880 O THR A 138 155.030 -2.809 2.385 1.00 0.00 O ATOM 1881 CB THR A 138 155.880 -3.223 -0.922 1.00 0.00 C ATOM 1882 OG1 THR A 138 156.699 -2.495 -1.823 1.00 0.00 O ATOM 1883 CG2 THR A 138 154.814 -3.993 -1.699 1.00 0.00 C ATOM 0 H THR A 138 156.303 -0.490 -0.164 1.00 0.00 H new ATOM 0 HA THR A 138 154.130 -2.454 0.064 1.00 0.00 H new ATOM 0 HB THR A 138 156.501 -3.926 -0.366 1.00 0.00 H new ATOM 0 HG1 THR A 138 157.132 -3.115 -2.446 1.00 0.00 H new ATOM 0 HG21 THR A 138 155.296 -4.679 -2.396 1.00 0.00 H new ATOM 0 HG22 THR A 138 154.194 -4.559 -1.003 1.00 0.00 H new ATOM 0 HG23 THR A 138 154.190 -3.292 -2.253 1.00 0.00 H new ATOM 1888 N PRO A 139 157.073 -2.381 1.582 1.00 0.00 N ATOM 1889 CA PRO A 139 157.794 -2.613 2.841 1.00 0.00 C ATOM 1890 C PRO A 139 156.923 -2.548 4.081 1.00 0.00 C ATOM 1891 O PRO A 139 155.919 -1.839 4.142 1.00 0.00 O ATOM 1892 CB PRO A 139 158.837 -1.503 2.815 1.00 0.00 C ATOM 1893 CG PRO A 139 159.175 -1.330 1.362 1.00 0.00 C ATOM 1894 CD PRO A 139 158.048 -1.991 0.550 1.00 0.00 C ATOM 0 HA PRO A 139 158.206 -3.620 2.902 1.00 0.00 H new ATOM 0 HB2 PRO A 139 158.444 -0.581 3.243 1.00 0.00 H new ATOM 0 HB3 PRO A 139 159.718 -1.774 3.397 1.00 0.00 H new ATOM 0 HG2 PRO A 139 159.261 -0.273 1.110 1.00 0.00 H new ATOM 0 HG3 PRO A 139 160.136 -1.791 1.133 1.00 0.00 H new ATOM 0 HD2 PRO A 139 157.614 -1.300 -0.173 1.00 0.00 H new ATOM 0 HD3 PRO A 139 158.408 -2.854 -0.010 1.00 0.00 H new ATOM 1902 N GLU A 140 157.363 -3.289 5.077 1.00 0.00 N ATOM 1903 CA GLU A 140 156.677 -3.347 6.360 1.00 0.00 C ATOM 1904 C GLU A 140 156.350 -1.940 6.856 1.00 0.00 C ATOM 1905 O GLU A 140 155.717 -1.774 7.898 1.00 0.00 O ATOM 1906 CB GLU A 140 157.555 -4.063 7.389 1.00 0.00 C ATOM 1907 CG GLU A 140 157.772 -5.512 6.954 1.00 0.00 C ATOM 1908 CD GLU A 140 158.581 -6.260 8.009 1.00 0.00 C ATOM 1909 OE1 GLU A 140 159.076 -5.612 8.916 1.00 0.00 O ATOM 1910 OE2 GLU A 140 158.693 -7.468 7.893 1.00 0.00 O ATOM 0 H GLU A 140 158.202 -3.867 5.025 1.00 0.00 H new ATOM 0 HA GLU A 140 155.746 -3.900 6.230 1.00 0.00 H new ATOM 0 HB2 GLU A 140 158.514 -3.553 7.483 1.00 0.00 H new ATOM 0 HB3 GLU A 140 157.081 -4.034 8.370 1.00 0.00 H new ATOM 0 HG2 GLU A 140 156.810 -6.003 6.806 1.00 0.00 H new ATOM 0 HG3 GLU A 140 158.294 -5.539 5.998 1.00 0.00 H new ATOM 1917 N THR A 141 156.776 -0.927 6.102 1.00 0.00 N ATOM 1918 CA THR A 141 156.512 0.451 6.475 1.00 0.00 C ATOM 1919 C THR A 141 155.109 0.873 6.045 1.00 0.00 C ATOM 1920 O THR A 141 154.641 1.947 6.423 1.00 0.00 O ATOM 1921 CB THR A 141 157.546 1.375 5.827 1.00 0.00 C ATOM 1922 OG1 THR A 141 157.391 1.339 4.415 1.00 0.00 O ATOM 1923 CG2 THR A 141 158.958 0.915 6.199 1.00 0.00 C ATOM 0 H THR A 141 157.302 -1.039 5.235 1.00 0.00 H new ATOM 0 HA THR A 141 156.581 0.529 7.560 1.00 0.00 H new ATOM 0 HB THR A 141 157.395 2.393 6.186 1.00 0.00 H new ATOM 0 HG1 THR A 141 158.051 1.931 3.998 1.00 0.00 H new ATOM 0 HG21 THR A 141 159.690 1.576 5.735 1.00 0.00 H new ATOM 0 HG22 THR A 141 159.077 0.945 7.282 1.00 0.00 H new ATOM 0 HG23 THR A 141 159.114 -0.104 5.845 1.00 0.00 H new ATOM 1928 N ALA A 142 154.424 0.025 5.270 1.00 0.00 N ATOM 1929 CA ALA A 142 153.070 0.356 4.841 1.00 0.00 C ATOM 1930 C ALA A 142 152.111 0.305 6.034 1.00 0.00 C ATOM 1931 O ALA A 142 151.325 1.230 6.263 1.00 0.00 O ATOM 1932 CB ALA A 142 152.608 -0.628 3.765 1.00 0.00 C ATOM 0 H ALA A 142 154.777 -0.872 4.936 1.00 0.00 H new ATOM 0 HA ALA A 142 153.070 1.365 4.428 1.00 0.00 H new ATOM 0 HB1 ALA A 142 151.596 -0.374 3.450 1.00 0.00 H new ATOM 0 HB2 ALA A 142 153.280 -0.572 2.908 1.00 0.00 H new ATOM 0 HB3 ALA A 142 152.619 -1.640 4.169 1.00 0.00 H new ATOM 1938 N GLU A 143 152.189 -0.782 6.795 1.00 0.00 N ATOM 1939 CA GLU A 143 151.333 -0.950 7.964 1.00 0.00 C ATOM 1940 C GLU A 143 151.631 0.120 9.008 1.00 0.00 C ATOM 1941 O GLU A 143 150.746 0.539 9.753 1.00 0.00 O ATOM 1942 CB GLU A 143 151.553 -2.336 8.575 1.00 0.00 C ATOM 1943 CG GLU A 143 151.113 -3.411 7.579 1.00 0.00 C ATOM 1944 CD GLU A 143 151.263 -4.793 8.205 1.00 0.00 C ATOM 1945 OE1 GLU A 143 151.810 -4.873 9.292 1.00 0.00 O ATOM 1946 OE2 GLU A 143 150.829 -5.751 7.588 1.00 0.00 O ATOM 0 H GLU A 143 152.832 -1.555 6.625 1.00 0.00 H new ATOM 0 HA GLU A 143 150.295 -0.851 7.647 1.00 0.00 H new ATOM 0 HB2 GLU A 143 152.604 -2.470 8.829 1.00 0.00 H new ATOM 0 HB3 GLU A 143 150.987 -2.430 9.501 1.00 0.00 H new ATOM 0 HG2 GLU A 143 150.076 -3.245 7.287 1.00 0.00 H new ATOM 0 HG3 GLU A 143 151.714 -3.346 6.672 1.00 0.00 H new ATOM 1953 N LYS A 144 152.885 0.559 9.054 1.00 0.00 N ATOM 1954 CA LYS A 144 153.291 1.581 10.008 1.00 0.00 C ATOM 1955 C LYS A 144 152.454 2.835 9.818 1.00 0.00 C ATOM 1956 O LYS A 144 152.032 3.468 10.785 1.00 0.00 O ATOM 1957 CB LYS A 144 154.769 1.921 9.817 1.00 0.00 C ATOM 1958 CG LYS A 144 155.214 2.898 10.905 1.00 0.00 C ATOM 1959 CD LYS A 144 156.676 3.285 10.678 1.00 0.00 C ATOM 1960 CE LYS A 144 157.162 4.148 11.844 1.00 0.00 C ATOM 1961 NZ LYS A 144 158.599 4.488 11.644 1.00 0.00 N ATOM 0 H LYS A 144 153.632 0.225 8.445 1.00 0.00 H new ATOM 0 HA LYS A 144 153.138 1.196 11.016 1.00 0.00 H new ATOM 0 HB2 LYS A 144 155.370 1.013 9.861 1.00 0.00 H new ATOM 0 HB3 LYS A 144 154.927 2.361 8.832 1.00 0.00 H new ATOM 0 HG2 LYS A 144 154.585 3.788 10.889 1.00 0.00 H new ATOM 0 HG3 LYS A 144 155.096 2.442 11.888 1.00 0.00 H new ATOM 0 HD2 LYS A 144 157.291 2.389 10.593 1.00 0.00 H new ATOM 0 HD3 LYS A 144 156.777 3.831 9.740 1.00 0.00 H new ATOM 0 HE2 LYS A 144 156.567 5.059 11.909 1.00 0.00 H new ATOM 0 HE3 LYS A 144 157.031 3.614 12.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 158.930 5.075 12.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 159.160 3.613 11.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 158.711 5.014 10.754 1.00 0.00 H new ATOM 1975 N LEU A 145 152.219 3.190 8.561 1.00 0.00 N ATOM 1976 CA LEU A 145 151.433 4.374 8.255 1.00 0.00 C ATOM 1977 C LEU A 145 150.143 4.363 9.061 1.00 0.00 C ATOM 1978 O LEU A 145 149.676 5.410 9.507 1.00 0.00 O ATOM 1979 CB LEU A 145 151.113 4.419 6.762 1.00 0.00 C ATOM 1980 CG LEU A 145 152.416 4.405 5.962 1.00 0.00 C ATOM 1981 CD1 LEU A 145 152.094 4.462 4.471 1.00 0.00 C ATOM 1982 CD2 LEU A 145 153.267 5.620 6.344 1.00 0.00 C ATOM 0 H LEU A 145 152.558 2.680 7.746 1.00 0.00 H new ATOM 0 HA LEU A 145 152.011 5.260 8.520 1.00 0.00 H new ATOM 0 HB2 LEU A 145 150.495 3.565 6.486 1.00 0.00 H new ATOM 0 HB3 LEU A 145 150.540 5.316 6.529 1.00 0.00 H new ATOM 0 HG LEU A 145 152.968 3.492 6.184 1.00 0.00 H new ATOM 0 HD11 LEU A 145 153.021 4.452 3.898 1.00 0.00 H new ATOM 0 HD12 LEU A 145 151.488 3.598 4.196 1.00 0.00 H new ATOM 0 HD13 LEU A 145 151.542 5.376 4.253 1.00 0.00 H new ATOM 0 HD21 LEU A 145 154.195 5.608 5.773 1.00 0.00 H new ATOM 0 HD22 LEU A 145 152.716 6.534 6.122 1.00 0.00 H new ATOM 0 HD23 LEU A 145 153.496 5.583 7.409 1.00 0.00 H new ATOM 1988 N ALA A 146 149.582 3.175 9.277 1.00 0.00 N ATOM 1989 CA ALA A 146 148.360 3.059 10.072 1.00 0.00 C ATOM 1990 C ALA A 146 148.677 3.306 11.544 1.00 0.00 C ATOM 1991 O ALA A 146 147.894 3.933 12.266 1.00 0.00 O ATOM 1992 CB ALA A 146 147.766 1.660 9.908 1.00 0.00 C ATOM 0 H ALA A 146 149.946 2.292 8.920 1.00 0.00 H new ATOM 0 HA ALA A 146 147.640 3.801 9.727 1.00 0.00 H new ATOM 0 HB1 ALA A 146 146.856 1.579 10.502 1.00 0.00 H new ATOM 0 HB2 ALA A 146 147.530 1.486 8.858 1.00 0.00 H new ATOM 0 HB3 ALA A 146 148.488 0.916 10.246 1.00 0.00 H new ATOM 1998 N ARG A 147 149.841 2.812 11.971 1.00 0.00 N ATOM 1999 CA ARG A 147 150.285 2.976 13.351 1.00 0.00 C ATOM 2000 C ARG A 147 150.503 4.446 13.676 1.00 0.00 C ATOM 2001 O ARG A 147 150.180 4.901 14.774 1.00 0.00 O ATOM 2002 CB ARG A 147 151.585 2.201 13.580 1.00 0.00 C ATOM 2003 CG ARG A 147 151.322 0.702 13.424 1.00 0.00 C ATOM 2004 CD ARG A 147 152.609 -0.073 13.709 1.00 0.00 C ATOM 2005 NE ARG A 147 152.952 0.024 15.123 1.00 0.00 N ATOM 2006 CZ ARG A 147 154.089 -0.483 15.591 1.00 0.00 C ATOM 2007 NH1 ARG A 147 154.919 -1.080 14.781 1.00 0.00 N ATOM 2008 NH2 ARG A 147 154.373 -0.382 16.861 1.00 0.00 N ATOM 0 H ARG A 147 150.491 2.295 11.379 1.00 0.00 H new ATOM 0 HA ARG A 147 149.509 2.584 14.008 1.00 0.00 H new ATOM 0 HB2 ARG A 147 152.343 2.524 12.867 1.00 0.00 H new ATOM 0 HB3 ARG A 147 151.975 2.411 14.576 1.00 0.00 H new ATOM 0 HG2 ARG A 147 150.535 0.387 14.109 1.00 0.00 H new ATOM 0 HG3 ARG A 147 150.971 0.486 12.415 1.00 0.00 H new ATOM 0 HD2 ARG A 147 152.482 -1.119 13.429 1.00 0.00 H new ATOM 0 HD3 ARG A 147 153.423 0.323 13.102 1.00 0.00 H new ATOM 0 HE ARG A 147 152.309 0.489 15.764 1.00 0.00 H new ATOM 0 HH11 ARG A 147 154.696 -1.158 13.789 1.00 0.00 H new ATOM 0 HH12 ARG A 147 155.791 -1.469 15.140 1.00 0.00 H new ATOM 0 HH21 ARG A 147 153.723 0.085 17.493 1.00 0.00 H new ATOM 0 HH22 ARG A 147 155.245 -0.770 17.221 1.00 0.00 H new ATOM 2022 N ASP A 148 151.035 5.195 12.714 1.00 0.00 N ATOM 2023 CA ASP A 148 151.262 6.616 12.927 1.00 0.00 C ATOM 2024 C ASP A 148 149.986 7.216 13.482 1.00 0.00 C ATOM 2025 O ASP A 148 150.008 8.108 14.330 1.00 0.00 O ATOM 2026 CB ASP A 148 151.630 7.298 11.608 1.00 0.00 C ATOM 2027 CG ASP A 148 152.987 6.801 11.122 1.00 0.00 C ATOM 2028 OD1 ASP A 148 153.703 6.219 11.920 1.00 0.00 O ATOM 2029 OD2 ASP A 148 153.288 7.005 9.957 1.00 0.00 O ATOM 0 H ASP A 148 151.312 4.847 11.796 1.00 0.00 H new ATOM 0 HA ASP A 148 152.086 6.763 13.626 1.00 0.00 H new ATOM 0 HB2 ASP A 148 150.868 7.090 10.857 1.00 0.00 H new ATOM 0 HB3 ASP A 148 151.657 8.379 11.744 1.00 0.00 H new ATOM 2034 N LEU A 149 148.872 6.683 13.003 1.00 0.00 N ATOM 2035 CA LEU A 149 147.563 7.115 13.447 1.00 0.00 C ATOM 2036 C LEU A 149 146.807 5.915 14.004 1.00 0.00 C ATOM 2037 O LEU A 149 147.172 5.356 15.037 1.00 0.00 O ATOM 2038 CB LEU A 149 146.781 7.712 12.271 1.00 0.00 C ATOM 2039 CG LEU A 149 147.566 8.874 11.660 1.00 0.00 C ATOM 2040 CD1 LEU A 149 146.759 9.486 10.511 1.00 0.00 C ATOM 2041 CD2 LEU A 149 147.816 9.938 12.730 1.00 0.00 C ATOM 0 H LEU A 149 148.853 5.944 12.300 1.00 0.00 H new ATOM 0 HA LEU A 149 147.675 7.875 14.220 1.00 0.00 H new ATOM 0 HB2 LEU A 149 146.601 6.946 11.516 1.00 0.00 H new ATOM 0 HB3 LEU A 149 145.805 8.060 12.611 1.00 0.00 H new ATOM 0 HG LEU A 149 148.520 8.509 11.280 1.00 0.00 H new ATOM 0 HD11 LEU A 149 147.318 10.314 10.075 1.00 0.00 H new ATOM 0 HD12 LEU A 149 146.579 8.728 9.749 1.00 0.00 H new ATOM 0 HD13 LEU A 149 145.805 9.852 10.891 1.00 0.00 H new ATOM 0 HD21 LEU A 149 148.375 10.767 12.296 1.00 0.00 H new ATOM 0 HD22 LEU A 149 146.862 10.304 13.109 1.00 0.00 H new ATOM 0 HD23 LEU A 149 148.389 9.503 13.549 1.00 0.00 H new ATOM 2047 N LYS A 150 145.748 5.538 13.310 1.00 0.00 N ATOM 2048 CA LYS A 150 144.934 4.411 13.739 1.00 0.00 C ATOM 2049 C LYS A 150 144.656 3.464 12.573 1.00 0.00 C ATOM 2050 O LYS A 150 145.585 2.864 12.036 1.00 0.00 O ATOM 2051 CB LYS A 150 143.624 4.925 14.345 1.00 0.00 C ATOM 2052 CG LYS A 150 142.939 3.796 15.119 1.00 0.00 C ATOM 2053 CD LYS A 150 141.653 4.322 15.761 1.00 0.00 C ATOM 2054 CE LYS A 150 141.119 3.286 16.752 1.00 0.00 C ATOM 2055 NZ LYS A 150 142.202 2.902 17.702 1.00 0.00 N ATOM 0 H LYS A 150 145.432 5.991 12.453 1.00 0.00 H new ATOM 0 HA LYS A 150 145.480 3.850 14.497 1.00 0.00 H new ATOM 0 HB2 LYS A 150 143.824 5.766 15.009 1.00 0.00 H new ATOM 0 HB3 LYS A 150 142.966 5.291 13.557 1.00 0.00 H new ATOM 0 HG2 LYS A 150 142.710 2.968 14.448 1.00 0.00 H new ATOM 0 HG3 LYS A 150 143.609 3.409 15.887 1.00 0.00 H new ATOM 0 HD2 LYS A 150 141.848 5.264 16.273 1.00 0.00 H new ATOM 0 HD3 LYS A 150 140.907 4.525 14.993 1.00 0.00 H new ATOM 0 HE2 LYS A 150 140.269 3.694 17.299 1.00 0.00 H new ATOM 0 HE3 LYS A 150 140.761 2.406 16.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 141.788 2.689 18.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 142.697 2.061 17.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 142.877 3.688 17.795 1.00 0.00 H new ATOM 2069 N ALA A 151 143.372 3.322 12.228 1.00 0.00 N ATOM 2070 CA ALA A 151 142.910 2.434 11.154 1.00 0.00 C ATOM 2071 C ALA A 151 142.171 1.249 11.765 1.00 0.00 C ATOM 2072 O ALA A 151 141.771 1.297 12.926 1.00 0.00 O ATOM 2073 CB ALA A 151 144.065 1.915 10.291 1.00 0.00 C ATOM 0 H ALA A 151 142.615 3.826 12.691 1.00 0.00 H new ATOM 0 HA ALA A 151 142.249 3.013 10.509 1.00 0.00 H new ATOM 0 HB1 ALA A 151 143.672 1.263 9.511 1.00 0.00 H new ATOM 0 HB2 ALA A 151 144.584 2.757 9.833 1.00 0.00 H new ATOM 0 HB3 ALA A 151 144.762 1.355 10.915 1.00 0.00 H new ATOM 2079 N VAL A 152 141.994 0.189 10.985 1.00 0.00 N ATOM 2080 CA VAL A 152 141.310 -1.003 11.487 1.00 0.00 C ATOM 2081 C VAL A 152 141.851 -2.255 10.805 1.00 0.00 C ATOM 2082 O VAL A 152 142.432 -3.124 11.455 1.00 0.00 O ATOM 2083 CB VAL A 152 139.799 -0.895 11.266 1.00 0.00 C ATOM 2084 CG1 VAL A 152 139.144 -2.250 11.535 1.00 0.00 C ATOM 2085 CG2 VAL A 152 139.220 0.146 12.228 1.00 0.00 C ATOM 0 H VAL A 152 142.308 0.127 10.017 1.00 0.00 H new ATOM 0 HA VAL A 152 141.499 -1.077 12.558 1.00 0.00 H new ATOM 0 HB VAL A 152 139.603 -0.594 10.237 1.00 0.00 H new ATOM 0 HG11 VAL A 152 138.068 -2.172 11.377 1.00 0.00 H new ATOM 0 HG12 VAL A 152 139.557 -2.995 10.855 1.00 0.00 H new ATOM 0 HG13 VAL A 152 139.339 -2.550 12.565 1.00 0.00 H new ATOM 0 HG21 VAL A 152 138.144 0.226 12.073 1.00 0.00 H new ATOM 0 HG22 VAL A 152 139.417 -0.159 13.256 1.00 0.00 H new ATOM 0 HG23 VAL A 152 139.686 1.113 12.041 1.00 0.00 H new ATOM 2089 N LYS A 153 141.671 -2.340 9.491 1.00 0.00 N ATOM 2090 CA LYS A 153 142.166 -3.492 8.739 1.00 0.00 C ATOM 2091 C LYS A 153 143.615 -3.238 8.333 1.00 0.00 C ATOM 2092 O LYS A 153 144.199 -2.234 8.739 1.00 0.00 O ATOM 2093 CB LYS A 153 141.301 -3.719 7.494 1.00 0.00 C ATOM 2094 CG LYS A 153 141.217 -5.218 7.177 1.00 0.00 C ATOM 2095 CD LYS A 153 140.138 -5.875 8.049 1.00 0.00 C ATOM 2096 CE LYS A 153 140.032 -7.366 7.709 1.00 0.00 C ATOM 2097 NZ LYS A 153 140.734 -7.642 6.424 1.00 0.00 N ATOM 0 H LYS A 153 141.193 -1.636 8.929 1.00 0.00 H new ATOM 0 HA LYS A 153 142.114 -4.384 9.363 1.00 0.00 H new ATOM 0 HB2 LYS A 153 140.301 -3.317 7.658 1.00 0.00 H new ATOM 0 HB3 LYS A 153 141.724 -3.183 6.645 1.00 0.00 H new ATOM 0 HG2 LYS A 153 140.983 -5.363 6.122 1.00 0.00 H new ATOM 0 HG3 LYS A 153 142.182 -5.692 7.358 1.00 0.00 H new ATOM 0 HD2 LYS A 153 140.384 -5.750 9.104 1.00 0.00 H new ATOM 0 HD3 LYS A 153 139.178 -5.386 7.885 1.00 0.00 H new ATOM 0 HE2 LYS A 153 140.470 -7.963 8.509 1.00 0.00 H new ATOM 0 HE3 LYS A 153 138.984 -7.657 7.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 140.426 -8.563 6.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 140.505 -6.896 5.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 141.761 -7.660 6.586 1.00 0.00 H new ATOM 2111 N TYR A 154 144.205 -4.125 7.531 1.00 0.00 N ATOM 2112 CA TYR A 154 145.578 -3.924 7.106 1.00 0.00 C ATOM 2113 C TYR A 154 145.911 -4.937 6.042 1.00 0.00 C ATOM 2114 O TYR A 154 146.255 -6.081 6.334 1.00 0.00 O ATOM 2115 CB TYR A 154 146.532 -4.055 8.301 1.00 0.00 C ATOM 2116 CG TYR A 154 146.566 -5.486 8.787 1.00 0.00 C ATOM 2117 CD1 TYR A 154 145.526 -5.978 9.583 1.00 0.00 C ATOM 2118 CD2 TYR A 154 147.638 -6.319 8.444 1.00 0.00 C ATOM 2119 CE1 TYR A 154 145.556 -7.303 10.037 1.00 0.00 C ATOM 2120 CE2 TYR A 154 147.669 -7.643 8.896 1.00 0.00 C ATOM 2121 CZ TYR A 154 146.628 -8.135 9.692 1.00 0.00 C ATOM 2122 OH TYR A 154 146.657 -9.441 10.137 1.00 0.00 O ATOM 0 H TYR A 154 143.760 -4.970 7.172 1.00 0.00 H new ATOM 0 HA TYR A 154 145.694 -2.920 6.697 1.00 0.00 H new ATOM 0 HB2 TYR A 154 147.534 -3.737 8.012 1.00 0.00 H new ATOM 0 HB3 TYR A 154 146.209 -3.397 9.108 1.00 0.00 H new ATOM 0 HD1 TYR A 154 144.699 -5.336 9.848 1.00 0.00 H new ATOM 0 HD2 TYR A 154 148.441 -5.939 7.830 1.00 0.00 H new ATOM 0 HE1 TYR A 154 144.753 -7.682 10.652 1.00 0.00 H new ATOM 0 HE2 TYR A 154 148.496 -8.285 8.631 1.00 0.00 H new ATOM 0 HH TYR A 154 147.468 -9.881 9.807 1.00 0.00 H new ATOM 2132 N VAL A 155 145.782 -4.519 4.799 1.00 0.00 N ATOM 2133 CA VAL A 155 146.054 -5.415 3.706 1.00 0.00 C ATOM 2134 C VAL A 155 146.019 -4.681 2.371 1.00 0.00 C ATOM 2135 O VAL A 155 145.958 -3.452 2.310 1.00 0.00 O ATOM 2136 CB VAL A 155 145.050 -6.586 3.749 1.00 0.00 C ATOM 2137 CG1 VAL A 155 143.913 -6.398 2.734 1.00 0.00 C ATOM 2138 CG2 VAL A 155 145.793 -7.893 3.461 1.00 0.00 C ATOM 0 H VAL A 155 145.495 -3.579 4.528 1.00 0.00 H new ATOM 0 HA VAL A 155 147.061 -5.818 3.810 1.00 0.00 H new ATOM 0 HB VAL A 155 144.602 -6.617 4.742 1.00 0.00 H new ATOM 0 HG11 VAL A 155 143.227 -7.243 2.795 1.00 0.00 H new ATOM 0 HG12 VAL A 155 143.375 -5.477 2.957 1.00 0.00 H new ATOM 0 HG13 VAL A 155 144.329 -6.340 1.728 1.00 0.00 H new ATOM 0 HG21 VAL A 155 145.090 -8.725 3.490 1.00 0.00 H new ATOM 0 HG22 VAL A 155 146.253 -7.840 2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 155 146.566 -8.045 4.214 1.00 0.00 H new ATOM 2142 N GLU A 156 146.035 -5.460 1.315 1.00 0.00 N ATOM 2143 CA GLU A 156 145.989 -4.925 -0.032 1.00 0.00 C ATOM 2144 C GLU A 156 145.369 -5.968 -0.937 1.00 0.00 C ATOM 2145 O GLU A 156 145.914 -7.042 -1.076 1.00 0.00 O ATOM 2146 CB GLU A 156 147.407 -4.594 -0.516 1.00 0.00 C ATOM 2147 CG GLU A 156 148.095 -3.659 0.482 1.00 0.00 C ATOM 2148 CD GLU A 156 149.414 -3.161 -0.100 1.00 0.00 C ATOM 2149 OE1 GLU A 156 149.806 -3.661 -1.141 1.00 0.00 O ATOM 2150 OE2 GLU A 156 150.012 -2.286 0.505 1.00 0.00 O ATOM 0 H GLU A 156 146.080 -6.478 1.361 1.00 0.00 H new ATOM 0 HA GLU A 156 145.396 -4.011 -0.049 1.00 0.00 H new ATOM 0 HB2 GLU A 156 147.986 -5.511 -0.627 1.00 0.00 H new ATOM 0 HB3 GLU A 156 147.364 -4.123 -1.498 1.00 0.00 H new ATOM 0 HG2 GLU A 156 147.445 -2.814 0.710 1.00 0.00 H new ATOM 0 HG3 GLU A 156 148.276 -4.184 1.420 1.00 0.00 H new ATOM 2157 N CYS A 157 144.202 -5.679 -1.493 1.00 0.00 N ATOM 2158 CA CYS A 157 143.517 -6.648 -2.326 1.00 0.00 C ATOM 2159 C CYS A 157 143.268 -6.139 -3.719 1.00 0.00 C ATOM 2160 O CYS A 157 142.842 -5.013 -3.941 1.00 0.00 O ATOM 2161 CB CYS A 157 142.171 -7.049 -1.706 1.00 0.00 C ATOM 2162 SG CYS A 157 140.836 -6.350 -2.707 1.00 0.00 S ATOM 0 H CYS A 157 143.716 -4.789 -1.382 1.00 0.00 H new ATOM 0 HA CYS A 157 144.178 -7.513 -2.386 1.00 0.00 H new ATOM 0 HB2 CYS A 157 142.083 -8.135 -1.665 1.00 0.00 H new ATOM 0 HB3 CYS A 157 142.104 -6.685 -0.681 1.00 0.00 H new ATOM 0 HG CYS A 157 141.286 -5.334 -3.382 1.00 0.00 H new ATOM 2168 N SER A 158 143.494 -7.036 -4.637 1.00 0.00 N ATOM 2169 CA SER A 158 143.252 -6.787 -6.034 1.00 0.00 C ATOM 2170 C SER A 158 142.789 -8.086 -6.629 1.00 0.00 C ATOM 2171 O SER A 158 143.592 -8.940 -7.008 1.00 0.00 O ATOM 2172 CB SER A 158 144.518 -6.315 -6.725 1.00 0.00 C ATOM 2173 OG SER A 158 144.235 -6.033 -8.089 1.00 0.00 O ATOM 0 H SER A 158 143.854 -7.969 -4.437 1.00 0.00 H new ATOM 0 HA SER A 158 142.504 -6.004 -6.162 1.00 0.00 H new ATOM 0 HB2 SER A 158 144.904 -5.424 -6.231 1.00 0.00 H new ATOM 0 HB3 SER A 158 145.291 -7.080 -6.653 1.00 0.00 H new ATOM 0 HG SER A 158 145.036 -6.195 -8.630 1.00 0.00 H new ATOM 2179 N ALA A 159 141.486 -8.237 -6.674 1.00 0.00 N ATOM 2180 CA ALA A 159 140.901 -9.456 -7.186 1.00 0.00 C ATOM 2181 C ALA A 159 141.725 -10.638 -6.708 1.00 0.00 C ATOM 2182 O ALA A 159 141.826 -11.664 -7.378 1.00 0.00 O ATOM 2183 CB ALA A 159 140.864 -9.418 -8.708 1.00 0.00 C ATOM 0 H ALA A 159 140.813 -7.536 -6.364 1.00 0.00 H new ATOM 0 HA ALA A 159 139.879 -9.555 -6.820 1.00 0.00 H new ATOM 0 HB1 ALA A 159 140.422 -10.340 -9.084 1.00 0.00 H new ATOM 0 HB2 ALA A 159 140.265 -8.568 -9.036 1.00 0.00 H new ATOM 0 HB3 ALA A 159 141.878 -9.318 -9.094 1.00 0.00 H new ATOM 2189 N LEU A 160 142.316 -10.470 -5.532 1.00 0.00 N ATOM 2190 CA LEU A 160 143.138 -11.508 -4.942 1.00 0.00 C ATOM 2191 C LEU A 160 142.992 -11.499 -3.424 1.00 0.00 C ATOM 2192 O LEU A 160 142.228 -12.294 -2.890 1.00 0.00 O ATOM 2193 CB LEU A 160 144.601 -11.303 -5.335 1.00 0.00 C ATOM 2194 CG LEU A 160 145.452 -12.431 -4.748 1.00 0.00 C ATOM 2195 CD1 LEU A 160 144.986 -13.772 -5.316 1.00 0.00 C ATOM 2196 CD2 LEU A 160 146.919 -12.210 -5.124 1.00 0.00 C ATOM 0 H LEU A 160 142.239 -9.622 -4.970 1.00 0.00 H new ATOM 0 HA LEU A 160 142.805 -12.476 -5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 160 144.698 -11.288 -6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 160 144.955 -10.339 -4.970 1.00 0.00 H new ATOM 0 HG LEU A 160 145.346 -12.436 -3.663 1.00 0.00 H new ATOM 0 HD11 LEU A 160 145.593 -14.575 -4.897 1.00 0.00 H new ATOM 0 HD12 LEU A 160 143.940 -13.934 -5.055 1.00 0.00 H new ATOM 0 HD13 LEU A 160 145.093 -13.764 -6.401 1.00 0.00 H new ATOM 0 HD21 LEU A 160 147.527 -13.013 -4.706 1.00 0.00 H new ATOM 0 HD22 LEU A 160 147.020 -12.206 -6.209 1.00 0.00 H new ATOM 0 HD23 LEU A 160 147.257 -11.254 -4.724 1.00 0.00 H new ATOM 2202 N THR A 161 143.804 -10.669 -2.746 1.00 0.00 N ATOM 2203 CA THR A 161 143.834 -10.616 -1.256 1.00 0.00 C ATOM 2204 C THR A 161 142.452 -10.607 -0.609 1.00 0.00 C ATOM 2205 O THR A 161 142.234 -9.933 0.399 1.00 0.00 O ATOM 2206 CB THR A 161 144.612 -9.398 -0.745 1.00 0.00 C ATOM 2207 OG1 THR A 161 145.701 -9.144 -1.620 1.00 0.00 O ATOM 2208 CG2 THR A 161 145.123 -9.619 0.696 1.00 0.00 C ATOM 0 H THR A 161 144.451 -10.022 -3.197 1.00 0.00 H new ATOM 0 HA THR A 161 144.338 -11.538 -0.965 1.00 0.00 H new ATOM 0 HB THR A 161 143.943 -8.538 -0.726 1.00 0.00 H new ATOM 0 HG1 THR A 161 145.995 -8.215 -1.515 1.00 0.00 H new ATOM 0 HG21 THR A 161 145.670 -8.736 1.027 1.00 0.00 H new ATOM 0 HG22 THR A 161 144.276 -9.791 1.360 1.00 0.00 H new ATOM 0 HG23 THR A 161 145.784 -10.485 0.719 1.00 0.00 H new ATOM 2213 N GLN A 162 141.560 -11.415 -1.134 1.00 0.00 N ATOM 2214 CA GLN A 162 140.254 -11.563 -0.552 1.00 0.00 C ATOM 2215 C GLN A 162 140.486 -12.286 0.755 1.00 0.00 C ATOM 2216 O GLN A 162 139.573 -12.541 1.532 1.00 0.00 O ATOM 2217 CB GLN A 162 139.345 -12.388 -1.468 1.00 0.00 C ATOM 2218 CG GLN A 162 139.807 -13.847 -1.464 1.00 0.00 C ATOM 2219 CD GLN A 162 139.091 -14.626 -2.561 1.00 0.00 C ATOM 2220 OE1 GLN A 162 138.912 -14.118 -3.668 1.00 0.00 O ATOM 2221 NE2 GLN A 162 138.664 -15.835 -2.317 1.00 0.00 N ATOM 0 H GLN A 162 141.720 -11.981 -1.967 1.00 0.00 H new ATOM 0 HA GLN A 162 139.761 -10.602 -0.407 1.00 0.00 H new ATOM 0 HB2 GLN A 162 138.311 -12.322 -1.128 1.00 0.00 H new ATOM 0 HB3 GLN A 162 139.374 -11.989 -2.482 1.00 0.00 H new ATOM 0 HG2 GLN A 162 140.885 -13.896 -1.617 1.00 0.00 H new ATOM 0 HG3 GLN A 162 139.602 -14.299 -0.493 1.00 0.00 H new ATOM 0 HE21 GLN A 162 138.814 -16.253 -1.399 1.00 0.00 H new ATOM 0 HE22 GLN A 162 138.181 -16.362 -3.045 1.00 0.00 H new ATOM 2228 N LYS A 163 141.764 -12.585 0.985 1.00 0.00 N ATOM 2229 CA LYS A 163 142.178 -13.257 2.204 1.00 0.00 C ATOM 2230 C LYS A 163 141.715 -12.419 3.368 1.00 0.00 C ATOM 2231 O LYS A 163 141.407 -12.923 4.448 1.00 0.00 O ATOM 2232 CB LYS A 163 143.700 -13.409 2.247 1.00 0.00 C ATOM 2233 CG LYS A 163 144.161 -14.312 1.100 1.00 0.00 C ATOM 2234 CD LYS A 163 145.669 -14.545 1.208 1.00 0.00 C ATOM 2235 CE LYS A 163 146.151 -15.348 -0.001 1.00 0.00 C ATOM 2236 NZ LYS A 163 146.030 -14.514 -1.231 1.00 0.00 N ATOM 0 H LYS A 163 142.525 -12.371 0.341 1.00 0.00 H new ATOM 0 HA LYS A 163 141.741 -14.255 2.246 1.00 0.00 H new ATOM 0 HB2 LYS A 163 144.175 -12.431 2.166 1.00 0.00 H new ATOM 0 HB3 LYS A 163 144.006 -13.834 3.203 1.00 0.00 H new ATOM 0 HG2 LYS A 163 143.632 -15.264 1.137 1.00 0.00 H new ATOM 0 HG3 LYS A 163 143.921 -13.851 0.142 1.00 0.00 H new ATOM 0 HD2 LYS A 163 146.192 -13.590 1.255 1.00 0.00 H new ATOM 0 HD3 LYS A 163 145.900 -15.081 2.129 1.00 0.00 H new ATOM 0 HE2 LYS A 163 147.187 -15.655 0.143 1.00 0.00 H new ATOM 0 HE3 LYS A 163 145.560 -16.258 -0.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 146.660 -14.889 -1.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 145.047 -14.537 -1.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 146.298 -13.533 -1.013 1.00 0.00 H new ATOM 2250 N GLY A 164 141.629 -11.127 3.102 1.00 0.00 N ATOM 2251 CA GLY A 164 141.154 -10.177 4.086 1.00 0.00 C ATOM 2252 C GLY A 164 139.855 -9.591 3.579 1.00 0.00 C ATOM 2253 O GLY A 164 138.798 -9.793 4.176 1.00 0.00 O ATOM 0 H GLY A 164 141.884 -10.712 2.206 1.00 0.00 H new ATOM 0 HA2 GLY A 164 141.001 -10.668 5.047 1.00 0.00 H new ATOM 0 HA3 GLY A 164 141.892 -9.390 4.243 1.00 0.00 H new ATOM 2257 N LEU A 165 139.942 -8.855 2.470 1.00 0.00 N ATOM 2258 CA LEU A 165 138.769 -8.227 1.871 1.00 0.00 C ATOM 2259 C LEU A 165 137.548 -9.146 1.850 1.00 0.00 C ATOM 2260 O LEU A 165 136.437 -8.695 1.559 1.00 0.00 O ATOM 2261 CB LEU A 165 139.123 -7.787 0.456 1.00 0.00 C ATOM 2262 CG LEU A 165 139.076 -6.256 0.363 1.00 0.00 C ATOM 2263 CD1 LEU A 165 137.671 -5.745 0.700 1.00 0.00 C ATOM 2264 CD2 LEU A 165 140.081 -5.661 1.353 1.00 0.00 C ATOM 0 H LEU A 165 140.814 -8.681 1.970 1.00 0.00 H new ATOM 0 HA LEU A 165 138.495 -7.369 2.485 1.00 0.00 H new ATOM 0 HB2 LEU A 165 140.117 -8.147 0.191 1.00 0.00 H new ATOM 0 HB3 LEU A 165 138.425 -8.226 -0.257 1.00 0.00 H new ATOM 0 HG LEU A 165 139.328 -5.954 -0.654 1.00 0.00 H new ATOM 0 HD11 LEU A 165 137.653 -4.657 0.630 1.00 0.00 H new ATOM 0 HD12 LEU A 165 136.952 -6.166 -0.003 1.00 0.00 H new ATOM 0 HD13 LEU A 165 137.407 -6.048 1.713 1.00 0.00 H new ATOM 0 HD21 LEU A 165 140.052 -4.573 1.291 1.00 0.00 H new ATOM 0 HD22 LEU A 165 139.824 -5.974 2.365 1.00 0.00 H new ATOM 0 HD23 LEU A 165 141.084 -6.012 1.109 1.00 0.00 H new ATOM 2270 N LYS A 166 137.717 -10.406 2.227 1.00 0.00 N ATOM 2271 CA LYS A 166 136.576 -11.308 2.290 1.00 0.00 C ATOM 2272 C LYS A 166 136.020 -11.278 3.700 1.00 0.00 C ATOM 2273 O LYS A 166 134.811 -11.178 3.909 1.00 0.00 O ATOM 2274 CB LYS A 166 136.973 -12.737 1.917 1.00 0.00 C ATOM 2275 CG LYS A 166 135.731 -13.628 1.918 1.00 0.00 C ATOM 2276 CD LYS A 166 136.135 -15.064 1.576 1.00 0.00 C ATOM 2277 CE LYS A 166 134.885 -15.938 1.453 1.00 0.00 C ATOM 2278 NZ LYS A 166 135.086 -16.941 0.368 1.00 0.00 N ATOM 0 H LYS A 166 138.612 -10.820 2.488 1.00 0.00 H new ATOM 0 HA LYS A 166 135.823 -10.979 1.574 1.00 0.00 H new ATOM 0 HB2 LYS A 166 137.442 -12.750 0.933 1.00 0.00 H new ATOM 0 HB3 LYS A 166 137.708 -13.118 2.626 1.00 0.00 H new ATOM 0 HG2 LYS A 166 135.249 -13.597 2.895 1.00 0.00 H new ATOM 0 HG3 LYS A 166 135.005 -13.260 1.193 1.00 0.00 H new ATOM 0 HD2 LYS A 166 136.695 -15.081 0.641 1.00 0.00 H new ATOM 0 HD3 LYS A 166 136.793 -15.461 2.349 1.00 0.00 H new ATOM 0 HE2 LYS A 166 134.687 -16.443 2.398 1.00 0.00 H new ATOM 0 HE3 LYS A 166 134.015 -15.319 1.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 134.237 -17.536 0.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 135.255 -16.449 -0.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 135.906 -17.539 0.595 1.00 0.00 H new ATOM 2292 N ASN A 167 136.929 -11.334 4.667 1.00 0.00 N ATOM 2293 CA ASN A 167 136.543 -11.281 6.063 1.00 0.00 C ATOM 2294 C ASN A 167 136.324 -9.829 6.462 1.00 0.00 C ATOM 2295 O ASN A 167 135.924 -9.536 7.588 1.00 0.00 O ATOM 2296 CB ASN A 167 137.634 -11.905 6.936 1.00 0.00 C ATOM 2297 CG ASN A 167 137.830 -13.371 6.558 1.00 0.00 C ATOM 2298 OD1 ASN A 167 138.935 -13.778 6.200 1.00 0.00 O ATOM 2299 ND2 ASN A 167 136.817 -14.192 6.620 1.00 0.00 N ATOM 0 H ASN A 167 137.933 -11.416 4.506 1.00 0.00 H new ATOM 0 HA ASN A 167 135.621 -11.844 6.207 1.00 0.00 H new ATOM 0 HB2 ASN A 167 138.569 -11.360 6.809 1.00 0.00 H new ATOM 0 HB3 ASN A 167 137.359 -11.826 7.988 1.00 0.00 H new ATOM 0 HD21 ASN A 167 136.940 -15.174 6.371 1.00 0.00 H new ATOM 0 HD22 ASN A 167 135.902 -13.852 6.917 1.00 0.00 H new ATOM 2304 N VAL A 168 136.553 -8.921 5.511 1.00 0.00 N ATOM 2305 CA VAL A 168 136.338 -7.502 5.763 1.00 0.00 C ATOM 2306 C VAL A 168 134.854 -7.224 5.840 1.00 0.00 C ATOM 2307 O VAL A 168 134.369 -6.633 6.798 1.00 0.00 O ATOM 2308 CB VAL A 168 136.933 -6.663 4.640 1.00 0.00 C ATOM 2309 CG1 VAL A 168 136.347 -5.251 4.696 1.00 0.00 C ATOM 2310 CG2 VAL A 168 138.450 -6.586 4.820 1.00 0.00 C ATOM 0 H VAL A 168 136.883 -9.143 4.572 1.00 0.00 H new ATOM 0 HA VAL A 168 136.823 -7.240 6.703 1.00 0.00 H new ATOM 0 HB VAL A 168 136.698 -7.119 3.678 1.00 0.00 H new ATOM 0 HG11 VAL A 168 136.772 -4.649 3.893 1.00 0.00 H new ATOM 0 HG12 VAL A 168 135.265 -5.301 4.578 1.00 0.00 H new ATOM 0 HG13 VAL A 168 136.587 -4.795 5.657 1.00 0.00 H new ATOM 0 HG21 VAL A 168 138.882 -5.986 4.019 1.00 0.00 H new ATOM 0 HG22 VAL A 168 138.679 -6.126 5.781 1.00 0.00 H new ATOM 0 HG23 VAL A 168 138.872 -7.591 4.789 1.00 0.00 H new ATOM 2314 N PHE A 169 134.134 -7.664 4.816 1.00 0.00 N ATOM 2315 CA PHE A 169 132.687 -7.461 4.791 1.00 0.00 C ATOM 2316 C PHE A 169 132.046 -8.049 6.049 1.00 0.00 C ATOM 2317 O PHE A 169 131.140 -7.454 6.631 1.00 0.00 O ATOM 2318 CB PHE A 169 132.081 -8.116 3.549 1.00 0.00 C ATOM 2319 CG PHE A 169 132.349 -7.249 2.344 1.00 0.00 C ATOM 2320 CD1 PHE A 169 133.625 -7.219 1.773 1.00 0.00 C ATOM 2321 CD2 PHE A 169 131.318 -6.477 1.795 1.00 0.00 C ATOM 2322 CE1 PHE A 169 133.873 -6.415 0.653 1.00 0.00 C ATOM 2323 CE2 PHE A 169 131.565 -5.673 0.676 1.00 0.00 C ATOM 2324 CZ PHE A 169 132.842 -5.643 0.105 1.00 0.00 C ATOM 0 H PHE A 169 134.516 -8.154 4.007 1.00 0.00 H new ATOM 0 HA PHE A 169 132.490 -6.389 4.760 1.00 0.00 H new ATOM 0 HB2 PHE A 169 132.511 -9.107 3.401 1.00 0.00 H new ATOM 0 HB3 PHE A 169 131.008 -8.251 3.682 1.00 0.00 H new ATOM 0 HD1 PHE A 169 134.420 -7.816 2.196 1.00 0.00 H new ATOM 0 HD2 PHE A 169 130.332 -6.502 2.235 1.00 0.00 H new ATOM 0 HE1 PHE A 169 134.859 -6.391 0.213 1.00 0.00 H new ATOM 0 HE2 PHE A 169 130.770 -5.076 0.254 1.00 0.00 H new ATOM 0 HZ PHE A 169 133.032 -5.024 -0.759 1.00 0.00 H new ATOM 2334 N ASP A 170 132.523 -9.220 6.462 1.00 0.00 N ATOM 2335 CA ASP A 170 131.992 -9.882 7.653 1.00 0.00 C ATOM 2336 C ASP A 170 132.359 -9.120 8.929 1.00 0.00 C ATOM 2337 O ASP A 170 131.507 -8.882 9.785 1.00 0.00 O ATOM 2338 CB ASP A 170 132.542 -11.306 7.740 1.00 0.00 C ATOM 2339 CG ASP A 170 133.019 -11.596 9.159 1.00 0.00 C ATOM 2340 OD1 ASP A 170 132.216 -11.479 10.069 1.00 0.00 O ATOM 2341 OD2 ASP A 170 134.183 -11.929 9.315 1.00 0.00 O ATOM 0 H ASP A 170 133.272 -9.729 5.993 1.00 0.00 H new ATOM 0 HA ASP A 170 130.906 -9.904 7.567 1.00 0.00 H new ATOM 0 HB2 ASP A 170 131.770 -12.021 7.454 1.00 0.00 H new ATOM 0 HB3 ASP A 170 133.367 -11.429 7.038 1.00 0.00 H new ATOM 2346 N GLU A 171 133.631 -8.750 9.056 1.00 0.00 N ATOM 2347 CA GLU A 171 134.094 -8.026 10.238 1.00 0.00 C ATOM 2348 C GLU A 171 133.634 -6.572 10.210 1.00 0.00 C ATOM 2349 O GLU A 171 133.511 -5.927 11.251 1.00 0.00 O ATOM 2350 CB GLU A 171 135.621 -8.078 10.321 1.00 0.00 C ATOM 2351 CG GLU A 171 136.069 -9.516 10.593 1.00 0.00 C ATOM 2352 CD GLU A 171 137.587 -9.577 10.708 1.00 0.00 C ATOM 2353 OE1 GLU A 171 138.223 -8.571 10.437 1.00 0.00 O ATOM 2354 OE2 GLU A 171 138.093 -10.628 11.065 1.00 0.00 O ATOM 0 H GLU A 171 134.354 -8.937 8.362 1.00 0.00 H new ATOM 0 HA GLU A 171 133.663 -8.507 11.116 1.00 0.00 H new ATOM 0 HB2 GLU A 171 136.059 -7.720 9.389 1.00 0.00 H new ATOM 0 HB3 GLU A 171 135.975 -7.419 11.114 1.00 0.00 H new ATOM 0 HG2 GLU A 171 135.612 -9.880 11.513 1.00 0.00 H new ATOM 0 HG3 GLU A 171 135.731 -10.169 9.789 1.00 0.00 H new ATOM 2361 N ALA A 172 133.406 -6.057 9.011 1.00 0.00 N ATOM 2362 CA ALA A 172 132.987 -4.670 8.848 1.00 0.00 C ATOM 2363 C ALA A 172 131.780 -4.358 9.723 1.00 0.00 C ATOM 2364 O ALA A 172 131.754 -3.340 10.415 1.00 0.00 O ATOM 2365 CB ALA A 172 132.635 -4.403 7.387 1.00 0.00 C ATOM 0 H ALA A 172 133.503 -6.576 8.138 1.00 0.00 H new ATOM 0 HA ALA A 172 133.814 -4.028 9.152 1.00 0.00 H new ATOM 0 HB1 ALA A 172 132.323 -3.365 7.272 1.00 0.00 H new ATOM 0 HB2 ALA A 172 133.508 -4.591 6.762 1.00 0.00 H new ATOM 0 HB3 ALA A 172 131.822 -5.062 7.082 1.00 0.00 H new ATOM 2371 N ILE A 173 130.789 -5.239 9.702 1.00 0.00 N ATOM 2372 CA ILE A 173 129.600 -5.034 10.516 1.00 0.00 C ATOM 2373 C ILE A 173 129.969 -5.124 11.992 1.00 0.00 C ATOM 2374 O ILE A 173 129.441 -4.382 12.825 1.00 0.00 O ATOM 2375 CB ILE A 173 128.535 -6.076 10.168 1.00 0.00 C ATOM 2376 CG1 ILE A 173 129.180 -7.462 10.101 1.00 0.00 C ATOM 2377 CG2 ILE A 173 127.919 -5.736 8.809 1.00 0.00 C ATOM 2378 CD1 ILE A 173 128.092 -8.536 10.116 1.00 0.00 C ATOM 0 H ILE A 173 130.784 -6.090 9.139 1.00 0.00 H new ATOM 0 HA ILE A 173 129.192 -4.044 10.312 1.00 0.00 H new ATOM 0 HB ILE A 173 127.758 -6.073 10.933 1.00 0.00 H new ATOM 0 HG12 ILE A 173 129.781 -7.551 9.196 1.00 0.00 H new ATOM 0 HG13 ILE A 173 129.854 -7.601 10.946 1.00 0.00 H new ATOM 0 HG21 ILE A 173 127.160 -6.477 8.558 1.00 0.00 H new ATOM 0 HG22 ILE A 173 127.461 -4.748 8.854 1.00 0.00 H new ATOM 0 HG23 ILE A 173 128.697 -5.741 8.045 1.00 0.00 H new ATOM 0 HD11 ILE A 173 128.554 -9.522 10.068 1.00 0.00 H new ATOM 0 HD12 ILE A 173 127.510 -8.452 11.034 1.00 0.00 H new ATOM 0 HD13 ILE A 173 127.435 -8.401 9.257 1.00 0.00 H new ATOM 2382 N LEU A 174 130.898 -6.020 12.308 1.00 0.00 N ATOM 2383 CA LEU A 174 131.346 -6.176 13.683 1.00 0.00 C ATOM 2384 C LEU A 174 131.966 -4.870 14.162 1.00 0.00 C ATOM 2385 O LEU A 174 131.830 -4.492 15.327 1.00 0.00 O ATOM 2386 CB LEU A 174 132.373 -7.307 13.783 1.00 0.00 C ATOM 2387 CG LEU A 174 132.729 -7.549 15.253 1.00 0.00 C ATOM 2388 CD1 LEU A 174 131.535 -8.170 15.984 1.00 0.00 C ATOM 2389 CD2 LEU A 174 133.923 -8.502 15.339 1.00 0.00 C ATOM 0 H LEU A 174 131.350 -6.642 11.638 1.00 0.00 H new ATOM 0 HA LEU A 174 130.491 -6.427 14.311 1.00 0.00 H new ATOM 0 HB2 LEU A 174 131.970 -8.218 13.341 1.00 0.00 H new ATOM 0 HB3 LEU A 174 133.269 -7.049 13.219 1.00 0.00 H new ATOM 0 HG LEU A 174 132.982 -6.597 15.719 1.00 0.00 H new ATOM 0 HD11 LEU A 174 131.796 -8.339 17.029 1.00 0.00 H new ATOM 0 HD12 LEU A 174 130.682 -7.494 15.928 1.00 0.00 H new ATOM 0 HD13 LEU A 174 131.276 -9.120 15.516 1.00 0.00 H new ATOM 0 HD21 LEU A 174 134.176 -8.674 16.385 1.00 0.00 H new ATOM 0 HD22 LEU A 174 133.666 -9.450 14.867 1.00 0.00 H new ATOM 0 HD23 LEU A 174 134.778 -8.061 14.826 1.00 0.00 H new ATOM 2395 N ALA A 175 132.640 -4.182 13.245 1.00 0.00 N ATOM 2396 CA ALA A 175 133.275 -2.911 13.565 1.00 0.00 C ATOM 2397 C ALA A 175 132.227 -1.895 14.000 1.00 0.00 C ATOM 2398 O ALA A 175 132.520 -0.972 14.760 1.00 0.00 O ATOM 2399 CB ALA A 175 134.030 -2.380 12.343 1.00 0.00 C ATOM 0 H ALA A 175 132.759 -4.483 12.278 1.00 0.00 H new ATOM 0 HA ALA A 175 133.979 -3.068 14.382 1.00 0.00 H new ATOM 0 HB1 ALA A 175 134.502 -1.429 12.592 1.00 0.00 H new ATOM 0 HB2 ALA A 175 134.795 -3.098 12.047 1.00 0.00 H new ATOM 0 HB3 ALA A 175 133.332 -2.234 11.519 1.00 0.00 H new ATOM 2405 N ALA A 176 130.998 -2.079 13.523 1.00 0.00 N ATOM 2406 CA ALA A 176 129.912 -1.179 13.883 1.00 0.00 C ATOM 2407 C ALA A 176 129.725 -1.172 15.394 1.00 0.00 C ATOM 2408 O ALA A 176 129.320 -0.169 15.979 1.00 0.00 O ATOM 2409 CB ALA A 176 128.619 -1.635 13.215 1.00 0.00 C ATOM 0 H ALA A 176 130.734 -2.836 12.893 1.00 0.00 H new ATOM 0 HA ALA A 176 130.160 -0.173 13.544 1.00 0.00 H new ATOM 0 HB1 ALA A 176 127.810 -0.958 13.488 1.00 0.00 H new ATOM 0 HB2 ALA A 176 128.747 -1.629 12.133 1.00 0.00 H new ATOM 0 HB3 ALA A 176 128.375 -2.644 13.546 1.00 0.00 H new ATOM 2415 N LEU A 177 130.028 -2.307 16.016 1.00 0.00 N ATOM 2416 CA LEU A 177 129.896 -2.438 17.462 1.00 0.00 C ATOM 2417 C LEU A 177 130.652 -1.320 18.170 1.00 0.00 C ATOM 2418 O LEU A 177 130.200 -0.801 19.191 1.00 0.00 O ATOM 2419 CB LEU A 177 130.447 -3.796 17.910 1.00 0.00 C ATOM 2420 CG LEU A 177 130.203 -3.990 19.411 1.00 0.00 C ATOM 2421 CD1 LEU A 177 128.711 -4.208 19.674 1.00 0.00 C ATOM 2422 CD2 LEU A 177 130.987 -5.213 19.894 1.00 0.00 C ATOM 0 H LEU A 177 130.365 -3.146 15.543 1.00 0.00 H new ATOM 0 HA LEU A 177 128.840 -2.368 17.724 1.00 0.00 H new ATOM 0 HB2 LEU A 177 129.966 -4.597 17.348 1.00 0.00 H new ATOM 0 HB3 LEU A 177 131.514 -3.854 17.696 1.00 0.00 H new ATOM 0 HG LEU A 177 130.534 -3.101 19.948 1.00 0.00 H new ATOM 0 HD11 LEU A 177 128.546 -4.345 20.743 1.00 0.00 H new ATOM 0 HD12 LEU A 177 128.150 -3.340 19.329 1.00 0.00 H new ATOM 0 HD13 LEU A 177 128.373 -5.095 19.138 1.00 0.00 H new ATOM 0 HD21 LEU A 177 130.817 -5.356 20.961 1.00 0.00 H new ATOM 0 HD22 LEU A 177 130.652 -6.097 19.352 1.00 0.00 H new ATOM 0 HD23 LEU A 177 132.051 -5.058 19.713 1.00 0.00 H new ATOM 2428 N GLU A 178 131.806 -0.952 17.624 1.00 0.00 N ATOM 2429 CA GLU A 178 132.616 0.107 18.215 1.00 0.00 C ATOM 2430 C GLU A 178 132.936 1.180 17.181 1.00 0.00 C ATOM 2431 O GLU A 178 132.742 2.367 17.436 1.00 99.99 O ATOM 2432 CB GLU A 178 133.918 -0.477 18.767 1.00 0.00 C ATOM 2433 CG GLU A 178 134.696 0.615 19.504 1.00 0.00 C ATOM 2434 CD GLU A 178 136.044 0.073 19.965 1.00 0.00 C ATOM 2435 OE1 GLU A 178 136.321 -1.082 19.686 1.00 0.00 O ATOM 2436 OE2 GLU A 178 136.779 0.819 20.589 1.00 0.00 O ATOM 0 H GLU A 178 132.199 -1.368 16.780 1.00 0.00 H new ATOM 0 HA GLU A 178 132.048 0.561 19.027 1.00 0.00 H new ATOM 0 HB2 GLU A 178 133.700 -1.303 19.444 1.00 0.00 H new ATOM 0 HB3 GLU A 178 134.521 -0.882 17.954 1.00 0.00 H new ATOM 0 HG2 GLU A 178 134.845 1.473 18.848 1.00 0.00 H new ATOM 0 HG3 GLU A 178 134.123 0.965 20.362 1.00 0.00 H new