USER MOD reduce.3.24.130724 H: found=0, std=0, add=988, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 986 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 33 GLN : amide:sc= -2.25! C(o=-2.2!,f=-2.7!) USER MOD Set 1.2: A 38 TYR OH : rot 180:sc= 0 USER MOD Set 1.3: A 124 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 34 HIS : no HD1:sc= -15.1! C(o=-28!,f=-31!) USER MOD Set 2.2: A 115 HIS : no HD1:sc= -13.1! C(o=-28!,f=-29!) USER MOD Set 3.1: A 3 TYR OH : rot -46:sc= -3.43! USER MOD Set 3.2: A 37 ASN : amide:sc= -1.3! C(o=-4.7!,f=-8.5!) USER MOD Single : A 1 LYS N :NH3+ -122:sc= -2.72 (180deg=-4.88!) USER MOD Single : A 1 LYS NZ :NH3+ 152:sc= 0.534 (180deg=0.228) USER MOD Single : A 11 THR OG1 : rot 112:sc= 0.162 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 17 MET CE :methyl -153:sc= 0 (180deg=-1.52) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 131:sc= -0.75 USER MOD Single : A 39 ASN : amide:sc= -0.336 K(o=-0.34,f=-2.2!) USER MOD Single : A 40 THR OG1 : rot 70:sc= 0.869 USER MOD Single : A 43 THR OG1 : rot -89:sc= 0.981 USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=0.011) USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -1.89 X(o=-1.9,f=-2) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 51 SER OG : rot 88:sc= 0.155 USER MOD Single : A 52 THR OG1 : rot -163:sc= 0.0537 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0.00701 X(o=0.007,f=0) USER MOD Single : A 60 ASN : amide:sc= -0.92 K(o=-0.92,f=-2.2) USER MOD Single : A 61 SER OG : rot -62:sc= 1.75 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -4.12! K(o=-4.1!,f=-1.9) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -2.36 K(o=-2.4,f=-6.4!) USER MOD Single : A 80 ASN : amide:sc= 0.594 K(o=0.59,f=0) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0181 X(o=-0.018,f=-0.047) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.113 K(o=-0.11,f=-1.6!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 GLN : amide:sc= -0.431 X(o=-0.43,f=0) USER MOD Single : A 118 ASN : amide:sc= -0.0129 X(o=-0.013,f=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc=-0.00636 X(o=-0.0064,f=0) USER MOD Single : A 127 ASN : amide:sc= 0.971 K(o=0.97,f=-0.94) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 -6.318 6.081 6.082 1.00 0.00 N ATOM 2 CA LYS A 1 -5.473 7.181 6.515 1.00 0.00 C ATOM 3 C LYS A 1 -4.639 6.735 7.718 1.00 0.00 C ATOM 4 O LYS A 1 -3.485 7.136 7.859 1.00 0.00 O ATOM 5 CB LYS A 1 -6.316 8.431 6.779 1.00 0.00 C ATOM 6 CG LYS A 1 -7.478 8.119 7.724 1.00 0.00 C ATOM 7 CD LYS A 1 -7.513 9.103 8.894 1.00 0.00 C ATOM 8 CE LYS A 1 -8.952 9.478 9.252 1.00 0.00 C ATOM 9 NZ LYS A 1 -9.313 10.781 8.649 1.00 0.00 N ATOM 0 H1 LYS A 1 -6.113 5.857 5.087 1.00 0.00 H new ATOM 0 H2 LYS A 1 -6.129 5.245 6.671 1.00 0.00 H new ATOM 0 H3 LYS A 1 -7.317 6.353 6.177 1.00 0.00 H new ATOM 0 HA LYS A 1 -4.773 7.457 5.727 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -5.690 9.211 7.212 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -6.703 8.819 5.837 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -8.419 8.166 7.176 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -7.380 7.102 8.103 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -7.022 8.660 9.761 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -6.953 10.002 8.635 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -9.634 8.705 8.898 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -9.062 9.529 10.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -10.338 10.812 8.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -9.046 11.549 9.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -8.808 10.898 7.747 1.00 0.00 H new ATOM 23 N VAL A 2 -5.256 5.912 8.553 1.00 0.00 N ATOM 24 CA VAL A 2 -4.585 5.407 9.738 1.00 0.00 C ATOM 25 C VAL A 2 -5.079 3.991 10.035 1.00 0.00 C ATOM 26 O VAL A 2 -6.283 3.756 10.129 1.00 0.00 O ATOM 27 CB VAL A 2 -4.795 6.370 10.909 1.00 0.00 C ATOM 28 CG1 VAL A 2 -4.741 5.630 12.245 1.00 0.00 C ATOM 29 CG2 VAL A 2 -3.773 7.509 10.871 1.00 0.00 C ATOM 0 H VAL A 2 -6.214 5.582 8.432 1.00 0.00 H new ATOM 0 HA VAL A 2 -3.510 5.348 9.571 1.00 0.00 H new ATOM 0 HB VAL A 2 -5.789 6.807 10.809 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -4.893 6.338 13.060 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -5.523 4.871 12.273 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.768 5.152 12.357 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -3.944 8.179 11.713 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -2.766 7.097 10.934 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -3.881 8.063 9.939 1.00 0.00 H new ATOM 39 N TYR A 3 -4.126 3.082 10.173 1.00 0.00 N ATOM 40 CA TYR A 3 -4.449 1.694 10.458 1.00 0.00 C ATOM 41 C TYR A 3 -3.230 0.947 11.002 1.00 0.00 C ATOM 42 O TYR A 3 -2.109 1.169 10.548 1.00 0.00 O ATOM 43 CB TYR A 3 -4.857 1.074 9.119 1.00 0.00 C ATOM 44 CG TYR A 3 -3.715 0.367 8.388 1.00 0.00 C ATOM 45 CD1 TYR A 3 -3.073 -0.702 8.979 1.00 0.00 C ATOM 46 CD2 TYR A 3 -3.326 0.798 7.135 1.00 0.00 C ATOM 47 CE1 TYR A 3 -1.997 -1.366 8.290 1.00 0.00 C ATOM 48 CE2 TYR A 3 -2.252 0.133 6.446 1.00 0.00 C ATOM 49 CZ TYR A 3 -1.640 -0.916 7.058 1.00 0.00 C ATOM 50 OH TYR A 3 -0.624 -1.545 6.407 1.00 0.00 O ATOM 0 H TYR A 3 -3.129 3.279 10.093 1.00 0.00 H new ATOM 0 HA TYR A 3 -5.238 1.629 11.207 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -5.662 0.360 9.291 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -5.258 1.857 8.475 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -3.378 -1.041 9.958 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -3.828 1.635 6.672 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -1.485 -2.203 8.742 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -1.939 0.459 5.465 1.00 0.00 H new ATOM 0 HH TYR A 3 0.123 -1.686 7.026 1.00 0.00 H new ATOM 60 N GLU A 4 -3.491 0.077 11.966 1.00 0.00 N ATOM 61 CA GLU A 4 -2.430 -0.705 12.577 1.00 0.00 C ATOM 62 C GLU A 4 -2.543 -2.173 12.161 1.00 0.00 C ATOM 63 O GLU A 4 -3.504 -2.561 11.498 1.00 0.00 O ATOM 64 CB GLU A 4 -2.452 -0.564 14.100 1.00 0.00 C ATOM 65 CG GLU A 4 -3.728 -1.170 14.688 1.00 0.00 C ATOM 66 CD GLU A 4 -3.576 -1.417 16.191 1.00 0.00 C ATOM 67 OE1 GLU A 4 -3.091 -0.489 16.873 1.00 0.00 O ATOM 68 OE2 GLU A 4 -3.946 -2.531 16.622 1.00 0.00 O ATOM 0 H GLU A 4 -4.423 -0.104 12.339 1.00 0.00 H new ATOM 0 HA GLU A 4 -1.474 -0.321 12.223 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -1.580 -1.059 14.527 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -2.386 0.489 14.372 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -4.569 -0.500 14.509 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -3.955 -2.109 14.183 1.00 0.00 H new ATOM 75 N ARG A 5 -1.549 -2.949 12.567 1.00 0.00 N ATOM 76 CA ARG A 5 -1.526 -4.365 12.244 1.00 0.00 C ATOM 77 C ARG A 5 -2.926 -4.965 12.385 1.00 0.00 C ATOM 78 O ARG A 5 -3.543 -5.350 11.394 1.00 0.00 O ATOM 79 CB ARG A 5 -0.559 -5.122 13.156 1.00 0.00 C ATOM 80 CG ARG A 5 -0.538 -4.512 14.560 1.00 0.00 C ATOM 81 CD ARG A 5 0.849 -3.962 14.898 1.00 0.00 C ATOM 82 NE ARG A 5 0.958 -3.725 16.354 1.00 0.00 N ATOM 83 CZ ARG A 5 0.961 -4.697 17.276 1.00 0.00 C ATOM 84 NH1 ARG A 5 0.861 -5.979 16.897 1.00 0.00 N ATOM 85 NH2 ARG A 5 1.064 -4.389 18.576 1.00 0.00 N ATOM 0 H ARG A 5 -0.754 -2.624 13.117 1.00 0.00 H new ATOM 0 HA ARG A 5 -1.188 -4.464 11.213 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -0.854 -6.170 13.215 1.00 0.00 H new ATOM 0 HB3 ARG A 5 0.444 -5.097 12.730 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -1.276 -3.712 14.624 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -0.822 -5.267 15.293 1.00 0.00 H new ATOM 0 HD2 ARG A 5 1.617 -4.666 14.577 1.00 0.00 H new ATOM 0 HD3 ARG A 5 1.023 -3.032 14.356 1.00 0.00 H new ATOM 0 HE ARG A 5 1.036 -2.760 16.676 1.00 0.00 H new ATOM 0 HH11 ARG A 5 0.783 -6.214 15.907 1.00 0.00 H new ATOM 0 HH12 ARG A 5 0.863 -6.720 17.598 1.00 0.00 H new ATOM 0 HH21 ARG A 5 1.140 -3.414 18.865 1.00 0.00 H new ATOM 0 HH22 ARG A 5 1.066 -5.130 19.277 1.00 0.00 H new ATOM 99 N CYS A 6 -3.386 -5.026 13.626 1.00 0.00 N ATOM 100 CA CYS A 6 -4.702 -5.572 13.912 1.00 0.00 C ATOM 101 C CYS A 6 -5.700 -4.957 12.929 1.00 0.00 C ATOM 102 O CYS A 6 -6.152 -5.623 11.999 1.00 0.00 O ATOM 103 CB CYS A 6 -5.112 -5.334 15.367 1.00 0.00 C ATOM 104 SG CYS A 6 -5.082 -6.824 16.426 1.00 0.00 S ATOM 0 H CYS A 6 -2.870 -4.706 14.446 1.00 0.00 H new ATOM 0 HA CYS A 6 -4.685 -6.654 13.783 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -4.448 -4.585 15.799 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -6.118 -4.915 15.382 1.00 0.00 H new ATOM 109 N GLU A 7 -6.015 -3.693 13.168 1.00 0.00 N ATOM 110 CA GLU A 7 -6.952 -2.981 12.316 1.00 0.00 C ATOM 111 C GLU A 7 -6.867 -3.502 10.881 1.00 0.00 C ATOM 112 O GLU A 7 -7.802 -4.133 10.389 1.00 0.00 O ATOM 113 CB GLU A 7 -6.701 -1.472 12.367 1.00 0.00 C ATOM 114 CG GLU A 7 -7.841 -0.750 13.088 1.00 0.00 C ATOM 115 CD GLU A 7 -8.900 -0.267 12.095 1.00 0.00 C ATOM 116 OE1 GLU A 7 -9.525 -1.145 11.460 1.00 0.00 O ATOM 117 OE2 GLU A 7 -9.060 0.967 11.992 1.00 0.00 O ATOM 0 H GLU A 7 -5.638 -3.143 13.940 1.00 0.00 H new ATOM 0 HA GLU A 7 -7.961 -3.162 12.688 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -5.759 -1.274 12.879 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -6.602 -1.082 11.354 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -8.299 -1.421 13.815 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -7.444 0.100 13.644 1.00 0.00 H new ATOM 124 N PHE A 8 -5.736 -3.221 10.249 1.00 0.00 N ATOM 125 CA PHE A 8 -5.517 -3.654 8.879 1.00 0.00 C ATOM 126 C PHE A 8 -6.002 -5.091 8.675 1.00 0.00 C ATOM 127 O PHE A 8 -6.869 -5.344 7.840 1.00 0.00 O ATOM 128 CB PHE A 8 -4.009 -3.597 8.628 1.00 0.00 C ATOM 129 CG PHE A 8 -3.630 -3.220 7.194 1.00 0.00 C ATOM 130 CD1 PHE A 8 -4.136 -2.089 6.632 1.00 0.00 C ATOM 131 CD2 PHE A 8 -2.789 -4.016 6.482 1.00 0.00 C ATOM 132 CE1 PHE A 8 -3.786 -1.739 5.302 1.00 0.00 C ATOM 133 CE2 PHE A 8 -2.438 -3.666 5.151 1.00 0.00 C ATOM 134 CZ PHE A 8 -2.944 -2.535 4.589 1.00 0.00 C ATOM 0 H PHE A 8 -4.962 -2.699 10.660 1.00 0.00 H new ATOM 0 HA PHE A 8 -6.068 -3.011 8.192 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -3.564 -2.874 9.312 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -3.575 -4.569 8.864 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -4.804 -1.457 7.198 1.00 0.00 H new ATOM 0 HD2 PHE A 8 -2.388 -4.914 6.928 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -4.188 -0.841 4.856 1.00 0.00 H new ATOM 0 HE2 PHE A 8 -1.769 -4.298 4.585 1.00 0.00 H new ATOM 0 HZ PHE A 8 -2.677 -2.269 3.577 1.00 0.00 H new ATOM 144 N ALA A 9 -5.421 -5.993 9.452 1.00 0.00 N ATOM 145 CA ALA A 9 -5.783 -7.398 9.365 1.00 0.00 C ATOM 146 C ALA A 9 -7.307 -7.527 9.333 1.00 0.00 C ATOM 147 O ALA A 9 -7.859 -8.188 8.456 1.00 0.00 O ATOM 148 CB ALA A 9 -5.157 -8.159 10.537 1.00 0.00 C ATOM 0 H ALA A 9 -4.703 -5.779 10.144 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.396 -7.838 8.446 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -5.428 -9.213 10.473 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -4.072 -8.060 10.497 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -5.525 -7.747 11.477 1.00 0.00 H new ATOM 154 N ARG A 10 -7.944 -6.884 10.301 1.00 0.00 N ATOM 155 CA ARG A 10 -9.393 -6.918 10.395 1.00 0.00 C ATOM 156 C ARG A 10 -10.020 -6.265 9.161 1.00 0.00 C ATOM 157 O ARG A 10 -10.854 -6.870 8.490 1.00 0.00 O ATOM 158 CB ARG A 10 -9.882 -6.195 11.651 1.00 0.00 C ATOM 159 CG ARG A 10 -11.361 -6.486 11.912 1.00 0.00 C ATOM 160 CD ARG A 10 -12.051 -5.284 12.559 1.00 0.00 C ATOM 161 NE ARG A 10 -12.247 -5.532 14.005 1.00 0.00 N ATOM 162 CZ ARG A 10 -13.008 -4.769 14.802 1.00 0.00 C ATOM 163 NH1 ARG A 10 -13.651 -3.707 14.297 1.00 0.00 N ATOM 164 NH2 ARG A 10 -13.127 -5.069 16.102 1.00 0.00 N ATOM 0 H ARG A 10 -7.482 -6.336 11.027 1.00 0.00 H new ATOM 0 HA ARG A 10 -9.697 -7.963 10.451 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -9.289 -6.510 12.510 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -9.734 -5.121 11.537 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -11.858 -6.733 10.974 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -11.455 -7.356 12.561 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -11.449 -4.387 12.414 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -13.013 -5.104 12.079 1.00 0.00 H new ATOM 0 HE ARG A 10 -11.773 -6.334 14.421 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -13.561 -3.480 13.307 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -14.230 -3.126 14.903 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -12.638 -5.878 16.485 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -13.706 -4.488 16.708 1.00 0.00 H new ATOM 178 N THR A 11 -9.594 -5.038 8.900 1.00 0.00 N ATOM 179 CA THR A 11 -10.103 -4.296 7.760 1.00 0.00 C ATOM 180 C THR A 11 -9.926 -5.106 6.474 1.00 0.00 C ATOM 181 O THR A 11 -10.887 -5.332 5.741 1.00 0.00 O ATOM 182 CB THR A 11 -9.397 -2.939 7.725 1.00 0.00 C ATOM 183 OG1 THR A 11 -9.970 -2.220 8.814 1.00 0.00 O ATOM 184 CG2 THR A 11 -9.776 -2.112 6.495 1.00 0.00 C ATOM 0 H THR A 11 -8.902 -4.539 9.459 1.00 0.00 H new ATOM 0 HA THR A 11 -11.175 -4.119 7.851 1.00 0.00 H new ATOM 0 HB THR A 11 -8.318 -3.093 7.742 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.293 -2.087 9.511 1.00 0.00 H new ATOM 0 HG21 THR A 11 -9.247 -1.159 6.520 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.501 -2.656 5.592 1.00 0.00 H new ATOM 0 HG23 THR A 11 -10.851 -1.930 6.496 1.00 0.00 H new ATOM 192 N LEU A 12 -8.690 -5.520 6.240 1.00 0.00 N ATOM 193 CA LEU A 12 -8.374 -6.300 5.055 1.00 0.00 C ATOM 194 C LEU A 12 -9.287 -7.527 4.999 1.00 0.00 C ATOM 195 O LEU A 12 -9.896 -7.804 3.966 1.00 0.00 O ATOM 196 CB LEU A 12 -6.882 -6.643 5.020 1.00 0.00 C ATOM 197 CG LEU A 12 -6.056 -5.933 3.946 1.00 0.00 C ATOM 198 CD1 LEU A 12 -5.666 -4.524 4.395 1.00 0.00 C ATOM 199 CD2 LEU A 12 -4.836 -6.768 3.552 1.00 0.00 C ATOM 0 H LEU A 12 -7.895 -5.330 6.850 1.00 0.00 H new ATOM 0 HA LEU A 12 -8.565 -5.717 4.154 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.453 -6.409 5.994 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.780 -7.719 4.877 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.675 -5.826 3.055 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.080 -4.042 3.613 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -6.567 -3.940 4.585 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.073 -4.584 5.308 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -4.266 -6.241 2.787 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -4.207 -6.928 4.427 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -5.165 -7.731 3.160 1.00 0.00 H new ATOM 211 N LYS A 13 -9.355 -8.226 6.121 1.00 0.00 N ATOM 212 CA LYS A 13 -10.184 -9.416 6.213 1.00 0.00 C ATOM 213 C LYS A 13 -11.648 -9.030 5.992 1.00 0.00 C ATOM 214 O LYS A 13 -12.439 -9.835 5.501 1.00 0.00 O ATOM 215 CB LYS A 13 -9.933 -10.144 7.534 1.00 0.00 C ATOM 216 CG LYS A 13 -10.359 -11.611 7.442 1.00 0.00 C ATOM 217 CD LYS A 13 -9.145 -12.526 7.281 1.00 0.00 C ATOM 218 CE LYS A 13 -9.577 -13.963 6.980 1.00 0.00 C ATOM 219 NZ LYS A 13 -8.394 -14.828 6.776 1.00 0.00 N ATOM 0 H LYS A 13 -8.849 -7.992 6.975 1.00 0.00 H new ATOM 0 HA LYS A 13 -9.919 -10.126 5.430 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -8.875 -10.084 7.791 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -10.484 -9.651 8.335 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -10.912 -11.890 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -11.034 -11.745 6.597 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -8.511 -12.157 6.475 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -8.547 -12.506 8.192 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -10.179 -14.348 7.803 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -10.206 -13.981 6.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -8.705 -15.799 6.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -7.835 -14.469 5.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -7.809 -14.825 7.636 1.00 0.00 H new ATOM 233 N ARG A 14 -11.965 -7.798 6.364 1.00 0.00 N ATOM 234 CA ARG A 14 -13.320 -7.297 6.213 1.00 0.00 C ATOM 235 C ARG A 14 -13.521 -6.727 4.807 1.00 0.00 C ATOM 236 O ARG A 14 -14.653 -6.581 4.347 1.00 0.00 O ATOM 237 CB ARG A 14 -13.622 -6.208 7.244 1.00 0.00 C ATOM 238 CG ARG A 14 -15.127 -5.945 7.339 1.00 0.00 C ATOM 239 CD ARG A 14 -15.623 -6.107 8.777 1.00 0.00 C ATOM 240 NE ARG A 14 -16.096 -7.492 8.997 1.00 0.00 N ATOM 241 CZ ARG A 14 -16.355 -8.015 10.202 1.00 0.00 C ATOM 242 NH1 ARG A 14 -16.185 -7.273 11.305 1.00 0.00 N ATOM 243 NH2 ARG A 14 -16.781 -9.281 10.306 1.00 0.00 N ATOM 0 H ARG A 14 -11.307 -7.133 6.769 1.00 0.00 H new ATOM 0 HA ARG A 14 -14.002 -8.132 6.372 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -13.240 -6.509 8.219 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -13.105 -5.289 6.969 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -15.346 -4.937 6.986 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -15.662 -6.635 6.686 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -14.820 -5.873 9.476 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -16.431 -5.403 8.973 1.00 0.00 H new ATOM 0 HE ARG A 14 -16.233 -8.086 8.179 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -15.858 -6.310 11.226 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -16.382 -7.671 12.223 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -16.908 -9.847 9.467 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -16.978 -9.679 11.224 1.00 0.00 H new ATOM 257 N ASN A 15 -12.405 -6.419 4.162 1.00 0.00 N ATOM 258 CA ASN A 15 -12.444 -5.869 2.818 1.00 0.00 C ATOM 259 C ASN A 15 -12.450 -7.014 1.803 1.00 0.00 C ATOM 260 O ASN A 15 -13.166 -6.958 0.804 1.00 0.00 O ATOM 261 CB ASN A 15 -11.215 -5.000 2.542 1.00 0.00 C ATOM 262 CG ASN A 15 -11.595 -3.752 1.744 1.00 0.00 C ATOM 263 OD1 ASN A 15 -11.374 -3.658 0.547 1.00 0.00 O ATOM 264 ND2 ASN A 15 -12.177 -2.801 2.469 1.00 0.00 N ATOM 0 H ASN A 15 -11.468 -6.540 4.546 1.00 0.00 H new ATOM 0 HA ASN A 15 -13.344 -5.260 2.729 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -10.753 -4.707 3.485 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -10.473 -5.577 1.990 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -12.468 -1.929 2.027 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -12.333 -2.944 3.467 1.00 0.00 H new ATOM 271 N GLY A 16 -11.645 -8.025 2.094 1.00 0.00 N ATOM 272 CA GLY A 16 -11.549 -9.181 1.219 1.00 0.00 C ATOM 273 C GLY A 16 -10.222 -9.183 0.457 1.00 0.00 C ATOM 274 O GLY A 16 -10.186 -9.486 -0.734 1.00 0.00 O ATOM 0 H GLY A 16 -11.053 -8.068 2.924 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -11.636 -10.095 1.807 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -12.379 -9.176 0.512 1.00 0.00 H new ATOM 278 N MET A 17 -9.163 -8.842 1.177 1.00 0.00 N ATOM 279 CA MET A 17 -7.837 -8.801 0.583 1.00 0.00 C ATOM 280 C MET A 17 -6.874 -9.725 1.331 1.00 0.00 C ATOM 281 O MET A 17 -6.033 -10.381 0.716 1.00 0.00 O ATOM 282 CB MET A 17 -7.304 -7.367 0.623 1.00 0.00 C ATOM 283 CG MET A 17 -6.279 -7.133 -0.488 1.00 0.00 C ATOM 284 SD MET A 17 -5.317 -5.671 -0.134 1.00 0.00 S ATOM 285 CE MET A 17 -4.736 -5.278 -1.774 1.00 0.00 C ATOM 0 H MET A 17 -9.196 -8.592 2.165 1.00 0.00 H new ATOM 0 HA MET A 17 -7.910 -9.142 -0.450 1.00 0.00 H new ATOM 0 HB2 MET A 17 -8.130 -6.665 0.514 1.00 0.00 H new ATOM 0 HB3 MET A 17 -6.846 -7.172 1.593 1.00 0.00 H new ATOM 0 HG2 MET A 17 -5.622 -7.998 -0.576 1.00 0.00 H new ATOM 0 HG3 MET A 17 -6.788 -7.021 -1.445 1.00 0.00 H new ATOM 0 HE1 MET A 17 -3.792 -4.738 -1.706 1.00 0.00 H new ATOM 0 HE2 MET A 17 -4.587 -6.199 -2.338 1.00 0.00 H new ATOM 0 HE3 MET A 17 -5.474 -4.657 -2.282 1.00 0.00 H new ATOM 295 N ALA A 18 -7.028 -9.749 2.647 1.00 0.00 N ATOM 296 CA ALA A 18 -6.182 -10.581 3.484 1.00 0.00 C ATOM 297 C ALA A 18 -6.195 -12.016 2.950 1.00 0.00 C ATOM 298 O ALA A 18 -7.217 -12.697 3.016 1.00 0.00 O ATOM 299 CB ALA A 18 -6.658 -10.496 4.936 1.00 0.00 C ATOM 0 H ALA A 18 -7.727 -9.205 3.154 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.151 -10.228 3.457 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -6.023 -11.121 5.564 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -6.602 -9.462 5.277 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -7.689 -10.844 5.002 1.00 0.00 H new ATOM 305 N GLY A 19 -5.048 -12.431 2.432 1.00 0.00 N ATOM 306 CA GLY A 19 -4.915 -13.770 1.887 1.00 0.00 C ATOM 307 C GLY A 19 -5.337 -13.808 0.416 1.00 0.00 C ATOM 308 O GLY A 19 -5.835 -14.826 -0.064 1.00 0.00 O ATOM 0 H GLY A 19 -4.203 -11.863 2.379 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.882 -14.104 1.981 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -5.528 -14.463 2.463 1.00 0.00 H new ATOM 312 N TYR A 20 -5.125 -12.687 -0.257 1.00 0.00 N ATOM 313 CA TYR A 20 -5.478 -12.579 -1.662 1.00 0.00 C ATOM 314 C TYR A 20 -4.964 -13.785 -2.451 1.00 0.00 C ATOM 315 O TYR A 20 -4.318 -14.669 -1.890 1.00 0.00 O ATOM 316 CB TYR A 20 -4.784 -11.315 -2.176 1.00 0.00 C ATOM 317 CG TYR A 20 -5.378 -10.762 -3.472 1.00 0.00 C ATOM 318 CD1 TYR A 20 -6.557 -10.046 -3.440 1.00 0.00 C ATOM 319 CD2 TYR A 20 -4.736 -10.980 -4.674 1.00 0.00 C ATOM 320 CE1 TYR A 20 -7.116 -9.525 -4.660 1.00 0.00 C ATOM 321 CE2 TYR A 20 -5.295 -10.459 -5.894 1.00 0.00 C ATOM 322 CZ TYR A 20 -6.457 -9.758 -5.827 1.00 0.00 C ATOM 323 OH TYR A 20 -6.986 -9.265 -6.980 1.00 0.00 O ATOM 0 H TYR A 20 -4.713 -11.845 0.145 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.561 -12.540 -1.783 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.838 -10.545 -1.406 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -3.728 -11.532 -2.336 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.060 -9.876 -2.500 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -3.814 -11.542 -4.699 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -8.038 -8.962 -4.649 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -4.802 -10.622 -6.841 1.00 0.00 H new ATOM 0 HH TYR A 20 -6.409 -9.507 -7.734 1.00 0.00 H new ATOM 333 N TYR A 21 -5.269 -13.783 -3.740 1.00 0.00 N ATOM 334 CA TYR A 21 -4.847 -14.865 -4.611 1.00 0.00 C ATOM 335 C TYR A 21 -3.486 -15.417 -4.180 1.00 0.00 C ATOM 336 O TYR A 21 -3.333 -16.622 -3.986 1.00 0.00 O ATOM 337 CB TYR A 21 -4.717 -14.257 -6.009 1.00 0.00 C ATOM 338 CG TYR A 21 -5.803 -14.710 -6.987 1.00 0.00 C ATOM 339 CD1 TYR A 21 -6.995 -14.018 -7.063 1.00 0.00 C ATOM 340 CD2 TYR A 21 -5.591 -15.808 -7.793 1.00 0.00 C ATOM 341 CE1 TYR A 21 -8.018 -14.444 -7.983 1.00 0.00 C ATOM 342 CE2 TYR A 21 -6.613 -16.234 -8.715 1.00 0.00 C ATOM 343 CZ TYR A 21 -7.776 -15.531 -8.764 1.00 0.00 C ATOM 344 OH TYR A 21 -8.742 -15.932 -9.634 1.00 0.00 O ATOM 0 H TYR A 21 -5.804 -13.048 -4.202 1.00 0.00 H new ATOM 0 HA TYR A 21 -5.564 -15.685 -4.577 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -4.747 -13.171 -5.926 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -3.741 -14.518 -6.419 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -7.161 -13.157 -6.432 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -4.658 -16.349 -7.733 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -8.956 -13.913 -8.051 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.459 -17.092 -9.353 1.00 0.00 H new ATOM 0 HH TYR A 21 -8.431 -16.720 -10.127 1.00 0.00 H new ATOM 354 N GLY A 22 -2.532 -14.508 -4.042 1.00 0.00 N ATOM 355 CA GLY A 22 -1.189 -14.887 -3.639 1.00 0.00 C ATOM 356 C GLY A 22 -0.757 -14.124 -2.384 1.00 0.00 C ATOM 357 O GLY A 22 -0.540 -14.724 -1.333 1.00 0.00 O ATOM 0 H GLY A 22 -2.663 -13.509 -4.202 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -1.152 -15.959 -3.448 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -0.491 -14.684 -4.451 1.00 0.00 H new ATOM 361 N VAL A 23 -0.646 -12.813 -2.537 1.00 0.00 N ATOM 362 CA VAL A 23 -0.245 -11.961 -1.430 1.00 0.00 C ATOM 363 C VAL A 23 -1.008 -12.377 -0.171 1.00 0.00 C ATOM 364 O VAL A 23 -2.239 -12.386 -0.161 1.00 0.00 O ATOM 365 CB VAL A 23 -0.453 -10.491 -1.798 1.00 0.00 C ATOM 366 CG1 VAL A 23 0.226 -9.570 -0.783 1.00 0.00 C ATOM 367 CG2 VAL A 23 0.042 -10.205 -3.217 1.00 0.00 C ATOM 0 H VAL A 23 -0.827 -12.319 -3.411 1.00 0.00 H new ATOM 0 HA VAL A 23 0.818 -12.081 -1.221 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.523 -10.287 -1.770 1.00 0.00 H new ATOM 0 HG11 VAL A 23 0.063 -8.531 -1.068 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.196 -9.745 0.207 1.00 0.00 H new ATOM 0 HG13 VAL A 23 1.296 -9.777 -0.763 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -0.118 -9.153 -3.453 1.00 0.00 H new ATOM 0 HG22 VAL A 23 1.105 -10.435 -3.285 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -0.508 -10.823 -3.926 1.00 0.00 H new ATOM 377 N SER A 24 -0.247 -12.710 0.861 1.00 0.00 N ATOM 378 CA SER A 24 -0.836 -13.125 2.123 1.00 0.00 C ATOM 379 C SER A 24 -1.052 -11.908 3.025 1.00 0.00 C ATOM 380 O SER A 24 -0.327 -10.919 2.924 1.00 0.00 O ATOM 381 CB SER A 24 0.043 -14.159 2.828 1.00 0.00 C ATOM 382 OG SER A 24 -0.721 -15.244 3.348 1.00 0.00 O ATOM 0 H SER A 24 0.773 -12.701 0.849 1.00 0.00 H new ATOM 0 HA SER A 24 -1.799 -13.590 1.914 1.00 0.00 H new ATOM 0 HB2 SER A 24 0.786 -14.541 2.128 1.00 0.00 H new ATOM 0 HB3 SER A 24 0.589 -13.678 3.640 1.00 0.00 H new ATOM 0 HG SER A 24 -0.123 -15.883 3.789 1.00 0.00 H new ATOM 388 N LEU A 25 -2.052 -12.020 3.887 1.00 0.00 N ATOM 389 CA LEU A 25 -2.372 -10.941 4.806 1.00 0.00 C ATOM 390 C LEU A 25 -1.087 -10.448 5.475 1.00 0.00 C ATOM 391 O LEU A 25 -0.844 -9.244 5.551 1.00 0.00 O ATOM 392 CB LEU A 25 -3.450 -11.383 5.797 1.00 0.00 C ATOM 393 CG LEU A 25 -3.471 -10.646 7.138 1.00 0.00 C ATOM 394 CD1 LEU A 25 -3.615 -9.137 6.932 1.00 0.00 C ATOM 395 CD2 LEU A 25 -4.562 -11.206 8.054 1.00 0.00 C ATOM 0 H LEU A 25 -2.651 -12.841 3.968 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.796 -10.094 4.266 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -4.424 -11.261 5.323 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.322 -12.448 5.992 1.00 0.00 H new ATOM 0 HG LEU A 25 -2.515 -10.813 7.635 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.627 -8.637 7.901 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.775 -8.768 6.344 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.546 -8.929 6.405 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.556 -10.665 9.000 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -5.534 -11.089 7.576 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -4.374 -12.264 8.239 1.00 0.00 H new ATOM 407 N ALA A 26 -0.296 -11.404 5.942 1.00 0.00 N ATOM 408 CA ALA A 26 0.957 -11.082 6.601 1.00 0.00 C ATOM 409 C ALA A 26 1.860 -10.321 5.628 1.00 0.00 C ATOM 410 O ALA A 26 2.499 -9.340 6.006 1.00 0.00 O ATOM 411 CB ALA A 26 1.608 -12.367 7.116 1.00 0.00 C ATOM 0 H ALA A 26 -0.500 -12.401 5.876 1.00 0.00 H new ATOM 0 HA ALA A 26 0.782 -10.437 7.462 1.00 0.00 H new ATOM 0 HB1 ALA A 26 2.549 -12.125 7.611 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.940 -12.854 7.826 1.00 0.00 H new ATOM 0 HB3 ALA A 26 1.800 -13.038 6.279 1.00 0.00 H new ATOM 417 N ASP A 27 1.882 -10.801 4.392 1.00 0.00 N ATOM 418 CA ASP A 27 2.696 -10.178 3.362 1.00 0.00 C ATOM 419 C ASP A 27 2.209 -8.746 3.131 1.00 0.00 C ATOM 420 O ASP A 27 3.011 -7.842 2.902 1.00 0.00 O ATOM 421 CB ASP A 27 2.583 -10.936 2.038 1.00 0.00 C ATOM 422 CG ASP A 27 3.222 -12.326 2.034 1.00 0.00 C ATOM 423 OD1 ASP A 27 3.825 -12.678 3.070 1.00 0.00 O ATOM 424 OD2 ASP A 27 3.092 -13.007 0.993 1.00 0.00 O ATOM 0 H ASP A 27 1.349 -11.614 4.081 1.00 0.00 H new ATOM 0 HA ASP A 27 3.733 -10.191 3.697 1.00 0.00 H new ATOM 0 HB2 ASP A 27 1.528 -11.037 1.783 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.045 -10.337 1.253 1.00 0.00 H new ATOM 429 N TRP A 28 0.895 -8.584 3.197 1.00 0.00 N ATOM 430 CA TRP A 28 0.292 -7.278 2.997 1.00 0.00 C ATOM 431 C TRP A 28 0.730 -6.372 4.150 1.00 0.00 C ATOM 432 O TRP A 28 1.378 -5.351 3.929 1.00 0.00 O ATOM 433 CB TRP A 28 -1.229 -7.390 2.870 1.00 0.00 C ATOM 434 CG TRP A 28 -1.705 -7.890 1.505 1.00 0.00 C ATOM 435 CD1 TRP A 28 -2.383 -9.012 1.227 1.00 0.00 C ATOM 436 CD2 TRP A 28 -1.510 -7.235 0.233 1.00 0.00 C ATOM 437 NE1 TRP A 28 -2.638 -9.129 -0.124 1.00 0.00 N ATOM 438 CE2 TRP A 28 -2.090 -8.013 -0.747 1.00 0.00 C ATOM 439 CE3 TRP A 28 -0.863 -6.026 -0.077 1.00 0.00 C ATOM 440 CZ2 TRP A 28 -2.082 -7.668 -2.104 1.00 0.00 C ATOM 441 CZ3 TRP A 28 -0.865 -5.695 -1.438 1.00 0.00 C ATOM 442 CH2 TRP A 28 -1.445 -6.468 -2.437 1.00 0.00 C ATOM 0 H TRP A 28 0.232 -9.336 3.386 1.00 0.00 H new ATOM 0 HA TRP A 28 0.631 -6.837 2.060 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -1.599 -8.065 3.642 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -1.672 -6.413 3.062 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -2.691 -9.735 1.968 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -3.136 -9.893 -0.581 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -0.401 -5.402 0.674 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -2.543 -8.295 -2.853 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -0.382 -4.775 -1.732 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -1.404 -6.143 -3.466 1.00 0.00 H new ATOM 453 N VAL A 29 0.359 -6.781 5.354 1.00 0.00 N ATOM 454 CA VAL A 29 0.706 -6.019 6.542 1.00 0.00 C ATOM 455 C VAL A 29 2.206 -5.715 6.527 1.00 0.00 C ATOM 456 O VAL A 29 2.609 -4.555 6.617 1.00 0.00 O ATOM 457 CB VAL A 29 0.262 -6.774 7.796 1.00 0.00 C ATOM 458 CG1 VAL A 29 0.354 -5.881 9.035 1.00 0.00 C ATOM 459 CG2 VAL A 29 -1.151 -7.334 7.627 1.00 0.00 C ATOM 0 H VAL A 29 -0.178 -7.630 5.533 1.00 0.00 H new ATOM 0 HA VAL A 29 0.180 -5.064 6.551 1.00 0.00 H new ATOM 0 HB VAL A 29 0.940 -7.615 7.939 1.00 0.00 H new ATOM 0 HG11 VAL A 29 0.033 -6.442 9.913 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.384 -5.553 9.171 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -0.290 -5.011 8.905 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -1.442 -7.866 8.533 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -1.848 -6.515 7.447 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -1.172 -8.020 6.780 1.00 0.00 H new ATOM 469 N CYS A 30 2.992 -6.774 6.411 1.00 0.00 N ATOM 470 CA CYS A 30 4.438 -6.636 6.383 1.00 0.00 C ATOM 471 C CYS A 30 4.801 -5.608 5.309 1.00 0.00 C ATOM 472 O CYS A 30 5.566 -4.680 5.565 1.00 0.00 O ATOM 473 CB CYS A 30 5.131 -7.979 6.147 1.00 0.00 C ATOM 474 SG CYS A 30 5.434 -8.386 4.388 1.00 0.00 S ATOM 0 H CYS A 30 2.654 -7.734 6.335 1.00 0.00 H new ATOM 0 HA CYS A 30 4.792 -6.287 7.353 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.085 -7.978 6.675 1.00 0.00 H new ATOM 0 HB3 CYS A 30 4.523 -8.769 6.589 1.00 0.00 H new ATOM 479 N LEU A 31 4.234 -5.809 4.128 1.00 0.00 N ATOM 480 CA LEU A 31 4.488 -4.912 3.014 1.00 0.00 C ATOM 481 C LEU A 31 4.304 -3.465 3.477 1.00 0.00 C ATOM 482 O LEU A 31 5.221 -2.653 3.365 1.00 0.00 O ATOM 483 CB LEU A 31 3.618 -5.289 1.814 1.00 0.00 C ATOM 484 CG LEU A 31 3.812 -4.444 0.553 1.00 0.00 C ATOM 485 CD1 LEU A 31 3.542 -2.966 0.837 1.00 0.00 C ATOM 486 CD2 LEU A 31 5.200 -4.669 -0.049 1.00 0.00 C ATOM 0 H LEU A 31 3.600 -6.580 3.919 1.00 0.00 H new ATOM 0 HA LEU A 31 5.519 -5.009 2.674 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.813 -6.331 1.562 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.572 -5.224 2.114 1.00 0.00 H new ATOM 0 HG LEU A 31 3.083 -4.767 -0.190 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.687 -2.388 -0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.516 -2.844 1.185 1.00 0.00 H new ATOM 0 HD13 LEU A 31 4.230 -2.611 1.604 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.312 -4.057 -0.944 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.962 -4.390 0.679 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.317 -5.720 -0.312 1.00 0.00 H new ATOM 498 N ALA A 32 3.113 -3.188 3.987 1.00 0.00 N ATOM 499 CA ALA A 32 2.799 -1.854 4.469 1.00 0.00 C ATOM 500 C ALA A 32 3.618 -1.563 5.727 1.00 0.00 C ATOM 501 O ALA A 32 3.812 -0.404 6.091 1.00 0.00 O ATOM 502 CB ALA A 32 1.292 -1.742 4.714 1.00 0.00 C ATOM 0 H ALA A 32 2.355 -3.864 4.077 1.00 0.00 H new ATOM 0 HA ALA A 32 3.065 -1.104 3.724 1.00 0.00 H new ATOM 0 HB1 ALA A 32 1.056 -0.741 5.076 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.757 -1.927 3.782 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.989 -2.478 5.459 1.00 0.00 H new ATOM 508 N GLN A 33 4.076 -2.634 6.358 1.00 0.00 N ATOM 509 CA GLN A 33 4.870 -2.508 7.567 1.00 0.00 C ATOM 510 C GLN A 33 6.211 -1.842 7.256 1.00 0.00 C ATOM 511 O GLN A 33 6.576 -0.850 7.884 1.00 0.00 O ATOM 512 CB GLN A 33 5.076 -3.871 8.232 1.00 0.00 C ATOM 513 CG GLN A 33 5.426 -3.712 9.713 1.00 0.00 C ATOM 514 CD GLN A 33 6.733 -2.934 9.888 1.00 0.00 C ATOM 515 OE1 GLN A 33 7.743 -3.222 9.268 1.00 0.00 O ATOM 516 NE2 GLN A 33 6.655 -1.936 10.762 1.00 0.00 N ATOM 0 H GLN A 33 3.912 -3.594 6.054 1.00 0.00 H new ATOM 0 HA GLN A 33 4.327 -1.875 8.269 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.171 -4.469 8.131 1.00 0.00 H new ATOM 0 HB3 GLN A 33 5.874 -4.411 7.722 1.00 0.00 H new ATOM 0 HG2 GLN A 33 4.618 -3.192 10.227 1.00 0.00 H new ATOM 0 HG3 GLN A 33 5.519 -4.694 10.176 1.00 0.00 H new ATOM 0 HE21 GLN A 33 5.777 -1.750 11.247 1.00 0.00 H new ATOM 0 HE22 GLN A 33 7.473 -1.356 10.948 1.00 0.00 H new ATOM 525 N HIS A 34 6.909 -2.414 6.285 1.00 0.00 N ATOM 526 CA HIS A 34 8.201 -1.887 5.882 1.00 0.00 C ATOM 527 C HIS A 34 8.026 -0.482 5.303 1.00 0.00 C ATOM 528 O HIS A 34 8.989 0.276 5.202 1.00 0.00 O ATOM 529 CB HIS A 34 8.900 -2.845 4.914 1.00 0.00 C ATOM 530 CG HIS A 34 10.408 -2.778 4.967 1.00 0.00 C ATOM 531 ND1 HIS A 34 11.221 -3.523 4.129 1.00 0.00 N ATOM 532 CD2 HIS A 34 11.241 -2.048 5.763 1.00 0.00 C ATOM 533 CE1 HIS A 34 12.484 -3.247 4.418 1.00 0.00 C ATOM 534 NE2 HIS A 34 12.494 -2.333 5.431 1.00 0.00 N ATOM 0 H HIS A 34 6.603 -3.237 5.766 1.00 0.00 H new ATOM 0 HA HIS A 34 8.851 -1.804 6.753 1.00 0.00 H new ATOM 0 HB2 HIS A 34 8.584 -3.864 5.136 1.00 0.00 H new ATOM 0 HB3 HIS A 34 8.572 -2.623 3.899 1.00 0.00 H new ATOM 0 HD2 HIS A 34 10.933 -1.356 6.533 1.00 0.00 H new ATOM 0 HE1 HIS A 34 13.353 -3.671 3.937 1.00 0.00 H new ATOM 0 HE2 HIS A 34 13.328 -1.934 5.862 1.00 0.00 H new ATOM 543 N GLU A 35 6.788 -0.177 4.940 1.00 0.00 N ATOM 544 CA GLU A 35 6.474 1.123 4.374 1.00 0.00 C ATOM 545 C GLU A 35 6.313 2.162 5.486 1.00 0.00 C ATOM 546 O GLU A 35 7.117 3.085 5.599 1.00 0.00 O ATOM 547 CB GLU A 35 5.218 1.053 3.503 1.00 0.00 C ATOM 548 CG GLU A 35 5.404 0.066 2.349 1.00 0.00 C ATOM 549 CD GLU A 35 5.968 0.768 1.112 1.00 0.00 C ATOM 550 OE1 GLU A 35 7.076 1.332 1.236 1.00 0.00 O ATOM 551 OE2 GLU A 35 5.278 0.725 0.071 1.00 0.00 O ATOM 0 H GLU A 35 5.991 -0.808 5.027 1.00 0.00 H new ATOM 0 HA GLU A 35 7.303 1.429 3.735 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.366 0.750 4.111 1.00 0.00 H new ATOM 0 HB3 GLU A 35 4.991 2.043 3.107 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.077 -0.735 2.656 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.448 -0.397 2.104 1.00 0.00 H new ATOM 558 N SER A 36 5.269 1.975 6.280 1.00 0.00 N ATOM 559 CA SER A 36 4.992 2.884 7.379 1.00 0.00 C ATOM 560 C SER A 36 4.001 2.241 8.352 1.00 0.00 C ATOM 561 O SER A 36 4.355 1.932 9.489 1.00 0.00 O ATOM 562 CB SER A 36 4.444 4.217 6.867 1.00 0.00 C ATOM 563 OG SER A 36 3.138 4.081 6.315 1.00 0.00 O ATOM 0 H SER A 36 4.605 1.207 6.184 1.00 0.00 H new ATOM 0 HA SER A 36 5.927 3.084 7.902 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.418 4.937 7.685 1.00 0.00 H new ATOM 0 HB3 SER A 36 5.117 4.619 6.110 1.00 0.00 H new ATOM 0 HG SER A 36 2.551 4.772 6.688 1.00 0.00 H new ATOM 569 N ASN A 37 2.780 2.060 7.871 1.00 0.00 N ATOM 570 CA ASN A 37 1.736 1.460 8.684 1.00 0.00 C ATOM 571 C ASN A 37 1.268 2.472 9.732 1.00 0.00 C ATOM 572 O ASN A 37 1.878 3.528 9.897 1.00 0.00 O ATOM 573 CB ASN A 37 2.255 0.222 9.419 1.00 0.00 C ATOM 574 CG ASN A 37 1.121 -0.771 9.686 1.00 0.00 C ATOM 575 OD1 ASN A 37 0.629 -1.443 8.795 1.00 0.00 O ATOM 576 ND2 ASN A 37 0.738 -0.825 10.957 1.00 0.00 N ATOM 0 H ASN A 37 2.490 2.319 6.928 1.00 0.00 H new ATOM 0 HA ASN A 37 0.917 1.171 8.025 1.00 0.00 H new ATOM 0 HB2 ASN A 37 3.032 -0.259 8.825 1.00 0.00 H new ATOM 0 HB3 ASN A 37 2.713 0.520 10.362 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -0.011 -1.458 11.237 1.00 0.00 H new ATOM 0 HD22 ASN A 37 1.193 -0.234 11.652 1.00 0.00 H new ATOM 583 N TYR A 38 0.190 2.113 10.413 1.00 0.00 N ATOM 584 CA TYR A 38 -0.368 2.976 11.441 1.00 0.00 C ATOM 585 C TYR A 38 -0.993 4.230 10.824 1.00 0.00 C ATOM 586 O TYR A 38 -2.180 4.492 11.012 1.00 0.00 O ATOM 587 CB TYR A 38 0.808 3.392 12.326 1.00 0.00 C ATOM 588 CG TYR A 38 1.816 2.270 12.589 1.00 0.00 C ATOM 589 CD1 TYR A 38 1.453 1.185 13.362 1.00 0.00 C ATOM 590 CD2 TYR A 38 3.085 2.343 12.055 1.00 0.00 C ATOM 591 CE1 TYR A 38 2.400 0.130 13.609 1.00 0.00 C ATOM 592 CE2 TYR A 38 4.033 1.287 12.304 1.00 0.00 C ATOM 593 CZ TYR A 38 3.644 0.232 13.068 1.00 0.00 C ATOM 594 OH TYR A 38 4.539 -0.765 13.302 1.00 0.00 O ATOM 0 H TYR A 38 -0.312 1.236 10.273 1.00 0.00 H new ATOM 0 HA TYR A 38 -1.147 2.455 11.997 1.00 0.00 H new ATOM 0 HB2 TYR A 38 1.325 4.228 11.856 1.00 0.00 H new ATOM 0 HB3 TYR A 38 0.422 3.751 13.280 1.00 0.00 H new ATOM 0 HD1 TYR A 38 0.459 1.128 13.781 1.00 0.00 H new ATOM 0 HD2 TYR A 38 3.368 3.192 11.450 1.00 0.00 H new ATOM 0 HE1 TYR A 38 2.129 -0.725 14.211 1.00 0.00 H new ATOM 0 HE2 TYR A 38 5.031 1.333 11.893 1.00 0.00 H new ATOM 0 HH TYR A 38 5.385 -0.558 12.852 1.00 0.00 H new ATOM 604 N ASN A 39 -0.167 4.970 10.100 1.00 0.00 N ATOM 605 CA ASN A 39 -0.623 6.190 9.455 1.00 0.00 C ATOM 606 C ASN A 39 -0.021 6.274 8.051 1.00 0.00 C ATOM 607 O ASN A 39 1.182 6.088 7.876 1.00 0.00 O ATOM 608 CB ASN A 39 -0.178 7.426 10.237 1.00 0.00 C ATOM 609 CG ASN A 39 0.926 7.076 11.236 1.00 0.00 C ATOM 610 OD1 ASN A 39 1.896 6.407 10.919 1.00 0.00 O ATOM 611 ND2 ASN A 39 0.727 7.565 12.456 1.00 0.00 N ATOM 0 H ASN A 39 0.817 4.748 9.945 1.00 0.00 H new ATOM 0 HA ASN A 39 -1.712 6.164 9.414 1.00 0.00 H new ATOM 0 HB2 ASN A 39 0.181 8.188 9.545 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -1.030 7.852 10.766 1.00 0.00 H new ATOM 0 HD21 ASN A 39 1.408 7.388 13.194 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -0.107 8.118 12.654 1.00 0.00 H new ATOM 618 N THR A 40 -0.886 6.558 7.088 1.00 0.00 N ATOM 619 CA THR A 40 -0.453 6.671 5.704 1.00 0.00 C ATOM 620 C THR A 40 0.256 8.007 5.475 1.00 0.00 C ATOM 621 O THR A 40 -0.115 8.765 4.581 1.00 0.00 O ATOM 622 CB THR A 40 -1.678 6.472 4.809 1.00 0.00 C ATOM 623 OG1 THR A 40 -2.409 7.687 4.944 1.00 0.00 O ATOM 624 CG2 THR A 40 -2.630 5.402 5.349 1.00 0.00 C ATOM 0 H THR A 40 -1.883 6.713 7.238 1.00 0.00 H new ATOM 0 HA THR A 40 0.279 5.903 5.454 1.00 0.00 H new ATOM 0 HB THR A 40 -1.353 6.196 3.806 1.00 0.00 H new ATOM 0 HG1 THR A 40 -1.918 8.414 4.508 1.00 0.00 H new ATOM 0 HG21 THR A 40 -3.482 5.300 4.677 1.00 0.00 H new ATOM 0 HG22 THR A 40 -2.105 4.449 5.417 1.00 0.00 H new ATOM 0 HG23 THR A 40 -2.981 5.694 6.339 1.00 0.00 H new ATOM 632 N ARG A 41 1.265 8.253 6.298 1.00 0.00 N ATOM 633 CA ARG A 41 2.031 9.483 6.195 1.00 0.00 C ATOM 634 C ARG A 41 3.063 9.376 5.071 1.00 0.00 C ATOM 635 O ARG A 41 3.730 10.354 4.739 1.00 0.00 O ATOM 636 CB ARG A 41 2.750 9.796 7.509 1.00 0.00 C ATOM 637 CG ARG A 41 3.421 11.170 7.454 1.00 0.00 C ATOM 638 CD ARG A 41 4.922 11.058 7.730 1.00 0.00 C ATOM 639 NE ARG A 41 5.678 11.157 6.461 1.00 0.00 N ATOM 640 CZ ARG A 41 6.977 11.475 6.384 1.00 0.00 C ATOM 641 NH1 ARG A 41 7.673 11.728 7.501 1.00 0.00 N ATOM 642 NH2 ARG A 41 7.581 11.541 5.190 1.00 0.00 N ATOM 0 H ARG A 41 1.570 7.621 7.039 1.00 0.00 H new ATOM 0 HA ARG A 41 1.332 10.290 5.974 1.00 0.00 H new ATOM 0 HB2 ARG A 41 2.037 9.768 8.333 1.00 0.00 H new ATOM 0 HB3 ARG A 41 3.499 9.030 7.709 1.00 0.00 H new ATOM 0 HG2 ARG A 41 3.260 11.618 6.474 1.00 0.00 H new ATOM 0 HG3 ARG A 41 2.961 11.833 8.187 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.235 11.849 8.412 1.00 0.00 H new ATOM 0 HD3 ARG A 41 5.140 10.109 8.220 1.00 0.00 H new ATOM 0 HE ARG A 41 5.179 10.972 5.591 1.00 0.00 H new ATOM 0 HH11 ARG A 41 7.214 11.678 8.410 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.662 11.970 7.442 1.00 0.00 H new ATOM 0 HH21 ARG A 41 7.052 11.349 4.339 1.00 0.00 H new ATOM 0 HH22 ARG A 41 8.570 11.783 5.132 1.00 0.00 H new ATOM 656 N ALA A 42 3.162 8.176 4.515 1.00 0.00 N ATOM 657 CA ALA A 42 4.101 7.928 3.435 1.00 0.00 C ATOM 658 C ALA A 42 3.897 8.972 2.336 1.00 0.00 C ATOM 659 O ALA A 42 2.938 8.893 1.569 1.00 0.00 O ATOM 660 CB ALA A 42 3.920 6.498 2.920 1.00 0.00 C ATOM 0 H ALA A 42 2.607 7.366 4.793 1.00 0.00 H new ATOM 0 HA ALA A 42 5.127 8.020 3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 42 4.624 6.311 2.109 1.00 0.00 H new ATOM 0 HB2 ALA A 42 4.105 5.793 3.731 1.00 0.00 H new ATOM 0 HB3 ALA A 42 2.902 6.370 2.553 1.00 0.00 H new ATOM 666 N THR A 43 4.813 9.928 2.295 1.00 0.00 N ATOM 667 CA THR A 43 4.746 10.987 1.303 1.00 0.00 C ATOM 668 C THR A 43 6.154 11.439 0.907 1.00 0.00 C ATOM 669 O THR A 43 6.949 11.827 1.762 1.00 0.00 O ATOM 670 CB THR A 43 3.885 12.116 1.874 1.00 0.00 C ATOM 671 OG1 THR A 43 4.241 12.161 3.253 1.00 0.00 O ATOM 672 CG2 THR A 43 2.396 11.767 1.884 1.00 0.00 C ATOM 0 H THR A 43 5.606 9.991 2.933 1.00 0.00 H new ATOM 0 HA THR A 43 4.280 10.636 0.382 1.00 0.00 H new ATOM 0 HB THR A 43 4.041 13.023 1.290 1.00 0.00 H new ATOM 0 HG1 THR A 43 3.661 11.556 3.760 1.00 0.00 H new ATOM 0 HG21 THR A 43 1.830 12.601 2.298 1.00 0.00 H new ATOM 0 HG22 THR A 43 2.061 11.572 0.865 1.00 0.00 H new ATOM 0 HG23 THR A 43 2.234 10.879 2.496 1.00 0.00 H new ATOM 680 N ASN A 44 6.420 11.372 -0.389 1.00 0.00 N ATOM 681 CA ASN A 44 7.718 11.768 -0.908 1.00 0.00 C ATOM 682 C ASN A 44 7.554 12.285 -2.339 1.00 0.00 C ATOM 683 O ASN A 44 7.432 11.499 -3.277 1.00 0.00 O ATOM 684 CB ASN A 44 8.683 10.581 -0.942 1.00 0.00 C ATOM 685 CG ASN A 44 9.988 10.913 -0.214 1.00 0.00 C ATOM 686 OD1 ASN A 44 10.020 11.128 0.986 1.00 0.00 O ATOM 687 ND2 ASN A 44 11.056 10.942 -1.005 1.00 0.00 N ATOM 0 H ASN A 44 5.759 11.049 -1.095 1.00 0.00 H new ATOM 0 HA ASN A 44 8.121 12.542 -0.254 1.00 0.00 H new ATOM 0 HB2 ASN A 44 8.214 9.713 -0.478 1.00 0.00 H new ATOM 0 HB3 ASN A 44 8.898 10.312 -1.976 1.00 0.00 H new ATOM 0 HD21 ASN A 44 11.974 11.154 -0.615 1.00 0.00 H new ATOM 0 HD22 ASN A 44 10.957 10.752 -2.002 1.00 0.00 H new ATOM 694 N TYR A 45 7.557 13.605 -2.460 1.00 0.00 N ATOM 695 CA TYR A 45 7.410 14.236 -3.759 1.00 0.00 C ATOM 696 C TYR A 45 8.770 14.418 -4.439 1.00 0.00 C ATOM 697 O TYR A 45 9.798 14.491 -3.767 1.00 0.00 O ATOM 698 CB TYR A 45 6.800 15.613 -3.493 1.00 0.00 C ATOM 699 CG TYR A 45 5.905 16.127 -4.623 1.00 0.00 C ATOM 700 CD1 TYR A 45 6.468 16.710 -5.739 1.00 0.00 C ATOM 701 CD2 TYR A 45 4.533 16.008 -4.524 1.00 0.00 C ATOM 702 CE1 TYR A 45 5.625 17.192 -6.802 1.00 0.00 C ATOM 703 CE2 TYR A 45 3.690 16.491 -5.587 1.00 0.00 C ATOM 704 CZ TYR A 45 4.278 17.059 -6.674 1.00 0.00 C ATOM 705 OH TYR A 45 3.483 17.516 -7.678 1.00 0.00 O ATOM 0 H TYR A 45 7.659 14.254 -1.679 1.00 0.00 H new ATOM 0 HA TYR A 45 6.791 13.623 -4.414 1.00 0.00 H new ATOM 0 HB2 TYR A 45 6.217 15.569 -2.573 1.00 0.00 H new ATOM 0 HB3 TYR A 45 7.605 16.329 -3.326 1.00 0.00 H new ATOM 0 HD1 TYR A 45 7.541 16.805 -5.815 1.00 0.00 H new ATOM 0 HD2 TYR A 45 4.092 15.553 -3.650 1.00 0.00 H new ATOM 0 HE1 TYR A 45 6.053 17.649 -7.682 1.00 0.00 H new ATOM 0 HE2 TYR A 45 2.615 16.404 -5.523 1.00 0.00 H new ATOM 0 HH TYR A 45 2.544 17.354 -7.451 1.00 0.00 H new ATOM 715 N ASN A 46 8.731 14.484 -5.761 1.00 0.00 N ATOM 716 CA ASN A 46 9.947 14.654 -6.538 1.00 0.00 C ATOM 717 C ASN A 46 9.589 15.191 -7.926 1.00 0.00 C ATOM 718 O ASN A 46 9.103 14.446 -8.776 1.00 0.00 O ATOM 719 CB ASN A 46 10.676 13.323 -6.719 1.00 0.00 C ATOM 720 CG ASN A 46 11.247 12.825 -5.390 1.00 0.00 C ATOM 721 OD1 ASN A 46 10.694 11.958 -4.733 1.00 0.00 O ATOM 722 ND2 ASN A 46 12.382 13.419 -5.033 1.00 0.00 N ATOM 0 H ASN A 46 7.876 14.423 -6.314 1.00 0.00 H new ATOM 0 HA ASN A 46 10.595 15.349 -6.003 1.00 0.00 H new ATOM 0 HB2 ASN A 46 9.989 12.580 -7.125 1.00 0.00 H new ATOM 0 HB3 ASN A 46 11.482 13.441 -7.443 1.00 0.00 H new ATOM 0 HD21 ASN A 46 12.843 13.156 -4.162 1.00 0.00 H new ATOM 0 HD22 ASN A 46 12.791 14.138 -5.630 1.00 0.00 H new ATOM 729 N ARG A 47 9.844 16.477 -8.112 1.00 0.00 N ATOM 730 CA ARG A 47 9.555 17.122 -9.382 1.00 0.00 C ATOM 731 C ARG A 47 10.618 16.751 -10.419 1.00 0.00 C ATOM 732 O ARG A 47 10.312 16.611 -11.602 1.00 0.00 O ATOM 733 CB ARG A 47 9.510 18.643 -9.230 1.00 0.00 C ATOM 734 CG ARG A 47 8.503 19.262 -10.202 1.00 0.00 C ATOM 735 CD ARG A 47 8.995 20.619 -10.709 1.00 0.00 C ATOM 736 NE ARG A 47 9.083 20.605 -12.187 1.00 0.00 N ATOM 737 CZ ARG A 47 10.106 20.078 -12.874 1.00 0.00 C ATOM 738 NH1 ARG A 47 11.133 19.519 -12.221 1.00 0.00 N ATOM 739 NH2 ARG A 47 10.101 20.111 -14.213 1.00 0.00 N ATOM 0 H ARG A 47 10.248 17.091 -7.404 1.00 0.00 H new ATOM 0 HA ARG A 47 8.578 16.773 -9.716 1.00 0.00 H new ATOM 0 HB2 ARG A 47 9.239 18.902 -8.206 1.00 0.00 H new ATOM 0 HB3 ARG A 47 10.500 19.060 -9.413 1.00 0.00 H new ATOM 0 HG2 ARG A 47 8.346 18.590 -11.045 1.00 0.00 H new ATOM 0 HG3 ARG A 47 7.540 19.382 -9.706 1.00 0.00 H new ATOM 0 HD2 ARG A 47 8.315 21.406 -10.384 1.00 0.00 H new ATOM 0 HD3 ARG A 47 9.971 20.845 -10.280 1.00 0.00 H new ATOM 0 HE ARG A 47 8.317 21.023 -12.715 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.136 19.494 -11.201 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.912 19.118 -12.743 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.319 20.537 -14.710 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.880 19.710 -14.736 1.00 0.00 H new ATOM 753 N GLY A 48 11.842 16.601 -9.936 1.00 0.00 N ATOM 754 CA GLY A 48 12.951 16.249 -10.808 1.00 0.00 C ATOM 755 C GLY A 48 12.506 15.265 -11.891 1.00 0.00 C ATOM 756 O GLY A 48 12.925 15.372 -13.042 1.00 0.00 O ATOM 0 H GLY A 48 12.091 16.716 -8.954 1.00 0.00 H new ATOM 0 HA2 GLY A 48 13.353 17.149 -11.273 1.00 0.00 H new ATOM 0 HA3 GLY A 48 13.755 15.808 -10.219 1.00 0.00 H new ATOM 760 N ASP A 49 11.662 14.327 -11.484 1.00 0.00 N ATOM 761 CA ASP A 49 11.157 13.325 -12.405 1.00 0.00 C ATOM 762 C ASP A 49 9.627 13.335 -12.374 1.00 0.00 C ATOM 763 O ASP A 49 8.992 12.296 -12.542 1.00 0.00 O ATOM 764 CB ASP A 49 11.627 11.924 -12.008 1.00 0.00 C ATOM 765 CG ASP A 49 11.189 10.802 -12.953 1.00 0.00 C ATOM 766 OD1 ASP A 49 11.514 10.913 -14.154 1.00 0.00 O ATOM 767 OD2 ASP A 49 10.539 9.860 -12.451 1.00 0.00 O ATOM 0 H ASP A 49 11.316 14.241 -10.528 1.00 0.00 H new ATOM 0 HA ASP A 49 11.532 13.563 -13.400 1.00 0.00 H new ATOM 0 HB2 ASP A 49 12.715 11.925 -11.950 1.00 0.00 H new ATOM 0 HB3 ASP A 49 11.255 11.702 -11.008 1.00 0.00 H new ATOM 772 N GLN A 50 9.080 14.523 -12.159 1.00 0.00 N ATOM 773 CA GLN A 50 7.637 14.684 -12.105 1.00 0.00 C ATOM 774 C GLN A 50 6.985 13.430 -11.518 1.00 0.00 C ATOM 775 O GLN A 50 5.984 12.943 -12.042 1.00 0.00 O ATOM 776 CB GLN A 50 7.068 15.001 -13.488 1.00 0.00 C ATOM 777 CG GLN A 50 7.281 13.831 -14.450 1.00 0.00 C ATOM 778 CD GLN A 50 6.654 14.122 -15.816 1.00 0.00 C ATOM 779 OE1 GLN A 50 6.367 15.255 -16.167 1.00 0.00 O ATOM 780 NE2 GLN A 50 6.458 13.039 -16.563 1.00 0.00 N ATOM 0 H GLN A 50 9.611 15.383 -12.020 1.00 0.00 H new ATOM 0 HA GLN A 50 7.410 15.528 -11.453 1.00 0.00 H new ATOM 0 HB2 GLN A 50 6.003 15.220 -13.406 1.00 0.00 H new ATOM 0 HB3 GLN A 50 7.547 15.895 -13.886 1.00 0.00 H new ATOM 0 HG2 GLN A 50 8.348 13.643 -14.568 1.00 0.00 H new ATOM 0 HG3 GLN A 50 6.842 12.926 -14.030 1.00 0.00 H new ATOM 0 HE21 GLN A 50 6.721 12.120 -16.208 1.00 0.00 H new ATOM 0 HE22 GLN A 50 6.044 13.128 -17.491 1.00 0.00 H new ATOM 789 N SER A 51 7.579 12.942 -10.438 1.00 0.00 N ATOM 790 CA SER A 51 7.070 11.754 -9.776 1.00 0.00 C ATOM 791 C SER A 51 6.994 11.990 -8.266 1.00 0.00 C ATOM 792 O SER A 51 7.808 12.723 -7.706 1.00 0.00 O ATOM 793 CB SER A 51 7.943 10.536 -10.080 1.00 0.00 C ATOM 794 OG SER A 51 7.940 10.209 -11.467 1.00 0.00 O ATOM 0 H SER A 51 8.408 13.349 -10.005 1.00 0.00 H new ATOM 0 HA SER A 51 6.069 11.552 -10.157 1.00 0.00 H new ATOM 0 HB2 SER A 51 8.965 10.733 -9.756 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.586 9.681 -9.505 1.00 0.00 H new ATOM 0 HG SER A 51 8.644 10.715 -11.924 1.00 0.00 H new ATOM 800 N THR A 52 6.008 11.354 -7.648 1.00 0.00 N ATOM 801 CA THR A 52 5.817 11.485 -6.214 1.00 0.00 C ATOM 802 C THR A 52 5.437 10.135 -5.602 1.00 0.00 C ATOM 803 O THR A 52 4.572 9.433 -6.124 1.00 0.00 O ATOM 804 CB THR A 52 4.770 12.576 -5.975 1.00 0.00 C ATOM 805 OG1 THR A 52 5.493 13.792 -6.141 1.00 0.00 O ATOM 806 CG2 THR A 52 4.293 12.621 -4.522 1.00 0.00 C ATOM 0 H THR A 52 5.334 10.747 -8.115 1.00 0.00 H new ATOM 0 HA THR A 52 6.740 11.784 -5.717 1.00 0.00 H new ATOM 0 HB THR A 52 3.916 12.411 -6.632 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.984 14.531 -5.747 1.00 0.00 H new ATOM 0 HG21 THR A 52 3.552 13.412 -4.407 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.846 11.663 -4.256 1.00 0.00 H new ATOM 0 HG23 THR A 52 5.141 12.820 -3.867 1.00 0.00 H new ATOM 814 N ASP A 53 6.104 9.812 -4.503 1.00 0.00 N ATOM 815 CA ASP A 53 5.847 8.558 -3.814 1.00 0.00 C ATOM 816 C ASP A 53 5.028 8.835 -2.552 1.00 0.00 C ATOM 817 O ASP A 53 5.584 9.172 -1.507 1.00 0.00 O ATOM 818 CB ASP A 53 7.154 7.886 -3.391 1.00 0.00 C ATOM 819 CG ASP A 53 8.205 7.762 -4.497 1.00 0.00 C ATOM 820 OD1 ASP A 53 7.923 8.263 -5.606 1.00 0.00 O ATOM 821 OD2 ASP A 53 9.267 7.170 -4.207 1.00 0.00 O ATOM 0 H ASP A 53 6.821 10.396 -4.073 1.00 0.00 H new ATOM 0 HA ASP A 53 5.308 7.901 -4.496 1.00 0.00 H new ATOM 0 HB2 ASP A 53 7.584 8.450 -2.564 1.00 0.00 H new ATOM 0 HB3 ASP A 53 6.927 6.889 -3.013 1.00 0.00 H new ATOM 826 N TYR A 54 3.719 8.680 -2.688 1.00 0.00 N ATOM 827 CA TYR A 54 2.818 8.907 -1.572 1.00 0.00 C ATOM 828 C TYR A 54 1.921 7.690 -1.333 1.00 0.00 C ATOM 829 O TYR A 54 1.743 6.862 -2.225 1.00 0.00 O ATOM 830 CB TYR A 54 1.945 10.098 -1.971 1.00 0.00 C ATOM 831 CG TYR A 54 2.519 11.456 -1.563 1.00 0.00 C ATOM 832 CD1 TYR A 54 3.791 11.815 -1.960 1.00 0.00 C ATOM 833 CD2 TYR A 54 1.766 12.323 -0.796 1.00 0.00 C ATOM 834 CE1 TYR A 54 4.331 13.093 -1.576 1.00 0.00 C ATOM 835 CE2 TYR A 54 2.307 13.600 -0.411 1.00 0.00 C ATOM 836 CZ TYR A 54 3.562 13.922 -0.820 1.00 0.00 C ATOM 837 OH TYR A 54 4.073 15.130 -0.457 1.00 0.00 O ATOM 0 H TYR A 54 3.261 8.400 -3.555 1.00 0.00 H new ATOM 0 HA TYR A 54 3.381 9.088 -0.656 1.00 0.00 H new ATOM 0 HB2 TYR A 54 1.803 10.085 -3.052 1.00 0.00 H new ATOM 0 HB3 TYR A 54 0.960 9.981 -1.519 1.00 0.00 H new ATOM 0 HD1 TYR A 54 4.381 11.137 -2.559 1.00 0.00 H new ATOM 0 HD2 TYR A 54 0.771 12.043 -0.485 1.00 0.00 H new ATOM 0 HE1 TYR A 54 5.324 13.387 -1.881 1.00 0.00 H new ATOM 0 HE2 TYR A 54 1.729 14.287 0.189 1.00 0.00 H new ATOM 0 HH TYR A 54 3.413 15.616 0.080 1.00 0.00 H new ATOM 847 N GLY A 55 1.381 7.621 -0.126 1.00 0.00 N ATOM 848 CA GLY A 55 0.507 6.519 0.241 1.00 0.00 C ATOM 849 C GLY A 55 1.222 5.542 1.176 1.00 0.00 C ATOM 850 O GLY A 55 2.425 5.320 1.048 1.00 0.00 O ATOM 0 H GLY A 55 1.531 8.310 0.611 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -0.388 6.906 0.729 1.00 0.00 H new ATOM 0 HA3 GLY A 55 0.179 5.995 -0.657 1.00 0.00 H new ATOM 854 N ILE A 56 0.450 4.983 2.097 1.00 0.00 N ATOM 855 CA ILE A 56 0.994 4.034 3.054 1.00 0.00 C ATOM 856 C ILE A 56 1.772 2.950 2.305 1.00 0.00 C ATOM 857 O ILE A 56 2.788 2.460 2.796 1.00 0.00 O ATOM 858 CB ILE A 56 -0.115 3.484 3.954 1.00 0.00 C ATOM 859 CG1 ILE A 56 0.446 3.035 5.304 1.00 0.00 C ATOM 860 CG2 ILE A 56 -0.886 2.365 3.251 1.00 0.00 C ATOM 861 CD1 ILE A 56 -0.651 2.420 6.176 1.00 0.00 C ATOM 0 H ILE A 56 -0.548 5.169 2.201 1.00 0.00 H new ATOM 0 HA ILE A 56 1.699 4.529 3.722 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.824 4.287 4.153 1.00 0.00 H new ATOM 0 HG12 ILE A 56 1.242 2.307 5.147 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.890 3.887 5.819 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.668 1.991 3.912 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -1.337 2.752 2.337 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -0.203 1.553 3.002 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -0.226 2.109 7.130 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.434 3.158 6.351 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.076 1.554 5.669 1.00 0.00 H new ATOM 873 N PHE A 57 1.267 2.609 1.130 1.00 0.00 N ATOM 874 CA PHE A 57 1.901 1.593 0.309 1.00 0.00 C ATOM 875 C PHE A 57 2.935 2.215 -0.632 1.00 0.00 C ATOM 876 O PHE A 57 3.310 1.610 -1.636 1.00 0.00 O ATOM 877 CB PHE A 57 0.798 0.938 -0.527 1.00 0.00 C ATOM 878 CG PHE A 57 0.071 -0.203 0.187 1.00 0.00 C ATOM 879 CD1 PHE A 57 0.578 -1.464 0.144 1.00 0.00 C ATOM 880 CD2 PHE A 57 -1.083 0.043 0.863 1.00 0.00 C ATOM 881 CE1 PHE A 57 -0.096 -2.523 0.806 1.00 0.00 C ATOM 882 CE2 PHE A 57 -1.757 -1.016 1.525 1.00 0.00 C ATOM 883 CZ PHE A 57 -1.249 -2.278 1.483 1.00 0.00 C ATOM 0 H PHE A 57 0.425 3.019 0.726 1.00 0.00 H new ATOM 0 HA PHE A 57 2.414 0.870 0.944 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.070 1.699 -0.809 1.00 0.00 H new ATOM 0 HB3 PHE A 57 1.234 0.556 -1.450 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.494 -1.660 -0.394 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -1.487 1.044 0.896 1.00 0.00 H new ATOM 0 HE1 PHE A 57 0.307 -3.524 0.772 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -2.673 -0.820 2.062 1.00 0.00 H new ATOM 0 HZ PHE A 57 -1.762 -3.084 1.987 1.00 0.00 H new ATOM 893 N GLN A 58 3.368 3.414 -0.274 1.00 0.00 N ATOM 894 CA GLN A 58 4.352 4.125 -1.073 1.00 0.00 C ATOM 895 C GLN A 58 4.028 3.983 -2.561 1.00 0.00 C ATOM 896 O GLN A 58 4.750 3.310 -3.296 1.00 0.00 O ATOM 897 CB GLN A 58 5.767 3.628 -0.769 1.00 0.00 C ATOM 898 CG GLN A 58 6.808 4.698 -1.107 1.00 0.00 C ATOM 899 CD GLN A 58 7.176 5.517 0.131 1.00 0.00 C ATOM 900 OE1 GLN A 58 7.899 5.072 1.008 1.00 0.00 O ATOM 901 NE2 GLN A 58 6.640 6.733 0.154 1.00 0.00 N ATOM 0 H GLN A 58 3.055 3.912 0.559 1.00 0.00 H new ATOM 0 HA GLN A 58 4.310 5.182 -0.811 1.00 0.00 H new ATOM 0 HB2 GLN A 58 5.844 3.361 0.285 1.00 0.00 H new ATOM 0 HB3 GLN A 58 5.970 2.724 -1.343 1.00 0.00 H new ATOM 0 HG2 GLN A 58 7.702 4.225 -1.513 1.00 0.00 H new ATOM 0 HG3 GLN A 58 6.417 5.358 -1.881 1.00 0.00 H new ATOM 0 HE21 GLN A 58 6.044 7.042 -0.614 1.00 0.00 H new ATOM 0 HE22 GLN A 58 6.825 7.357 0.939 1.00 0.00 H new ATOM 910 N ILE A 59 2.943 4.629 -2.963 1.00 0.00 N ATOM 911 CA ILE A 59 2.516 4.583 -4.351 1.00 0.00 C ATOM 912 C ILE A 59 3.062 5.807 -5.088 1.00 0.00 C ATOM 913 O ILE A 59 3.094 6.906 -4.536 1.00 0.00 O ATOM 914 CB ILE A 59 0.995 4.439 -4.438 1.00 0.00 C ATOM 915 CG1 ILE A 59 0.562 3.003 -4.143 1.00 0.00 C ATOM 916 CG2 ILE A 59 0.476 4.929 -5.792 1.00 0.00 C ATOM 917 CD1 ILE A 59 -0.939 2.929 -3.858 1.00 0.00 C ATOM 0 H ILE A 59 2.347 5.187 -2.352 1.00 0.00 H new ATOM 0 HA ILE A 59 2.925 3.703 -4.848 1.00 0.00 H new ATOM 0 HB ILE A 59 0.547 5.072 -3.672 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.806 2.364 -4.992 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.117 2.621 -3.286 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -0.608 4.816 -5.829 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.736 5.979 -5.923 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.929 4.341 -6.590 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -1.220 1.896 -3.651 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -1.176 3.549 -2.994 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.492 3.289 -4.726 1.00 0.00 H new ATOM 929 N ASN A 60 3.477 5.578 -6.325 1.00 0.00 N ATOM 930 CA ASN A 60 4.021 6.648 -7.143 1.00 0.00 C ATOM 931 C ASN A 60 2.873 7.385 -7.837 1.00 0.00 C ATOM 932 O ASN A 60 1.993 6.758 -8.424 1.00 0.00 O ATOM 933 CB ASN A 60 4.950 6.097 -8.225 1.00 0.00 C ATOM 934 CG ASN A 60 4.342 4.862 -8.895 1.00 0.00 C ATOM 935 OD1 ASN A 60 3.478 4.952 -9.753 1.00 0.00 O ATOM 936 ND2 ASN A 60 4.839 3.709 -8.457 1.00 0.00 N ATOM 0 H ASN A 60 3.447 4.666 -6.781 1.00 0.00 H new ATOM 0 HA ASN A 60 4.583 7.318 -6.492 1.00 0.00 H new ATOM 0 HB2 ASN A 60 5.137 6.866 -8.974 1.00 0.00 H new ATOM 0 HB3 ASN A 60 5.913 5.839 -7.785 1.00 0.00 H new ATOM 0 HD21 ASN A 60 4.498 2.828 -8.842 1.00 0.00 H new ATOM 0 HD22 ASN A 60 5.561 3.706 -7.736 1.00 0.00 H new ATOM 943 N SER A 61 2.920 8.706 -7.747 1.00 0.00 N ATOM 944 CA SER A 61 1.896 9.536 -8.359 1.00 0.00 C ATOM 945 C SER A 61 2.301 9.897 -9.789 1.00 0.00 C ATOM 946 O SER A 61 1.687 10.761 -10.413 1.00 0.00 O ATOM 947 CB SER A 61 1.653 10.805 -7.539 1.00 0.00 C ATOM 948 OG SER A 61 1.462 10.519 -6.156 1.00 0.00 O ATOM 0 H SER A 61 3.652 9.223 -7.259 1.00 0.00 H new ATOM 0 HA SER A 61 0.966 8.969 -8.384 1.00 0.00 H new ATOM 0 HB2 SER A 61 2.501 11.480 -7.656 1.00 0.00 H new ATOM 0 HB3 SER A 61 0.776 11.324 -7.926 1.00 0.00 H new ATOM 0 HG SER A 61 0.663 9.962 -6.044 1.00 0.00 H new ATOM 954 N ARG A 62 3.333 9.218 -10.268 1.00 0.00 N ATOM 955 CA ARG A 62 3.826 9.456 -11.613 1.00 0.00 C ATOM 956 C ARG A 62 3.098 8.556 -12.614 1.00 0.00 C ATOM 957 O ARG A 62 3.084 8.837 -13.811 1.00 0.00 O ATOM 958 CB ARG A 62 5.331 9.193 -11.702 1.00 0.00 C ATOM 959 CG ARG A 62 5.632 7.696 -11.605 1.00 0.00 C ATOM 960 CD ARG A 62 6.369 7.202 -12.852 1.00 0.00 C ATOM 961 NE ARG A 62 7.340 6.148 -12.481 1.00 0.00 N ATOM 962 CZ ARG A 62 8.328 5.722 -13.281 1.00 0.00 C ATOM 963 NH1 ARG A 62 8.482 6.259 -14.499 1.00 0.00 N ATOM 964 NH2 ARG A 62 9.162 4.761 -12.862 1.00 0.00 N ATOM 0 H ARG A 62 3.841 8.503 -9.748 1.00 0.00 H new ATOM 0 HA ARG A 62 3.636 10.502 -11.855 1.00 0.00 H new ATOM 0 HB2 ARG A 62 5.717 9.585 -12.643 1.00 0.00 H new ATOM 0 HB3 ARG A 62 5.845 9.724 -10.900 1.00 0.00 H new ATOM 0 HG2 ARG A 62 6.237 7.500 -10.719 1.00 0.00 H new ATOM 0 HG3 ARG A 62 4.701 7.141 -11.485 1.00 0.00 H new ATOM 0 HD2 ARG A 62 5.654 6.811 -13.576 1.00 0.00 H new ATOM 0 HD3 ARG A 62 6.887 8.033 -13.332 1.00 0.00 H new ATOM 0 HE ARG A 62 7.252 5.719 -11.560 1.00 0.00 H new ATOM 0 HH11 ARG A 62 7.848 6.992 -14.817 1.00 0.00 H new ATOM 0 HH12 ARG A 62 9.234 5.935 -15.108 1.00 0.00 H new ATOM 0 HH21 ARG A 62 9.045 4.353 -11.934 1.00 0.00 H new ATOM 0 HH22 ARG A 62 9.914 4.437 -13.471 1.00 0.00 H new ATOM 978 N TYR A 63 2.510 7.494 -12.085 1.00 0.00 N ATOM 979 CA TYR A 63 1.781 6.550 -12.917 1.00 0.00 C ATOM 980 C TYR A 63 0.359 6.345 -12.394 1.00 0.00 C ATOM 981 O TYR A 63 -0.609 6.522 -13.132 1.00 0.00 O ATOM 982 CB TYR A 63 2.543 5.227 -12.822 1.00 0.00 C ATOM 983 CG TYR A 63 3.172 4.774 -14.141 1.00 0.00 C ATOM 984 CD1 TYR A 63 2.369 4.521 -15.235 1.00 0.00 C ATOM 985 CD2 TYR A 63 4.539 4.618 -14.237 1.00 0.00 C ATOM 986 CE1 TYR A 63 2.961 4.094 -16.478 1.00 0.00 C ATOM 987 CE2 TYR A 63 5.129 4.192 -15.479 1.00 0.00 C ATOM 988 CZ TYR A 63 4.312 3.951 -16.538 1.00 0.00 C ATOM 989 OH TYR A 63 4.869 3.549 -17.711 1.00 0.00 O ATOM 0 H TYR A 63 2.523 7.265 -11.091 1.00 0.00 H new ATOM 0 HA TYR A 63 1.708 6.917 -13.941 1.00 0.00 H new ATOM 0 HB2 TYR A 63 3.328 5.325 -12.072 1.00 0.00 H new ATOM 0 HB3 TYR A 63 1.862 4.452 -12.471 1.00 0.00 H new ATOM 0 HD1 TYR A 63 1.299 4.643 -15.160 1.00 0.00 H new ATOM 0 HD2 TYR A 63 5.167 4.815 -13.381 1.00 0.00 H new ATOM 0 HE1 TYR A 63 2.345 3.892 -17.342 1.00 0.00 H new ATOM 0 HE2 TYR A 63 6.198 4.067 -15.567 1.00 0.00 H new ATOM 0 HH TYR A 63 5.842 3.491 -17.608 1.00 0.00 H new ATOM 999 N TRP A 64 0.276 5.973 -11.125 1.00 0.00 N ATOM 1000 CA TRP A 64 -1.013 5.741 -10.495 1.00 0.00 C ATOM 1001 C TRP A 64 -1.398 7.007 -9.727 1.00 0.00 C ATOM 1002 O TRP A 64 -0.542 7.835 -9.418 1.00 0.00 O ATOM 1003 CB TRP A 64 -0.973 4.493 -9.610 1.00 0.00 C ATOM 1004 CG TRP A 64 -0.030 3.400 -10.117 1.00 0.00 C ATOM 1005 CD1 TRP A 64 0.735 2.571 -9.395 1.00 0.00 C ATOM 1006 CD2 TRP A 64 0.218 3.049 -11.495 1.00 0.00 C ATOM 1007 NE1 TRP A 64 1.455 1.715 -10.203 1.00 0.00 N ATOM 1008 CE2 TRP A 64 1.131 2.015 -11.520 1.00 0.00 C ATOM 1009 CE3 TRP A 64 -0.312 3.588 -12.680 1.00 0.00 C ATOM 1010 CZ2 TRP A 64 1.595 1.430 -12.705 1.00 0.00 C ATOM 1011 CZ3 TRP A 64 0.161 2.993 -13.856 1.00 0.00 C ATOM 1012 CH2 TRP A 64 1.080 1.950 -13.898 1.00 0.00 C ATOM 0 H TRP A 64 1.081 5.826 -10.516 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.779 5.542 -11.244 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -0.669 4.783 -8.604 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -1.980 4.083 -9.533 1.00 0.00 H new ATOM 0 HD1 TRP A 64 0.782 2.572 -8.316 1.00 0.00 H new ATOM 0 HE1 TRP A 64 2.106 0.994 -9.891 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -1.027 4.397 -12.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 2.311 0.622 -12.699 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.214 3.370 -14.796 1.00 0.00 H new ATOM 0 HH2 TRP A 64 1.395 1.543 -14.847 1.00 0.00 H new ATOM 1023 N CYS A 65 -2.687 7.117 -9.440 1.00 0.00 N ATOM 1024 CA CYS A 65 -3.196 8.267 -8.714 1.00 0.00 C ATOM 1025 C CYS A 65 -2.844 9.529 -9.506 1.00 0.00 C ATOM 1026 O CYS A 65 -1.952 9.507 -10.351 1.00 0.00 O ATOM 1027 CB CYS A 65 -2.653 8.321 -7.285 1.00 0.00 C ATOM 1028 SG CYS A 65 -1.215 9.428 -7.050 1.00 0.00 S ATOM 0 H CYS A 65 -3.394 6.428 -9.697 1.00 0.00 H new ATOM 0 HA CYS A 65 -4.279 8.189 -8.618 1.00 0.00 H new ATOM 0 HB2 CYS A 65 -3.454 8.643 -6.619 1.00 0.00 H new ATOM 0 HB3 CYS A 65 -2.371 7.313 -6.980 1.00 0.00 H new ATOM 1033 N ASN A 66 -3.564 10.600 -9.202 1.00 0.00 N ATOM 1034 CA ASN A 66 -3.339 11.867 -9.875 1.00 0.00 C ATOM 1035 C ASN A 66 -3.453 13.006 -8.858 1.00 0.00 C ATOM 1036 O ASN A 66 -3.410 12.771 -7.651 1.00 0.00 O ATOM 1037 CB ASN A 66 -4.383 12.104 -10.968 1.00 0.00 C ATOM 1038 CG ASN A 66 -3.779 12.873 -12.145 1.00 0.00 C ATOM 1039 OD1 ASN A 66 -4.289 13.891 -12.583 1.00 0.00 O ATOM 1040 ND2 ASN A 66 -2.667 12.329 -12.632 1.00 0.00 N ATOM 0 H ASN A 66 -4.303 10.615 -8.499 1.00 0.00 H new ATOM 0 HA ASN A 66 -2.347 11.838 -10.325 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -4.774 11.148 -11.316 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.224 12.662 -10.557 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -2.188 12.766 -13.419 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -2.293 11.475 -12.218 1.00 0.00 H new ATOM 1047 N ASP A 67 -3.595 14.214 -9.383 1.00 0.00 N ATOM 1048 CA ASP A 67 -3.715 15.389 -8.537 1.00 0.00 C ATOM 1049 C ASP A 67 -4.807 16.304 -9.093 1.00 0.00 C ATOM 1050 O ASP A 67 -5.707 16.716 -8.363 1.00 0.00 O ATOM 1051 CB ASP A 67 -2.405 16.181 -8.506 1.00 0.00 C ATOM 1052 CG ASP A 67 -2.548 17.649 -8.102 1.00 0.00 C ATOM 1053 OD1 ASP A 67 -3.557 17.958 -7.432 1.00 0.00 O ATOM 1054 OD2 ASP A 67 -1.645 18.430 -8.471 1.00 0.00 O ATOM 0 H ASP A 67 -3.630 14.404 -10.384 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.959 15.055 -7.529 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -1.719 15.694 -7.813 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.946 16.134 -9.494 1.00 0.00 H new ATOM 1059 N GLY A 68 -4.693 16.594 -10.381 1.00 0.00 N ATOM 1060 CA GLY A 68 -5.660 17.452 -11.043 1.00 0.00 C ATOM 1061 C GLY A 68 -5.030 18.791 -11.432 1.00 0.00 C ATOM 1062 O GLY A 68 -5.677 19.627 -12.062 1.00 0.00 O ATOM 0 H GLY A 68 -3.945 16.250 -10.983 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -6.043 16.954 -11.934 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -6.510 17.624 -10.383 1.00 0.00 H new ATOM 1066 N LYS A 69 -3.775 18.954 -11.039 1.00 0.00 N ATOM 1067 CA LYS A 69 -3.051 20.178 -11.338 1.00 0.00 C ATOM 1068 C LYS A 69 -1.907 19.865 -12.304 1.00 0.00 C ATOM 1069 O LYS A 69 -1.315 20.773 -12.887 1.00 0.00 O ATOM 1070 CB LYS A 69 -2.594 20.860 -10.045 1.00 0.00 C ATOM 1071 CG LYS A 69 -2.576 22.381 -10.205 1.00 0.00 C ATOM 1072 CD LYS A 69 -2.364 23.072 -8.857 1.00 0.00 C ATOM 1073 CE LYS A 69 -1.884 24.511 -9.048 1.00 0.00 C ATOM 1074 NZ LYS A 69 -2.542 25.410 -8.073 1.00 0.00 N ATOM 0 H LYS A 69 -3.241 18.259 -10.516 1.00 0.00 H new ATOM 0 HA LYS A 69 -3.704 20.895 -11.836 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.262 20.584 -9.229 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -1.598 20.507 -9.776 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.782 22.668 -10.894 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.516 22.715 -10.645 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.296 23.068 -8.292 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.633 22.516 -8.270 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -0.802 24.559 -8.924 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.104 24.842 -10.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -2.205 26.383 -8.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.572 25.376 -8.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -2.311 25.102 -7.107 1.00 0.00 H new ATOM 1088 N THR A 70 -1.631 18.577 -12.447 1.00 0.00 N ATOM 1089 CA THR A 70 -0.568 18.133 -13.333 1.00 0.00 C ATOM 1090 C THR A 70 -1.126 17.194 -14.405 1.00 0.00 C ATOM 1091 O THR A 70 -1.118 15.976 -14.234 1.00 0.00 O ATOM 1092 CB THR A 70 0.527 17.494 -12.476 1.00 0.00 C ATOM 1093 OG1 THR A 70 1.185 18.603 -11.871 1.00 0.00 O ATOM 1094 CG2 THR A 70 1.616 16.828 -13.319 1.00 0.00 C ATOM 0 H THR A 70 -2.125 17.827 -11.964 1.00 0.00 H new ATOM 0 HA THR A 70 -0.129 18.971 -13.875 1.00 0.00 H new ATOM 0 HB THR A 70 0.082 16.755 -11.809 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.909 18.279 -11.296 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.368 16.390 -12.662 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.172 16.045 -13.934 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.085 17.573 -13.962 1.00 0.00 H new ATOM 1102 N PRO A 71 -1.609 17.813 -15.516 1.00 0.00 N ATOM 1103 CA PRO A 71 -2.169 17.046 -16.615 1.00 0.00 C ATOM 1104 C PRO A 71 -1.066 16.370 -17.431 1.00 0.00 C ATOM 1105 O PRO A 71 -0.982 16.555 -18.643 1.00 0.00 O ATOM 1106 CB PRO A 71 -2.975 18.050 -17.424 1.00 0.00 C ATOM 1107 CG PRO A 71 -2.462 19.421 -17.018 1.00 0.00 C ATOM 1108 CD PRO A 71 -1.635 19.253 -15.753 1.00 0.00 C ATOM 0 HA PRO A 71 -2.802 16.226 -16.276 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -2.844 17.885 -18.493 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -4.041 17.954 -17.215 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -1.857 19.854 -17.815 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -3.294 20.103 -16.843 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -0.629 19.651 -15.882 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -2.083 19.785 -14.913 1.00 0.00 H new ATOM 1116 N ARG A 72 -0.247 15.598 -16.731 1.00 0.00 N ATOM 1117 CA ARG A 72 0.848 14.892 -17.375 1.00 0.00 C ATOM 1118 C ARG A 72 0.874 13.430 -16.926 1.00 0.00 C ATOM 1119 O ARG A 72 0.934 12.524 -17.754 1.00 0.00 O ATOM 1120 CB ARG A 72 2.193 15.544 -17.045 1.00 0.00 C ATOM 1121 CG ARG A 72 2.853 16.106 -18.306 1.00 0.00 C ATOM 1122 CD ARG A 72 3.586 17.415 -18.004 1.00 0.00 C ATOM 1123 NE ARG A 72 5.009 17.300 -18.394 1.00 0.00 N ATOM 1124 CZ ARG A 72 5.950 18.199 -18.076 1.00 0.00 C ATOM 1125 NH1 ARG A 72 5.626 19.284 -17.360 1.00 0.00 N ATOM 1126 NH2 ARG A 72 7.216 18.013 -18.474 1.00 0.00 N ATOM 0 H ARG A 72 -0.320 15.446 -15.725 1.00 0.00 H new ATOM 0 HA ARG A 72 0.687 14.942 -18.452 1.00 0.00 H new ATOM 0 HB2 ARG A 72 2.045 16.344 -16.320 1.00 0.00 H new ATOM 0 HB3 ARG A 72 2.853 14.811 -16.581 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.555 15.376 -18.709 1.00 0.00 H new ATOM 0 HG3 ARG A 72 2.096 16.277 -19.072 1.00 0.00 H new ATOM 0 HD2 ARG A 72 3.117 18.237 -18.545 1.00 0.00 H new ATOM 0 HD3 ARG A 72 3.509 17.648 -16.942 1.00 0.00 H new ATOM 0 HE ARG A 72 5.291 16.485 -18.939 1.00 0.00 H new ATOM 0 HH11 ARG A 72 4.663 19.426 -17.057 1.00 0.00 H new ATOM 0 HH12 ARG A 72 6.343 19.968 -17.118 1.00 0.00 H new ATOM 0 HH21 ARG A 72 7.463 17.187 -19.019 1.00 0.00 H new ATOM 0 HH22 ARG A 72 7.932 18.697 -18.232 1.00 0.00 H new ATOM 1140 N ALA A 73 0.828 13.246 -15.614 1.00 0.00 N ATOM 1141 CA ALA A 73 0.846 11.910 -15.045 1.00 0.00 C ATOM 1142 C ALA A 73 -0.116 11.014 -15.828 1.00 0.00 C ATOM 1143 O ALA A 73 -0.923 11.503 -16.618 1.00 0.00 O ATOM 1144 CB ALA A 73 0.493 11.983 -13.558 1.00 0.00 C ATOM 0 H ALA A 73 0.778 14.001 -14.929 1.00 0.00 H new ATOM 0 HA ALA A 73 1.842 11.474 -15.123 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.507 10.980 -13.131 1.00 0.00 H new ATOM 0 HB2 ALA A 73 1.222 12.607 -13.041 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -0.501 12.414 -13.441 1.00 0.00 H new ATOM 1150 N VAL A 74 0.001 9.717 -15.583 1.00 0.00 N ATOM 1151 CA VAL A 74 -0.848 8.748 -16.255 1.00 0.00 C ATOM 1152 C VAL A 74 -1.656 7.974 -15.212 1.00 0.00 C ATOM 1153 O VAL A 74 -1.733 6.747 -15.267 1.00 0.00 O ATOM 1154 CB VAL A 74 0.000 7.841 -17.149 1.00 0.00 C ATOM 1155 CG1 VAL A 74 0.968 6.999 -16.315 1.00 0.00 C ATOM 1156 CG2 VAL A 74 -0.885 6.953 -18.026 1.00 0.00 C ATOM 0 H VAL A 74 0.671 9.315 -14.928 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.560 9.252 -16.908 1.00 0.00 H new ATOM 0 HB VAL A 74 0.592 8.477 -17.807 1.00 0.00 H new ATOM 0 HG11 VAL A 74 1.559 6.363 -16.975 1.00 0.00 H new ATOM 0 HG12 VAL A 74 1.632 7.657 -15.754 1.00 0.00 H new ATOM 0 HG13 VAL A 74 0.404 6.376 -15.621 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -0.257 6.318 -18.652 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.515 6.329 -17.393 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.514 7.579 -18.659 1.00 0.00 H new ATOM 1166 N ASN A 75 -2.238 8.721 -14.285 1.00 0.00 N ATOM 1167 CA ASN A 75 -3.036 8.119 -13.231 1.00 0.00 C ATOM 1168 C ASN A 75 -3.892 6.998 -13.823 1.00 0.00 C ATOM 1169 O ASN A 75 -4.971 7.251 -14.356 1.00 0.00 O ATOM 1170 CB ASN A 75 -3.976 9.147 -12.599 1.00 0.00 C ATOM 1171 CG ASN A 75 -4.809 9.859 -13.666 1.00 0.00 C ATOM 1172 OD1 ASN A 75 -4.373 10.083 -14.783 1.00 0.00 O ATOM 1173 ND2 ASN A 75 -6.029 10.202 -13.261 1.00 0.00 N ATOM 0 H ASN A 75 -2.173 9.738 -14.242 1.00 0.00 H new ATOM 0 HA ASN A 75 -2.357 7.734 -12.470 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.637 8.651 -11.888 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.395 9.879 -12.038 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -6.662 10.683 -13.900 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -6.331 9.984 -12.311 1.00 0.00 H new ATOM 1180 N ALA A 76 -3.377 5.782 -13.709 1.00 0.00 N ATOM 1181 CA ALA A 76 -4.081 4.621 -14.226 1.00 0.00 C ATOM 1182 C ALA A 76 -5.087 4.132 -13.182 1.00 0.00 C ATOM 1183 O ALA A 76 -5.902 3.255 -13.463 1.00 0.00 O ATOM 1184 CB ALA A 76 -3.069 3.540 -14.610 1.00 0.00 C ATOM 0 H ALA A 76 -2.481 5.576 -13.267 1.00 0.00 H new ATOM 0 HA ALA A 76 -4.639 4.881 -15.125 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -3.597 2.669 -14.998 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -2.396 3.927 -15.375 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -2.492 3.253 -13.731 1.00 0.00 H new ATOM 1190 N CYS A 77 -4.998 4.723 -11.999 1.00 0.00 N ATOM 1191 CA CYS A 77 -5.891 4.360 -10.912 1.00 0.00 C ATOM 1192 C CYS A 77 -7.131 5.251 -10.991 1.00 0.00 C ATOM 1193 O CYS A 77 -8.224 4.835 -10.609 1.00 0.00 O ATOM 1194 CB CYS A 77 -5.197 4.466 -9.552 1.00 0.00 C ATOM 1195 SG CYS A 77 -5.827 3.312 -8.278 1.00 0.00 S ATOM 0 H CYS A 77 -4.321 5.451 -11.770 1.00 0.00 H new ATOM 0 HA CYS A 77 -6.188 3.316 -11.015 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -4.131 4.287 -9.689 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -5.304 5.486 -9.183 1.00 0.00 H new ATOM 1200 N GLY A 78 -6.922 6.461 -11.489 1.00 0.00 N ATOM 1201 CA GLY A 78 -8.010 7.414 -11.623 1.00 0.00 C ATOM 1202 C GLY A 78 -8.564 7.810 -10.253 1.00 0.00 C ATOM 1203 O GLY A 78 -9.770 7.750 -10.026 1.00 0.00 O ATOM 0 H GLY A 78 -6.014 6.803 -11.805 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -7.658 8.302 -12.147 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -8.805 6.980 -12.229 1.00 0.00 H new ATOM 1207 N ILE A 79 -7.654 8.207 -9.375 1.00 0.00 N ATOM 1208 CA ILE A 79 -8.036 8.613 -8.033 1.00 0.00 C ATOM 1209 C ILE A 79 -7.041 9.655 -7.518 1.00 0.00 C ATOM 1210 O ILE A 79 -5.831 9.482 -7.653 1.00 0.00 O ATOM 1211 CB ILE A 79 -8.175 7.391 -7.122 1.00 0.00 C ATOM 1212 CG1 ILE A 79 -6.907 7.179 -6.293 1.00 0.00 C ATOM 1213 CG2 ILE A 79 -8.546 6.145 -7.929 1.00 0.00 C ATOM 1214 CD1 ILE A 79 -5.734 6.759 -7.181 1.00 0.00 C ATOM 0 H ILE A 79 -6.653 8.256 -9.567 1.00 0.00 H new ATOM 0 HA ILE A 79 -9.018 9.087 -8.043 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.990 7.577 -6.423 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -6.656 8.099 -5.764 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -7.087 6.415 -5.536 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -8.639 5.291 -7.258 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -9.495 6.311 -8.438 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -7.769 5.944 -8.666 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -4.846 6.615 -6.566 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -5.978 5.826 -7.690 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -5.541 7.536 -7.921 1.00 0.00 H new ATOM 1226 N ASN A 80 -7.589 10.712 -6.937 1.00 0.00 N ATOM 1227 CA ASN A 80 -6.764 11.782 -6.399 1.00 0.00 C ATOM 1228 C ASN A 80 -5.905 11.233 -5.258 1.00 0.00 C ATOM 1229 O ASN A 80 -6.431 10.746 -4.259 1.00 0.00 O ATOM 1230 CB ASN A 80 -7.628 12.914 -5.840 1.00 0.00 C ATOM 1231 CG ASN A 80 -7.419 14.206 -6.634 1.00 0.00 C ATOM 1232 OD1 ASN A 80 -8.130 14.506 -7.578 1.00 0.00 O ATOM 1233 ND2 ASN A 80 -6.406 14.950 -6.200 1.00 0.00 N ATOM 0 H ASN A 80 -8.593 10.851 -6.827 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.142 12.168 -7.207 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.679 12.626 -5.876 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -7.380 13.083 -4.792 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -6.185 15.831 -6.664 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -5.850 14.640 -5.403 1.00 0.00 H new ATOM 1240 N CYS A 81 -4.597 11.332 -5.445 1.00 0.00 N ATOM 1241 CA CYS A 81 -3.660 10.852 -4.443 1.00 0.00 C ATOM 1242 C CYS A 81 -4.127 11.348 -3.073 1.00 0.00 C ATOM 1243 O CYS A 81 -3.838 10.726 -2.052 1.00 0.00 O ATOM 1244 CB CYS A 81 -2.228 11.292 -4.753 1.00 0.00 C ATOM 1245 SG CYS A 81 -1.071 9.925 -5.131 1.00 0.00 S ATOM 0 H CYS A 81 -4.164 11.737 -6.275 1.00 0.00 H new ATOM 0 HA CYS A 81 -3.644 9.762 -4.447 1.00 0.00 H new ATOM 0 HB2 CYS A 81 -2.249 11.977 -5.601 1.00 0.00 H new ATOM 0 HB3 CYS A 81 -1.842 11.851 -3.901 1.00 0.00 H new ATOM 1250 N SER A 82 -4.838 12.465 -3.094 1.00 0.00 N ATOM 1251 CA SER A 82 -5.347 13.053 -1.866 1.00 0.00 C ATOM 1252 C SER A 82 -6.172 12.020 -1.095 1.00 0.00 C ATOM 1253 O SER A 82 -6.147 11.994 0.134 1.00 0.00 O ATOM 1254 CB SER A 82 -6.190 14.296 -2.158 1.00 0.00 C ATOM 1255 OG SER A 82 -5.391 15.471 -2.258 1.00 0.00 O ATOM 0 H SER A 82 -5.074 12.979 -3.943 1.00 0.00 H new ATOM 0 HA SER A 82 -4.498 13.360 -1.255 1.00 0.00 H new ATOM 0 HB2 SER A 82 -6.740 14.151 -3.088 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.929 14.426 -1.368 1.00 0.00 H new ATOM 0 HG SER A 82 -5.966 16.242 -2.447 1.00 0.00 H new ATOM 1261 N ALA A 83 -6.883 11.195 -1.849 1.00 0.00 N ATOM 1262 CA ALA A 83 -7.713 10.164 -1.252 1.00 0.00 C ATOM 1263 C ALA A 83 -6.830 9.198 -0.461 1.00 0.00 C ATOM 1264 O ALA A 83 -7.320 8.465 0.397 1.00 0.00 O ATOM 1265 CB ALA A 83 -8.516 9.456 -2.347 1.00 0.00 C ATOM 0 H ALA A 83 -6.901 11.220 -2.869 1.00 0.00 H new ATOM 0 HA ALA A 83 -8.427 10.603 -0.556 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -9.139 8.682 -1.899 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -9.149 10.180 -2.859 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.832 9.001 -3.063 1.00 0.00 H new ATOM 1271 N LEU A 84 -5.544 9.228 -0.777 1.00 0.00 N ATOM 1272 CA LEU A 84 -4.588 8.365 -0.106 1.00 0.00 C ATOM 1273 C LEU A 84 -3.738 9.200 0.854 1.00 0.00 C ATOM 1274 O LEU A 84 -2.662 8.772 1.269 1.00 0.00 O ATOM 1275 CB LEU A 84 -3.765 7.579 -1.129 1.00 0.00 C ATOM 1276 CG LEU A 84 -4.554 6.935 -2.271 1.00 0.00 C ATOM 1277 CD1 LEU A 84 -4.117 7.499 -3.625 1.00 0.00 C ATOM 1278 CD2 LEU A 84 -4.444 5.410 -2.224 1.00 0.00 C ATOM 0 H LEU A 84 -5.142 9.837 -1.489 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.107 7.618 0.494 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.022 8.249 -1.560 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.220 6.795 -0.603 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.607 7.185 -2.141 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -4.693 7.025 -4.420 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -4.290 8.575 -3.644 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -3.056 7.299 -3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -5.014 4.979 -3.047 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -3.398 5.118 -2.315 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -4.842 5.046 -1.277 1.00 0.00 H new ATOM 1290 N LEU A 85 -4.253 10.377 1.178 1.00 0.00 N ATOM 1291 CA LEU A 85 -3.555 11.277 2.081 1.00 0.00 C ATOM 1292 C LEU A 85 -4.000 10.996 3.517 1.00 0.00 C ATOM 1293 O LEU A 85 -3.260 10.394 4.294 1.00 0.00 O ATOM 1294 CB LEU A 85 -3.753 12.731 1.649 1.00 0.00 C ATOM 1295 CG LEU A 85 -2.653 13.710 2.061 1.00 0.00 C ATOM 1296 CD1 LEU A 85 -2.365 13.612 3.560 1.00 0.00 C ATOM 1297 CD2 LEU A 85 -1.392 13.501 1.220 1.00 0.00 C ATOM 0 H LEU A 85 -5.146 10.728 0.831 1.00 0.00 H new ATOM 0 HA LEU A 85 -2.480 11.101 2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -3.846 12.757 0.563 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.699 13.085 2.059 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.006 14.723 1.867 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -1.579 14.319 3.826 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.270 13.847 4.120 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -2.041 12.600 3.803 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -0.625 14.209 1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.026 12.484 1.360 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.626 13.661 0.167 1.00 0.00 H new ATOM 1309 N GLN A 86 -5.207 11.446 3.827 1.00 0.00 N ATOM 1310 CA GLN A 86 -5.760 11.251 5.158 1.00 0.00 C ATOM 1311 C GLN A 86 -7.267 10.999 5.075 1.00 0.00 C ATOM 1312 O GLN A 86 -8.013 11.373 5.978 1.00 0.00 O ATOM 1313 CB GLN A 86 -5.453 12.448 6.059 1.00 0.00 C ATOM 1314 CG GLN A 86 -6.126 13.717 5.534 1.00 0.00 C ATOM 1315 CD GLN A 86 -6.357 14.723 6.664 1.00 0.00 C ATOM 1316 OE1 GLN A 86 -7.059 14.462 7.628 1.00 0.00 O ATOM 1317 NE2 GLN A 86 -5.730 15.883 6.492 1.00 0.00 N ATOM 0 H GLN A 86 -5.818 11.945 3.180 1.00 0.00 H new ATOM 0 HA GLN A 86 -5.289 10.374 5.601 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -5.797 12.242 7.073 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -4.375 12.600 6.113 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -5.505 14.169 4.761 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -7.078 13.462 5.069 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -5.158 16.035 5.661 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -5.821 16.621 7.191 1.00 0.00 H new ATOM 1326 N ASP A 87 -7.669 10.366 3.983 1.00 0.00 N ATOM 1327 CA ASP A 87 -9.074 10.060 3.770 1.00 0.00 C ATOM 1328 C ASP A 87 -9.388 8.686 4.366 1.00 0.00 C ATOM 1329 O ASP A 87 -10.120 8.584 5.349 1.00 0.00 O ATOM 1330 CB ASP A 87 -9.408 10.015 2.278 1.00 0.00 C ATOM 1331 CG ASP A 87 -10.775 10.593 1.904 1.00 0.00 C ATOM 1332 OD1 ASP A 87 -10.833 11.824 1.695 1.00 0.00 O ATOM 1333 OD2 ASP A 87 -11.730 9.790 1.836 1.00 0.00 O ATOM 0 H ASP A 87 -7.047 10.057 3.236 1.00 0.00 H new ATOM 0 HA ASP A 87 -9.665 10.841 4.249 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.638 10.560 1.732 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -9.364 8.979 1.942 1.00 0.00 H new ATOM 1338 N ASP A 88 -8.817 7.664 3.745 1.00 0.00 N ATOM 1339 CA ASP A 88 -9.028 6.300 4.202 1.00 0.00 C ATOM 1340 C ASP A 88 -8.031 5.374 3.501 1.00 0.00 C ATOM 1341 O ASP A 88 -7.219 5.825 2.696 1.00 0.00 O ATOM 1342 CB ASP A 88 -10.439 5.817 3.864 1.00 0.00 C ATOM 1343 CG ASP A 88 -11.476 6.025 4.970 1.00 0.00 C ATOM 1344 OD1 ASP A 88 -11.359 5.320 5.996 1.00 0.00 O ATOM 1345 OD2 ASP A 88 -12.361 6.882 4.764 1.00 0.00 O ATOM 0 H ASP A 88 -8.209 7.753 2.931 1.00 0.00 H new ATOM 0 HA ASP A 88 -8.891 6.281 5.283 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -10.778 6.334 2.966 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -10.395 4.755 3.623 1.00 0.00 H new ATOM 1350 N ILE A 89 -8.127 4.094 3.835 1.00 0.00 N ATOM 1351 CA ILE A 89 -7.243 3.101 3.249 1.00 0.00 C ATOM 1352 C ILE A 89 -7.968 2.392 2.103 1.00 0.00 C ATOM 1353 O ILE A 89 -7.336 1.758 1.260 1.00 0.00 O ATOM 1354 CB ILE A 89 -6.718 2.149 4.325 1.00 0.00 C ATOM 1355 CG1 ILE A 89 -7.698 0.999 4.567 1.00 0.00 C ATOM 1356 CG2 ILE A 89 -6.393 2.906 5.615 1.00 0.00 C ATOM 1357 CD1 ILE A 89 -7.054 -0.102 5.411 1.00 0.00 C ATOM 0 H ILE A 89 -8.803 3.723 4.503 1.00 0.00 H new ATOM 0 HA ILE A 89 -6.362 3.581 2.822 1.00 0.00 H new ATOM 0 HB ILE A 89 -5.788 1.708 3.966 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -8.588 1.375 5.071 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -8.023 0.587 3.612 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -6.022 2.206 6.364 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.631 3.659 5.413 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -7.294 3.392 5.988 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -7.772 -0.907 5.568 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -6.178 -0.493 4.893 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -6.752 0.308 6.375 1.00 0.00 H new ATOM 1369 N THR A 90 -9.288 2.524 2.109 1.00 0.00 N ATOM 1370 CA THR A 90 -10.105 1.905 1.081 1.00 0.00 C ATOM 1371 C THR A 90 -9.497 2.144 -0.302 1.00 0.00 C ATOM 1372 O THR A 90 -9.408 1.223 -1.113 1.00 0.00 O ATOM 1373 CB THR A 90 -11.530 2.446 1.220 1.00 0.00 C ATOM 1374 OG1 THR A 90 -12.278 1.336 1.708 1.00 0.00 O ATOM 1375 CG2 THR A 90 -12.171 2.762 -0.134 1.00 0.00 C ATOM 0 H THR A 90 -9.810 3.050 2.810 1.00 0.00 H new ATOM 0 HA THR A 90 -10.139 0.822 1.203 1.00 0.00 H new ATOM 0 HB THR A 90 -11.518 3.346 1.835 1.00 0.00 H new ATOM 0 HG1 THR A 90 -13.214 1.600 1.828 1.00 0.00 H new ATOM 0 HG21 THR A 90 -13.181 3.142 0.021 1.00 0.00 H new ATOM 0 HG22 THR A 90 -11.576 3.514 -0.652 1.00 0.00 H new ATOM 0 HG23 THR A 90 -12.214 1.855 -0.737 1.00 0.00 H new ATOM 1383 N ALA A 91 -9.091 3.385 -0.528 1.00 0.00 N ATOM 1384 CA ALA A 91 -8.493 3.757 -1.799 1.00 0.00 C ATOM 1385 C ALA A 91 -7.140 3.056 -1.945 1.00 0.00 C ATOM 1386 O ALA A 91 -6.767 2.643 -3.041 1.00 0.00 O ATOM 1387 CB ALA A 91 -8.372 5.281 -1.881 1.00 0.00 C ATOM 0 H ALA A 91 -9.164 4.146 0.148 1.00 0.00 H new ATOM 0 HA ALA A 91 -9.123 3.435 -2.628 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -7.923 5.560 -2.835 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -9.362 5.729 -1.801 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.744 5.641 -1.066 1.00 0.00 H new ATOM 1393 N ALA A 92 -6.443 2.945 -0.824 1.00 0.00 N ATOM 1394 CA ALA A 92 -5.140 2.302 -0.813 1.00 0.00 C ATOM 1395 C ALA A 92 -5.298 0.833 -1.212 1.00 0.00 C ATOM 1396 O ALA A 92 -4.451 0.282 -1.914 1.00 0.00 O ATOM 1397 CB ALA A 92 -4.501 2.467 0.567 1.00 0.00 C ATOM 0 H ALA A 92 -6.756 3.290 0.084 1.00 0.00 H new ATOM 0 HA ALA A 92 -4.474 2.770 -1.538 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -3.524 1.985 0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -4.384 3.528 0.789 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -5.139 2.006 1.321 1.00 0.00 H new ATOM 1403 N ILE A 93 -6.388 0.241 -0.747 1.00 0.00 N ATOM 1404 CA ILE A 93 -6.668 -1.153 -1.047 1.00 0.00 C ATOM 1405 C ILE A 93 -7.075 -1.282 -2.515 1.00 0.00 C ATOM 1406 O ILE A 93 -6.492 -2.071 -3.258 1.00 0.00 O ATOM 1407 CB ILE A 93 -7.703 -1.714 -0.070 1.00 0.00 C ATOM 1408 CG1 ILE A 93 -7.275 -1.475 1.380 1.00 0.00 C ATOM 1409 CG2 ILE A 93 -7.977 -3.192 -0.350 1.00 0.00 C ATOM 1410 CD1 ILE A 93 -8.250 -2.134 2.356 1.00 0.00 C ATOM 0 H ILE A 93 -7.088 0.701 -0.165 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.773 -1.760 -0.910 1.00 0.00 H new ATOM 0 HB ILE A 93 -8.640 -1.179 -0.222 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -6.273 -1.874 1.537 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -7.227 -0.404 1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -8.716 -3.566 0.359 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -8.358 -3.306 -1.365 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -7.053 -3.760 -0.244 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -7.922 -1.949 3.379 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -9.246 -1.716 2.213 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -8.278 -3.208 2.173 1.00 0.00 H new ATOM 1422 N GLN A 94 -8.074 -0.497 -2.892 1.00 0.00 N ATOM 1423 CA GLN A 94 -8.565 -0.514 -4.258 1.00 0.00 C ATOM 1424 C GLN A 94 -7.419 -0.257 -5.239 1.00 0.00 C ATOM 1425 O GLN A 94 -7.276 -0.969 -6.231 1.00 0.00 O ATOM 1426 CB GLN A 94 -9.690 0.506 -4.449 1.00 0.00 C ATOM 1427 CG GLN A 94 -10.520 0.180 -5.693 1.00 0.00 C ATOM 1428 CD GLN A 94 -12.013 0.371 -5.419 1.00 0.00 C ATOM 1429 OE1 GLN A 94 -12.420 0.991 -4.450 1.00 0.00 O ATOM 1430 NE2 GLN A 94 -12.806 -0.195 -6.324 1.00 0.00 N ATOM 0 H GLN A 94 -8.557 0.155 -2.274 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.976 -1.502 -4.463 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -10.334 0.512 -3.569 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -9.267 1.506 -4.541 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.213 0.822 -6.519 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -10.331 -0.848 -6.002 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.401 -0.700 -7.112 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -13.819 -0.124 -6.230 1.00 0.00 H new ATOM 1439 N CYS A 95 -6.633 0.763 -4.926 1.00 0.00 N ATOM 1440 CA CYS A 95 -5.505 1.123 -5.767 1.00 0.00 C ATOM 1441 C CYS A 95 -4.446 0.025 -5.647 1.00 0.00 C ATOM 1442 O CYS A 95 -3.837 -0.367 -6.641 1.00 0.00 O ATOM 1443 CB CYS A 95 -4.944 2.498 -5.402 1.00 0.00 C ATOM 1444 SG CYS A 95 -4.316 3.472 -6.819 1.00 0.00 S ATOM 0 H CYS A 95 -6.755 1.351 -4.102 1.00 0.00 H new ATOM 0 HA CYS A 95 -5.832 1.200 -6.804 1.00 0.00 H new ATOM 0 HB2 CYS A 95 -5.724 3.072 -4.902 1.00 0.00 H new ATOM 0 HB3 CYS A 95 -4.135 2.366 -4.683 1.00 0.00 H new ATOM 1449 N ALA A 96 -4.260 -0.441 -4.420 1.00 0.00 N ATOM 1450 CA ALA A 96 -3.286 -1.487 -4.157 1.00 0.00 C ATOM 1451 C ALA A 96 -3.528 -2.656 -5.114 1.00 0.00 C ATOM 1452 O ALA A 96 -2.593 -3.158 -5.736 1.00 0.00 O ATOM 1453 CB ALA A 96 -3.372 -1.907 -2.689 1.00 0.00 C ATOM 0 H ALA A 96 -4.767 -0.113 -3.598 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.274 -1.122 -4.333 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.642 -2.692 -2.492 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -3.163 -1.048 -2.052 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.373 -2.281 -2.476 1.00 0.00 H new ATOM 1459 N LYS A 97 -4.788 -3.056 -5.202 1.00 0.00 N ATOM 1460 CA LYS A 97 -5.165 -4.157 -6.072 1.00 0.00 C ATOM 1461 C LYS A 97 -5.075 -3.703 -7.530 1.00 0.00 C ATOM 1462 O LYS A 97 -4.568 -4.432 -8.381 1.00 0.00 O ATOM 1463 CB LYS A 97 -6.541 -4.702 -5.681 1.00 0.00 C ATOM 1464 CG LYS A 97 -7.615 -3.619 -5.807 1.00 0.00 C ATOM 1465 CD LYS A 97 -9.018 -4.229 -5.748 1.00 0.00 C ATOM 1466 CE LYS A 97 -9.510 -4.329 -4.302 1.00 0.00 C ATOM 1467 NZ LYS A 97 -10.925 -3.904 -4.206 1.00 0.00 N ATOM 0 H LYS A 97 -5.561 -2.637 -4.685 1.00 0.00 H new ATOM 0 HA LYS A 97 -4.472 -4.990 -5.954 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -6.796 -5.548 -6.319 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.512 -5.073 -4.656 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -7.497 -2.890 -5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -7.487 -3.082 -6.747 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -9.709 -3.619 -6.330 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -9.007 -5.220 -6.202 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.407 -5.354 -3.947 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -8.892 -3.704 -3.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -11.243 -3.978 -3.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -11.014 -2.918 -4.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -11.513 -4.517 -4.806 1.00 0.00 H new ATOM 1481 N ARG A 98 -5.574 -2.500 -7.773 1.00 0.00 N ATOM 1482 CA ARG A 98 -5.556 -1.939 -9.115 1.00 0.00 C ATOM 1483 C ARG A 98 -4.115 -1.747 -9.590 1.00 0.00 C ATOM 1484 O ARG A 98 -3.858 -1.670 -10.790 1.00 0.00 O ATOM 1485 CB ARG A 98 -6.286 -0.595 -9.160 1.00 0.00 C ATOM 1486 CG ARG A 98 -6.445 -0.106 -10.600 1.00 0.00 C ATOM 1487 CD ARG A 98 -7.855 0.436 -10.843 1.00 0.00 C ATOM 1488 NE ARG A 98 -8.253 0.199 -12.248 1.00 0.00 N ATOM 1489 CZ ARG A 98 -9.366 0.696 -12.808 1.00 0.00 C ATOM 1490 NH1 ARG A 98 -10.195 1.461 -12.085 1.00 0.00 N ATOM 1491 NH2 ARG A 98 -9.647 0.429 -14.090 1.00 0.00 N ATOM 0 H ARG A 98 -5.993 -1.898 -7.064 1.00 0.00 H new ATOM 0 HA ARG A 98 -6.069 -2.639 -9.775 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -7.267 -0.694 -8.695 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -5.732 0.143 -8.580 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -5.711 0.673 -10.806 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -6.242 -0.925 -11.290 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -8.561 -0.050 -10.170 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -7.886 1.503 -10.623 1.00 0.00 H new ATOM 0 HE ARG A 98 -7.643 -0.378 -12.827 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -9.980 1.665 -11.109 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -11.041 1.839 -12.510 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -9.015 -0.152 -14.640 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -10.493 0.807 -14.516 1.00 0.00 H new ATOM 1505 N VAL A 99 -3.212 -1.673 -8.623 1.00 0.00 N ATOM 1506 CA VAL A 99 -1.803 -1.490 -8.927 1.00 0.00 C ATOM 1507 C VAL A 99 -1.145 -2.858 -9.120 1.00 0.00 C ATOM 1508 O VAL A 99 -0.580 -3.135 -10.176 1.00 0.00 O ATOM 1509 CB VAL A 99 -1.136 -0.654 -7.833 1.00 0.00 C ATOM 1510 CG1 VAL A 99 0.388 -0.762 -7.915 1.00 0.00 C ATOM 1511 CG2 VAL A 99 -1.586 0.806 -7.907 1.00 0.00 C ATOM 0 H VAL A 99 -3.429 -1.736 -7.628 1.00 0.00 H new ATOM 0 HA VAL A 99 -1.682 -0.937 -9.859 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.450 -1.053 -6.868 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.838 -0.159 -7.127 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.686 -1.803 -7.791 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.727 -0.401 -8.886 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.097 1.378 -7.118 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.315 1.221 -8.878 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.667 0.861 -7.778 1.00 0.00 H new ATOM 1521 N VAL A 100 -1.242 -3.677 -8.082 1.00 0.00 N ATOM 1522 CA VAL A 100 -0.663 -5.008 -8.124 1.00 0.00 C ATOM 1523 C VAL A 100 -1.203 -5.757 -9.345 1.00 0.00 C ATOM 1524 O VAL A 100 -0.508 -6.590 -9.923 1.00 0.00 O ATOM 1525 CB VAL A 100 -0.935 -5.738 -6.806 1.00 0.00 C ATOM 1526 CG1 VAL A 100 -2.160 -6.648 -6.926 1.00 0.00 C ATOM 1527 CG2 VAL A 100 0.294 -6.530 -6.355 1.00 0.00 C ATOM 0 H VAL A 100 -1.713 -3.444 -7.208 1.00 0.00 H new ATOM 0 HA VAL A 100 0.420 -4.950 -8.231 1.00 0.00 H new ATOM 0 HB VAL A 100 -1.148 -4.988 -6.045 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.331 -7.155 -5.976 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -3.034 -6.049 -7.181 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -1.988 -7.389 -7.707 1.00 0.00 H new ATOM 0 HG21 VAL A 100 0.074 -7.039 -5.417 1.00 0.00 H new ATOM 0 HG22 VAL A 100 0.551 -7.267 -7.116 1.00 0.00 H new ATOM 0 HG23 VAL A 100 1.133 -5.849 -6.211 1.00 0.00 H new ATOM 1537 N ARG A 101 -2.438 -5.431 -9.699 1.00 0.00 N ATOM 1538 CA ARG A 101 -3.078 -6.062 -10.841 1.00 0.00 C ATOM 1539 C ARG A 101 -2.142 -6.048 -12.051 1.00 0.00 C ATOM 1540 O ARG A 101 -2.230 -6.915 -12.918 1.00 0.00 O ATOM 1541 CB ARG A 101 -4.381 -5.348 -11.205 1.00 0.00 C ATOM 1542 CG ARG A 101 -5.590 -6.081 -10.622 1.00 0.00 C ATOM 1543 CD ARG A 101 -6.886 -5.318 -10.910 1.00 0.00 C ATOM 1544 NE ARG A 101 -8.054 -6.185 -10.642 1.00 0.00 N ATOM 1545 CZ ARG A 101 -9.286 -5.728 -10.380 1.00 0.00 C ATOM 1546 NH1 ARG A 101 -9.518 -4.408 -10.350 1.00 0.00 N ATOM 1547 NH2 ARG A 101 -10.286 -6.589 -10.151 1.00 0.00 N ATOM 0 H ARG A 101 -3.011 -4.739 -9.216 1.00 0.00 H new ATOM 0 HA ARG A 101 -3.305 -7.092 -10.566 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -4.356 -4.325 -10.830 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -4.476 -5.288 -12.289 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -5.652 -7.083 -11.047 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -5.464 -6.198 -9.546 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -6.937 -4.424 -10.289 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -6.899 -4.987 -11.948 1.00 0.00 H new ATOM 0 HE ARG A 101 -7.913 -7.195 -10.658 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -8.757 -3.752 -10.527 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -10.456 -4.059 -10.151 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -10.110 -7.593 -10.176 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -11.224 -6.240 -9.952 1.00 0.00 H new ATOM 1561 N ASP A 102 -1.266 -5.055 -12.069 1.00 0.00 N ATOM 1562 CA ASP A 102 -0.314 -4.917 -13.157 1.00 0.00 C ATOM 1563 C ASP A 102 0.742 -6.019 -13.049 1.00 0.00 C ATOM 1564 O ASP A 102 0.730 -6.804 -12.102 1.00 0.00 O ATOM 1565 CB ASP A 102 0.404 -3.567 -13.094 1.00 0.00 C ATOM 1566 CG ASP A 102 0.176 -2.657 -14.302 1.00 0.00 C ATOM 1567 OD1 ASP A 102 -0.892 -2.808 -14.934 1.00 0.00 O ATOM 1568 OD2 ASP A 102 1.075 -1.830 -14.567 1.00 0.00 O ATOM 0 H ASP A 102 -1.196 -4.338 -11.347 1.00 0.00 H new ATOM 0 HA ASP A 102 -0.863 -4.990 -14.096 1.00 0.00 H new ATOM 0 HB2 ASP A 102 0.080 -3.041 -12.196 1.00 0.00 H new ATOM 0 HB3 ASP A 102 1.474 -3.746 -12.990 1.00 0.00 H new ATOM 1573 N PRO A 103 1.655 -6.043 -14.057 1.00 0.00 N ATOM 1574 CA PRO A 103 2.715 -7.036 -14.083 1.00 0.00 C ATOM 1575 C PRO A 103 3.804 -6.703 -13.061 1.00 0.00 C ATOM 1576 O PRO A 103 4.804 -7.410 -12.961 1.00 0.00 O ATOM 1577 CB PRO A 103 3.225 -7.028 -15.515 1.00 0.00 C ATOM 1578 CG PRO A 103 2.754 -5.715 -16.120 1.00 0.00 C ATOM 1579 CD PRO A 103 1.700 -5.128 -15.194 1.00 0.00 C ATOM 0 HA PRO A 103 2.367 -8.030 -13.802 1.00 0.00 H new ATOM 0 HB2 PRO A 103 4.312 -7.103 -15.542 1.00 0.00 H new ATOM 0 HB3 PRO A 103 2.833 -7.878 -16.074 1.00 0.00 H new ATOM 0 HG2 PRO A 103 3.590 -5.025 -16.233 1.00 0.00 H new ATOM 0 HG3 PRO A 103 2.340 -5.880 -17.115 1.00 0.00 H new ATOM 0 HD2 PRO A 103 1.967 -4.119 -14.880 1.00 0.00 H new ATOM 0 HD3 PRO A 103 0.731 -5.062 -15.688 1.00 0.00 H new ATOM 1587 N GLN A 104 3.571 -5.625 -12.326 1.00 0.00 N ATOM 1588 CA GLN A 104 4.518 -5.190 -11.314 1.00 0.00 C ATOM 1589 C GLN A 104 4.559 -6.192 -10.159 1.00 0.00 C ATOM 1590 O GLN A 104 5.589 -6.817 -9.912 1.00 0.00 O ATOM 1591 CB GLN A 104 4.175 -3.786 -10.810 1.00 0.00 C ATOM 1592 CG GLN A 104 4.048 -2.801 -11.974 1.00 0.00 C ATOM 1593 CD GLN A 104 5.328 -1.979 -12.139 1.00 0.00 C ATOM 1594 OE1 GLN A 104 6.114 -2.184 -13.049 1.00 0.00 O ATOM 1595 NE2 GLN A 104 5.491 -1.039 -11.211 1.00 0.00 N ATOM 0 H GLN A 104 2.740 -5.040 -12.412 1.00 0.00 H new ATOM 0 HA GLN A 104 5.509 -5.147 -11.766 1.00 0.00 H new ATOM 0 HB2 GLN A 104 3.240 -3.815 -10.250 1.00 0.00 H new ATOM 0 HB3 GLN A 104 4.948 -3.444 -10.122 1.00 0.00 H new ATOM 0 HG2 GLN A 104 3.840 -3.346 -12.895 1.00 0.00 H new ATOM 0 HG3 GLN A 104 3.203 -2.134 -11.800 1.00 0.00 H new ATOM 0 HE21 GLN A 104 4.793 -0.921 -10.476 1.00 0.00 H new ATOM 0 HE22 GLN A 104 6.314 -0.436 -11.235 1.00 0.00 H new ATOM 1604 N GLY A 105 3.426 -6.315 -9.483 1.00 0.00 N ATOM 1605 CA GLY A 105 3.320 -7.231 -8.360 1.00 0.00 C ATOM 1606 C GLY A 105 4.007 -6.659 -7.119 1.00 0.00 C ATOM 1607 O GLY A 105 4.837 -5.756 -7.224 1.00 0.00 O ATOM 0 H GLY A 105 2.573 -5.795 -9.691 1.00 0.00 H new ATOM 0 HA2 GLY A 105 2.270 -7.424 -8.142 1.00 0.00 H new ATOM 0 HA3 GLY A 105 3.773 -8.187 -8.622 1.00 0.00 H new ATOM 1611 N ILE A 106 3.635 -7.206 -5.971 1.00 0.00 N ATOM 1612 CA ILE A 106 4.205 -6.762 -4.711 1.00 0.00 C ATOM 1613 C ILE A 106 5.706 -6.527 -4.889 1.00 0.00 C ATOM 1614 O ILE A 106 6.293 -5.689 -4.205 1.00 0.00 O ATOM 1615 CB ILE A 106 3.865 -7.748 -3.591 1.00 0.00 C ATOM 1616 CG1 ILE A 106 2.466 -7.482 -3.033 1.00 0.00 C ATOM 1617 CG2 ILE A 106 4.934 -7.723 -2.496 1.00 0.00 C ATOM 1618 CD1 ILE A 106 2.461 -6.248 -2.128 1.00 0.00 C ATOM 0 H ILE A 106 2.945 -7.953 -5.887 1.00 0.00 H new ATOM 0 HA ILE A 106 3.767 -5.810 -4.410 1.00 0.00 H new ATOM 0 HB ILE A 106 3.858 -8.754 -4.011 1.00 0.00 H new ATOM 0 HG12 ILE A 106 1.765 -7.337 -3.855 1.00 0.00 H new ATOM 0 HG13 ILE A 106 2.124 -8.351 -2.471 1.00 0.00 H new ATOM 0 HG21 ILE A 106 4.669 -8.432 -1.712 1.00 0.00 H new ATOM 0 HG22 ILE A 106 5.899 -7.998 -2.923 1.00 0.00 H new ATOM 0 HG23 ILE A 106 4.997 -6.721 -2.072 1.00 0.00 H new ATOM 0 HD11 ILE A 106 1.454 -6.082 -1.745 1.00 0.00 H new ATOM 0 HD12 ILE A 106 3.145 -6.406 -1.294 1.00 0.00 H new ATOM 0 HD13 ILE A 106 2.780 -5.376 -2.699 1.00 0.00 H new ATOM 1630 N ARG A 107 6.286 -7.282 -5.811 1.00 0.00 N ATOM 1631 CA ARG A 107 7.707 -7.167 -6.087 1.00 0.00 C ATOM 1632 C ARG A 107 8.123 -5.695 -6.125 1.00 0.00 C ATOM 1633 O ARG A 107 9.229 -5.348 -5.714 1.00 0.00 O ATOM 1634 CB ARG A 107 8.063 -7.825 -7.422 1.00 0.00 C ATOM 1635 CG ARG A 107 9.511 -8.320 -7.419 1.00 0.00 C ATOM 1636 CD ARG A 107 10.399 -7.422 -8.284 1.00 0.00 C ATOM 1637 NE ARG A 107 11.800 -7.492 -7.813 1.00 0.00 N ATOM 1638 CZ ARG A 107 12.854 -7.065 -8.523 1.00 0.00 C ATOM 1639 NH1 ARG A 107 12.671 -6.534 -9.739 1.00 0.00 N ATOM 1640 NH2 ARG A 107 14.089 -7.168 -8.015 1.00 0.00 N ATOM 0 H ARG A 107 5.797 -7.976 -6.376 1.00 0.00 H new ATOM 0 HA ARG A 107 8.243 -7.679 -5.288 1.00 0.00 H new ATOM 0 HB2 ARG A 107 7.389 -8.661 -7.611 1.00 0.00 H new ATOM 0 HB3 ARG A 107 7.920 -7.111 -8.233 1.00 0.00 H new ATOM 0 HG2 ARG A 107 9.891 -8.338 -6.398 1.00 0.00 H new ATOM 0 HG3 ARG A 107 9.550 -9.344 -7.792 1.00 0.00 H new ATOM 0 HD2 ARG A 107 10.341 -7.735 -9.327 1.00 0.00 H new ATOM 0 HD3 ARG A 107 10.043 -6.393 -8.240 1.00 0.00 H new ATOM 0 HE ARG A 107 11.975 -7.890 -6.890 1.00 0.00 H new ATOM 0 HH11 ARG A 107 11.730 -6.455 -10.124 1.00 0.00 H new ATOM 0 HH12 ARG A 107 13.473 -6.209 -10.279 1.00 0.00 H new ATOM 0 HH21 ARG A 107 14.227 -7.571 -7.088 1.00 0.00 H new ATOM 0 HH22 ARG A 107 14.891 -6.843 -8.555 1.00 0.00 H new ATOM 1654 N ALA A 108 7.214 -4.869 -6.623 1.00 0.00 N ATOM 1655 CA ALA A 108 7.473 -3.443 -6.721 1.00 0.00 C ATOM 1656 C ALA A 108 8.116 -2.956 -5.421 1.00 0.00 C ATOM 1657 O ALA A 108 8.966 -2.067 -5.440 1.00 0.00 O ATOM 1658 CB ALA A 108 6.170 -2.708 -7.037 1.00 0.00 C ATOM 0 H ALA A 108 6.297 -5.160 -6.963 1.00 0.00 H new ATOM 0 HA ALA A 108 8.170 -3.234 -7.533 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.364 -1.638 -7.110 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.769 -3.070 -7.984 1.00 0.00 H new ATOM 0 HB3 ALA A 108 5.447 -2.892 -6.242 1.00 0.00 H new ATOM 1664 N TRP A 109 7.688 -3.560 -4.322 1.00 0.00 N ATOM 1665 CA TRP A 109 8.211 -3.199 -3.016 1.00 0.00 C ATOM 1666 C TRP A 109 9.281 -4.225 -2.636 1.00 0.00 C ATOM 1667 O TRP A 109 9.119 -4.966 -1.668 1.00 0.00 O ATOM 1668 CB TRP A 109 7.086 -3.098 -1.983 1.00 0.00 C ATOM 1669 CG TRP A 109 6.017 -2.059 -2.329 1.00 0.00 C ATOM 1670 CD1 TRP A 109 6.052 -0.737 -2.117 1.00 0.00 C ATOM 1671 CD2 TRP A 109 4.744 -2.314 -2.960 1.00 0.00 C ATOM 1672 NE1 TRP A 109 4.900 -0.122 -2.563 1.00 0.00 N ATOM 1673 CE2 TRP A 109 4.079 -1.111 -3.093 1.00 0.00 C ATOM 1674 CE3 TRP A 109 4.173 -3.519 -3.405 1.00 0.00 C ATOM 1675 CZ2 TRP A 109 2.808 -0.998 -3.669 1.00 0.00 C ATOM 1676 CZ3 TRP A 109 2.904 -3.388 -3.978 1.00 0.00 C ATOM 1677 CH2 TRP A 109 2.220 -2.186 -4.118 1.00 0.00 C ATOM 0 H TRP A 109 6.984 -4.298 -4.310 1.00 0.00 H new ATOM 0 HA TRP A 109 8.670 -2.211 -3.044 1.00 0.00 H new ATOM 0 HB2 TRP A 109 6.611 -4.074 -1.881 1.00 0.00 H new ATOM 0 HB3 TRP A 109 7.518 -2.851 -1.013 1.00 0.00 H new ATOM 0 HD1 TRP A 109 6.878 -0.217 -1.655 1.00 0.00 H new ATOM 0 HE1 TRP A 109 4.690 0.875 -2.513 1.00 0.00 H new ATOM 0 HE3 TRP A 109 4.675 -4.471 -3.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 2.308 -0.045 -3.762 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 2.421 -4.285 -4.337 1.00 0.00 H new ATOM 0 HH2 TRP A 109 1.240 -2.169 -4.571 1.00 0.00 H new ATOM 1688 N VAL A 110 10.350 -4.234 -3.418 1.00 0.00 N ATOM 1689 CA VAL A 110 11.447 -5.156 -3.174 1.00 0.00 C ATOM 1690 C VAL A 110 11.722 -5.230 -1.672 1.00 0.00 C ATOM 1691 O VAL A 110 12.179 -6.256 -1.170 1.00 0.00 O ATOM 1692 CB VAL A 110 12.674 -4.737 -3.988 1.00 0.00 C ATOM 1693 CG1 VAL A 110 13.893 -5.583 -3.616 1.00 0.00 C ATOM 1694 CG2 VAL A 110 12.390 -4.815 -5.489 1.00 0.00 C ATOM 0 H VAL A 110 10.480 -3.618 -4.221 1.00 0.00 H new ATOM 0 HA VAL A 110 11.182 -6.160 -3.505 1.00 0.00 H new ATOM 0 HB VAL A 110 12.899 -3.699 -3.744 1.00 0.00 H new ATOM 0 HG11 VAL A 110 14.751 -5.265 -4.208 1.00 0.00 H new ATOM 0 HG12 VAL A 110 14.116 -5.454 -2.557 1.00 0.00 H new ATOM 0 HG13 VAL A 110 13.682 -6.633 -3.817 1.00 0.00 H new ATOM 0 HG21 VAL A 110 13.278 -4.512 -6.044 1.00 0.00 H new ATOM 0 HG22 VAL A 110 12.126 -5.838 -5.757 1.00 0.00 H new ATOM 0 HG23 VAL A 110 11.563 -4.150 -5.738 1.00 0.00 H new ATOM 1704 N ALA A 111 11.433 -4.128 -0.994 1.00 0.00 N ATOM 1705 CA ALA A 111 11.644 -4.055 0.441 1.00 0.00 C ATOM 1706 C ALA A 111 11.088 -5.320 1.100 1.00 0.00 C ATOM 1707 O ALA A 111 11.766 -5.952 1.908 1.00 0.00 O ATOM 1708 CB ALA A 111 10.997 -2.781 0.988 1.00 0.00 C ATOM 0 H ALA A 111 11.054 -3.279 -1.413 1.00 0.00 H new ATOM 0 HA ALA A 111 12.709 -4.005 0.670 1.00 0.00 H new ATOM 0 HB1 ALA A 111 11.155 -2.726 2.065 1.00 0.00 H new ATOM 0 HB2 ALA A 111 11.447 -1.911 0.510 1.00 0.00 H new ATOM 0 HB3 ALA A 111 9.927 -2.797 0.779 1.00 0.00 H new ATOM 1714 N TRP A 112 9.860 -5.651 0.728 1.00 0.00 N ATOM 1715 CA TRP A 112 9.206 -6.829 1.271 1.00 0.00 C ATOM 1716 C TRP A 112 10.128 -8.029 1.043 1.00 0.00 C ATOM 1717 O TRP A 112 10.228 -8.909 1.896 1.00 0.00 O ATOM 1718 CB TRP A 112 7.817 -7.016 0.660 1.00 0.00 C ATOM 1719 CG TRP A 112 7.533 -8.444 0.187 1.00 0.00 C ATOM 1720 CD1 TRP A 112 6.832 -9.397 0.818 1.00 0.00 C ATOM 1721 CD2 TRP A 112 7.972 -9.045 -1.049 1.00 0.00 C ATOM 1722 NE1 TRP A 112 6.789 -10.564 0.081 1.00 0.00 N ATOM 1723 CE2 TRP A 112 7.504 -10.342 -1.090 1.00 0.00 C ATOM 1724 CE3 TRP A 112 8.739 -8.509 -2.098 1.00 0.00 C ATOM 1725 CZ2 TRP A 112 7.751 -11.212 -2.159 1.00 0.00 C ATOM 1726 CZ3 TRP A 112 8.977 -9.392 -3.159 1.00 0.00 C ATOM 1727 CH2 TRP A 112 8.514 -10.701 -3.215 1.00 0.00 C ATOM 0 H TRP A 112 9.301 -5.124 0.057 1.00 0.00 H new ATOM 0 HA TRP A 112 9.039 -6.718 2.342 1.00 0.00 H new ATOM 0 HB2 TRP A 112 7.066 -6.732 1.397 1.00 0.00 H new ATOM 0 HB3 TRP A 112 7.708 -6.336 -0.185 1.00 0.00 H new ATOM 0 HD1 TRP A 112 6.361 -9.268 1.781 1.00 0.00 H new ATOM 0 HE1 TRP A 112 6.319 -11.429 0.347 1.00 0.00 H new ATOM 0 HE3 TRP A 112 9.115 -7.497 -2.087 1.00 0.00 H new ATOM 0 HZ2 TRP A 112 7.373 -12.224 -2.168 1.00 0.00 H new ATOM 0 HZ3 TRP A 112 9.561 -9.030 -3.992 1.00 0.00 H new ATOM 0 HH2 TRP A 112 8.742 -11.321 -4.069 1.00 0.00 H new ATOM 1738 N ARG A 113 10.777 -8.025 -0.112 1.00 0.00 N ATOM 1739 CA ARG A 113 11.685 -9.103 -0.463 1.00 0.00 C ATOM 1740 C ARG A 113 12.833 -9.179 0.546 1.00 0.00 C ATOM 1741 O ARG A 113 13.543 -10.181 0.608 1.00 0.00 O ATOM 1742 CB ARG A 113 12.261 -8.902 -1.866 1.00 0.00 C ATOM 1743 CG ARG A 113 12.796 -10.218 -2.433 1.00 0.00 C ATOM 1744 CD ARG A 113 14.037 -9.981 -3.296 1.00 0.00 C ATOM 1745 NE ARG A 113 14.774 -11.250 -3.484 1.00 0.00 N ATOM 1746 CZ ARG A 113 16.076 -11.325 -3.791 1.00 0.00 C ATOM 1747 NH1 ARG A 113 16.793 -10.204 -3.948 1.00 0.00 N ATOM 1748 NH2 ARG A 113 16.662 -12.521 -3.944 1.00 0.00 N ATOM 0 H ARG A 113 10.692 -7.292 -0.817 1.00 0.00 H new ATOM 0 HA ARG A 113 11.118 -10.034 -0.445 1.00 0.00 H new ATOM 0 HB2 ARG A 113 11.490 -8.504 -2.526 1.00 0.00 H new ATOM 0 HB3 ARG A 113 13.063 -8.164 -1.832 1.00 0.00 H new ATOM 0 HG2 ARG A 113 13.041 -10.897 -1.616 1.00 0.00 H new ATOM 0 HG3 ARG A 113 12.022 -10.703 -3.028 1.00 0.00 H new ATOM 0 HD2 ARG A 113 13.744 -9.574 -4.264 1.00 0.00 H new ATOM 0 HD3 ARG A 113 14.684 -9.242 -2.822 1.00 0.00 H new ATOM 0 HE ARG A 113 14.258 -12.123 -3.373 1.00 0.00 H new ATOM 0 HH11 ARG A 113 16.348 -9.294 -3.834 1.00 0.00 H new ATOM 0 HH12 ARG A 113 17.784 -10.261 -4.182 1.00 0.00 H new ATOM 0 HH21 ARG A 113 16.117 -13.375 -3.827 1.00 0.00 H new ATOM 0 HH22 ARG A 113 17.653 -12.577 -4.178 1.00 0.00 H new ATOM 1762 N ALA A 114 12.978 -8.107 1.310 1.00 0.00 N ATOM 1763 CA ALA A 114 14.028 -8.040 2.313 1.00 0.00 C ATOM 1764 C ALA A 114 13.415 -7.654 3.661 1.00 0.00 C ATOM 1765 O ALA A 114 14.052 -6.976 4.465 1.00 0.00 O ATOM 1766 CB ALA A 114 15.105 -7.053 1.859 1.00 0.00 C ATOM 0 H ALA A 114 12.387 -7.278 1.255 1.00 0.00 H new ATOM 0 HA ALA A 114 14.506 -9.012 2.434 1.00 0.00 H new ATOM 0 HB1 ALA A 114 15.893 -7.003 2.611 1.00 0.00 H new ATOM 0 HB2 ALA A 114 15.529 -7.387 0.912 1.00 0.00 H new ATOM 0 HB3 ALA A 114 14.662 -6.065 1.730 1.00 0.00 H new ATOM 1772 N HIS A 115 12.186 -8.103 3.866 1.00 0.00 N ATOM 1773 CA HIS A 115 11.480 -7.815 5.103 1.00 0.00 C ATOM 1774 C HIS A 115 10.574 -8.993 5.465 1.00 0.00 C ATOM 1775 O HIS A 115 10.556 -9.436 6.612 1.00 0.00 O ATOM 1776 CB HIS A 115 10.717 -6.492 4.997 1.00 0.00 C ATOM 1777 CG HIS A 115 11.003 -5.526 6.122 1.00 0.00 C ATOM 1778 ND1 HIS A 115 12.274 -5.056 6.402 1.00 0.00 N ATOM 1779 CD2 HIS A 115 10.169 -4.948 7.033 1.00 0.00 C ATOM 1780 CE1 HIS A 115 12.197 -4.233 7.437 1.00 0.00 C ATOM 1781 NE2 HIS A 115 10.892 -4.167 7.826 1.00 0.00 N ATOM 0 H HIS A 115 11.660 -8.665 3.196 1.00 0.00 H new ATOM 0 HA HIS A 115 12.198 -7.691 5.914 1.00 0.00 H new ATOM 0 HB2 HIS A 115 10.968 -6.015 4.050 1.00 0.00 H new ATOM 0 HB3 HIS A 115 9.648 -6.702 4.975 1.00 0.00 H new ATOM 0 HD2 HIS A 115 9.102 -5.100 7.098 1.00 0.00 H new ATOM 0 HE1 HIS A 115 13.023 -3.707 7.893 1.00 0.00 H new ATOM 0 HE2 HIS A 115 10.531 -3.609 8.600 1.00 0.00 H new ATOM 1790 N CYS A 116 9.846 -9.467 4.465 1.00 0.00 N ATOM 1791 CA CYS A 116 8.941 -10.586 4.664 1.00 0.00 C ATOM 1792 C CYS A 116 9.713 -11.882 4.401 1.00 0.00 C ATOM 1793 O CYS A 116 9.749 -12.771 5.251 1.00 0.00 O ATOM 1794 CB CYS A 116 7.698 -10.474 3.779 1.00 0.00 C ATOM 1795 SG CYS A 116 6.115 -10.354 4.689 1.00 0.00 S ATOM 0 H CYS A 116 9.864 -9.097 3.515 1.00 0.00 H new ATOM 0 HA CYS A 116 8.577 -10.583 5.691 1.00 0.00 H new ATOM 0 HB2 CYS A 116 7.801 -9.596 3.141 1.00 0.00 H new ATOM 0 HB3 CYS A 116 7.658 -11.343 3.122 1.00 0.00 H new ATOM 1800 N GLN A 117 10.312 -11.946 3.220 1.00 0.00 N ATOM 1801 CA GLN A 117 11.081 -13.118 2.835 1.00 0.00 C ATOM 1802 C GLN A 117 12.387 -13.180 3.629 1.00 0.00 C ATOM 1803 O GLN A 117 13.470 -13.220 3.047 1.00 0.00 O ATOM 1804 CB GLN A 117 11.353 -13.124 1.330 1.00 0.00 C ATOM 1805 CG GLN A 117 10.552 -14.225 0.632 1.00 0.00 C ATOM 1806 CD GLN A 117 11.299 -15.559 0.680 1.00 0.00 C ATOM 1807 OE1 GLN A 117 11.999 -15.943 -0.242 1.00 0.00 O ATOM 1808 NE2 GLN A 117 11.109 -16.245 1.805 1.00 0.00 N ATOM 0 H GLN A 117 10.280 -11.206 2.518 1.00 0.00 H new ATOM 0 HA GLN A 117 10.495 -14.007 3.068 1.00 0.00 H new ATOM 0 HB2 GLN A 117 11.091 -12.155 0.906 1.00 0.00 H new ATOM 0 HB3 GLN A 117 12.417 -13.274 1.150 1.00 0.00 H new ATOM 0 HG2 GLN A 117 9.579 -14.331 1.111 1.00 0.00 H new ATOM 0 HG3 GLN A 117 10.368 -13.944 -0.405 1.00 0.00 H new ATOM 0 HE21 GLN A 117 10.510 -15.866 2.538 1.00 0.00 H new ATOM 0 HE22 GLN A 117 11.563 -17.150 1.934 1.00 0.00 H new ATOM 1817 N ASN A 118 12.242 -13.187 4.947 1.00 0.00 N ATOM 1818 CA ASN A 118 13.397 -13.244 5.826 1.00 0.00 C ATOM 1819 C ASN A 118 13.050 -14.074 7.063 1.00 0.00 C ATOM 1820 O ASN A 118 13.704 -15.076 7.346 1.00 0.00 O ATOM 1821 CB ASN A 118 13.802 -11.845 6.294 1.00 0.00 C ATOM 1822 CG ASN A 118 15.323 -11.723 6.404 1.00 0.00 C ATOM 1823 OD1 ASN A 118 15.964 -12.347 7.233 1.00 0.00 O ATOM 1824 ND2 ASN A 118 15.864 -10.885 5.524 1.00 0.00 N ATOM 0 H ASN A 118 11.342 -13.154 5.426 1.00 0.00 H new ATOM 0 HA ASN A 118 14.222 -13.692 5.271 1.00 0.00 H new ATOM 0 HB2 ASN A 118 13.423 -11.100 5.594 1.00 0.00 H new ATOM 0 HB3 ASN A 118 13.346 -11.635 7.261 1.00 0.00 H new ATOM 0 HD21 ASN A 118 16.873 -10.734 5.517 1.00 0.00 H new ATOM 0 HD22 ASN A 118 15.270 -10.393 4.856 1.00 0.00 H new ATOM 1831 N ARG A 119 12.021 -13.626 7.768 1.00 0.00 N ATOM 1832 CA ARG A 119 11.579 -14.315 8.968 1.00 0.00 C ATOM 1833 C ARG A 119 10.070 -14.564 8.913 1.00 0.00 C ATOM 1834 O ARG A 119 9.441 -14.357 7.875 1.00 0.00 O ATOM 1835 CB ARG A 119 11.910 -13.504 10.222 1.00 0.00 C ATOM 1836 CG ARG A 119 12.210 -14.423 11.407 1.00 0.00 C ATOM 1837 CD ARG A 119 13.516 -14.023 12.096 1.00 0.00 C ATOM 1838 NE ARG A 119 13.256 -12.961 13.094 1.00 0.00 N ATOM 1839 CZ ARG A 119 14.189 -12.453 13.911 1.00 0.00 C ATOM 1840 NH1 ARG A 119 15.449 -12.907 13.853 1.00 0.00 N ATOM 1841 NH2 ARG A 119 13.863 -11.492 14.786 1.00 0.00 N ATOM 0 H ARG A 119 11.481 -12.794 7.531 1.00 0.00 H new ATOM 0 HA ARG A 119 12.106 -15.268 9.016 1.00 0.00 H new ATOM 0 HB2 ARG A 119 12.770 -12.863 10.028 1.00 0.00 H new ATOM 0 HB3 ARG A 119 11.073 -12.850 10.467 1.00 0.00 H new ATOM 0 HG2 ARG A 119 11.389 -14.379 12.123 1.00 0.00 H new ATOM 0 HG3 ARG A 119 12.278 -15.455 11.063 1.00 0.00 H new ATOM 0 HD2 ARG A 119 13.961 -14.891 12.583 1.00 0.00 H new ATOM 0 HD3 ARG A 119 14.234 -13.670 11.356 1.00 0.00 H new ATOM 0 HE ARG A 119 12.307 -12.593 13.164 1.00 0.00 H new ATOM 0 HH11 ARG A 119 15.697 -13.639 13.187 1.00 0.00 H new ATOM 0 HH12 ARG A 119 16.159 -12.521 14.475 1.00 0.00 H new ATOM 0 HH21 ARG A 119 12.904 -11.147 14.831 1.00 0.00 H new ATOM 0 HH22 ARG A 119 14.574 -11.106 15.408 1.00 0.00 H new ATOM 1855 N ASP A 120 9.534 -15.004 10.041 1.00 0.00 N ATOM 1856 CA ASP A 120 8.111 -15.283 10.134 1.00 0.00 C ATOM 1857 C ASP A 120 7.389 -14.052 10.686 1.00 0.00 C ATOM 1858 O ASP A 120 7.397 -13.812 11.893 1.00 0.00 O ATOM 1859 CB ASP A 120 7.839 -16.454 11.080 1.00 0.00 C ATOM 1860 CG ASP A 120 6.431 -17.045 10.991 1.00 0.00 C ATOM 1861 OD1 ASP A 120 6.196 -17.807 10.029 1.00 0.00 O ATOM 1862 OD2 ASP A 120 5.622 -16.721 11.887 1.00 0.00 O ATOM 0 H ASP A 120 10.059 -15.174 10.899 1.00 0.00 H new ATOM 0 HA ASP A 120 7.752 -15.535 9.136 1.00 0.00 H new ATOM 0 HB2 ASP A 120 8.562 -17.243 10.873 1.00 0.00 H new ATOM 0 HB3 ASP A 120 8.013 -16.122 12.104 1.00 0.00 H new ATOM 1867 N LEU A 121 6.783 -13.304 9.777 1.00 0.00 N ATOM 1868 CA LEU A 121 6.058 -12.103 10.157 1.00 0.00 C ATOM 1869 C LEU A 121 4.584 -12.450 10.379 1.00 0.00 C ATOM 1870 O LEU A 121 3.735 -11.563 10.435 1.00 0.00 O ATOM 1871 CB LEU A 121 6.280 -10.993 9.127 1.00 0.00 C ATOM 1872 CG LEU A 121 6.072 -9.563 9.627 1.00 0.00 C ATOM 1873 CD1 LEU A 121 7.266 -8.677 9.267 1.00 0.00 C ATOM 1874 CD2 LEU A 121 4.753 -8.986 9.107 1.00 0.00 C ATOM 0 H LEU A 121 6.779 -13.506 8.777 1.00 0.00 H new ATOM 0 HA LEU A 121 6.439 -11.711 11.100 1.00 0.00 H new ATOM 0 HB2 LEU A 121 7.297 -11.078 8.744 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.607 -11.164 8.287 1.00 0.00 H new ATOM 0 HG LEU A 121 6.006 -9.588 10.715 1.00 0.00 H new ATOM 0 HD11 LEU A 121 7.092 -7.665 9.634 1.00 0.00 H new ATOM 0 HD12 LEU A 121 8.169 -9.079 9.726 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.389 -8.654 8.184 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.630 -7.968 9.477 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.765 -8.977 8.017 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.924 -9.602 9.456 1.00 0.00 H new ATOM 1886 N SER A 122 4.327 -13.745 10.498 1.00 0.00 N ATOM 1887 CA SER A 122 2.971 -14.220 10.712 1.00 0.00 C ATOM 1888 C SER A 122 2.509 -13.867 12.128 1.00 0.00 C ATOM 1889 O SER A 122 1.311 -13.757 12.384 1.00 0.00 O ATOM 1890 CB SER A 122 2.874 -15.730 10.485 1.00 0.00 C ATOM 1891 OG SER A 122 2.180 -16.046 9.282 1.00 0.00 O ATOM 0 H SER A 122 5.034 -14.479 10.450 1.00 0.00 H new ATOM 0 HA SER A 122 2.319 -13.728 9.990 1.00 0.00 H new ATOM 0 HB2 SER A 122 3.877 -16.156 10.448 1.00 0.00 H new ATOM 0 HB3 SER A 122 2.363 -16.191 11.330 1.00 0.00 H new ATOM 0 HG SER A 122 2.141 -17.019 9.173 1.00 0.00 H new ATOM 1897 N GLN A 123 3.484 -13.697 13.008 1.00 0.00 N ATOM 1898 CA GLN A 123 3.192 -13.358 14.391 1.00 0.00 C ATOM 1899 C GLN A 123 2.739 -11.900 14.496 1.00 0.00 C ATOM 1900 O GLN A 123 2.226 -11.479 15.531 1.00 0.00 O ATOM 1901 CB GLN A 123 4.405 -13.622 15.287 1.00 0.00 C ATOM 1902 CG GLN A 123 4.041 -13.454 16.764 1.00 0.00 C ATOM 1903 CD GLN A 123 4.104 -14.795 17.498 1.00 0.00 C ATOM 1904 OE1 GLN A 123 3.299 -15.686 17.287 1.00 0.00 O ATOM 1905 NE2 GLN A 123 5.103 -14.886 18.373 1.00 0.00 N ATOM 0 H GLN A 123 4.477 -13.787 12.791 1.00 0.00 H new ATOM 0 HA GLN A 123 2.379 -13.996 14.738 1.00 0.00 H new ATOM 0 HB2 GLN A 123 4.778 -14.631 15.113 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.211 -12.935 15.027 1.00 0.00 H new ATOM 0 HG2 GLN A 123 4.724 -12.746 17.233 1.00 0.00 H new ATOM 0 HG3 GLN A 123 3.039 -13.034 16.850 1.00 0.00 H new ATOM 0 HE21 GLN A 123 5.742 -14.101 18.501 1.00 0.00 H new ATOM 0 HE22 GLN A 123 5.229 -15.740 18.916 1.00 0.00 H new ATOM 1914 N TYR A 124 2.946 -11.171 13.410 1.00 0.00 N ATOM 1915 CA TYR A 124 2.565 -9.769 13.366 1.00 0.00 C ATOM 1916 C TYR A 124 1.056 -9.617 13.159 1.00 0.00 C ATOM 1917 O TYR A 124 0.447 -8.683 13.677 1.00 0.00 O ATOM 1918 CB TYR A 124 3.296 -9.171 12.163 1.00 0.00 C ATOM 1919 CG TYR A 124 3.831 -7.757 12.400 1.00 0.00 C ATOM 1920 CD1 TYR A 124 2.953 -6.709 12.587 1.00 0.00 C ATOM 1921 CD2 TYR A 124 5.192 -7.529 12.426 1.00 0.00 C ATOM 1922 CE1 TYR A 124 3.456 -5.379 12.810 1.00 0.00 C ATOM 1923 CE2 TYR A 124 5.695 -6.199 12.649 1.00 0.00 C ATOM 1924 CZ TYR A 124 4.803 -5.189 12.829 1.00 0.00 C ATOM 1925 OH TYR A 124 5.279 -3.933 13.040 1.00 0.00 O ATOM 0 H TYR A 124 3.373 -11.524 12.553 1.00 0.00 H new ATOM 0 HA TYR A 124 2.823 -9.272 14.301 1.00 0.00 H new ATOM 0 HB2 TYR A 124 4.128 -9.823 11.895 1.00 0.00 H new ATOM 0 HB3 TYR A 124 2.617 -9.153 11.310 1.00 0.00 H new ATOM 0 HD1 TYR A 124 1.888 -6.887 12.566 1.00 0.00 H new ATOM 0 HD2 TYR A 124 5.880 -8.349 12.279 1.00 0.00 H new ATOM 0 HE1 TYR A 124 2.779 -4.551 12.959 1.00 0.00 H new ATOM 0 HE2 TYR A 124 6.758 -6.008 12.673 1.00 0.00 H new ATOM 0 HH TYR A 124 6.259 -3.948 13.028 1.00 0.00 H new ATOM 1935 N ILE A 125 0.499 -10.549 12.401 1.00 0.00 N ATOM 1936 CA ILE A 125 -0.927 -10.531 12.118 1.00 0.00 C ATOM 1937 C ILE A 125 -1.648 -11.458 13.099 1.00 0.00 C ATOM 1938 O ILE A 125 -2.776 -11.181 13.504 1.00 0.00 O ATOM 1939 CB ILE A 125 -1.186 -10.867 10.648 1.00 0.00 C ATOM 1940 CG1 ILE A 125 -0.515 -12.186 10.262 1.00 0.00 C ATOM 1941 CG2 ILE A 125 -0.755 -9.715 9.738 1.00 0.00 C ATOM 1942 CD1 ILE A 125 -1.488 -13.097 9.510 1.00 0.00 C ATOM 0 H ILE A 125 1.009 -11.322 11.974 1.00 0.00 H new ATOM 0 HA ILE A 125 -1.333 -9.531 12.267 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.259 -11.000 10.511 1.00 0.00 H new ATOM 0 HG12 ILE A 125 0.357 -11.986 9.639 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -0.157 -12.692 11.159 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -0.950 -9.980 8.699 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.318 -8.818 9.996 1.00 0.00 H new ATOM 0 HG23 ILE A 125 0.310 -9.526 9.870 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.986 -14.028 9.247 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -2.347 -13.315 10.145 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.825 -12.598 8.602 1.00 0.00 H new ATOM 1954 N ARG A 126 -0.968 -12.539 13.451 1.00 0.00 N ATOM 1955 CA ARG A 126 -1.530 -13.509 14.376 1.00 0.00 C ATOM 1956 C ARG A 126 -1.448 -12.983 15.810 1.00 0.00 C ATOM 1957 O ARG A 126 -0.361 -12.890 16.379 1.00 0.00 O ATOM 1958 CB ARG A 126 -0.793 -14.846 14.287 1.00 0.00 C ATOM 1959 CG ARG A 126 -1.478 -15.908 15.148 1.00 0.00 C ATOM 1960 CD ARG A 126 -2.856 -16.264 14.586 1.00 0.00 C ATOM 1961 NE ARG A 126 -3.415 -17.424 15.315 1.00 0.00 N ATOM 1962 CZ ARG A 126 -4.414 -18.190 14.855 1.00 0.00 C ATOM 1963 NH1 ARG A 126 -4.969 -17.925 13.665 1.00 0.00 N ATOM 1964 NH2 ARG A 126 -4.858 -19.222 15.585 1.00 0.00 N ATOM 0 H ARG A 126 -0.033 -12.765 13.112 1.00 0.00 H new ATOM 0 HA ARG A 126 -2.573 -13.664 14.101 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -0.761 -15.179 13.250 1.00 0.00 H new ATOM 0 HB3 ARG A 126 0.239 -14.719 14.613 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -0.857 -16.803 15.191 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -1.581 -15.542 16.170 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -3.527 -15.410 14.676 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -2.776 -16.496 13.524 1.00 0.00 H new ATOM 0 HE ARG A 126 -3.015 -17.655 16.224 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -4.631 -17.140 13.108 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -5.729 -18.508 13.316 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -4.436 -19.425 16.491 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -5.618 -19.805 15.235 1.00 0.00 H new ATOM 1978 N ASN A 127 -2.610 -12.655 16.354 1.00 0.00 N ATOM 1979 CA ASN A 127 -2.683 -12.141 17.711 1.00 0.00 C ATOM 1980 C ASN A 127 -4.045 -11.478 17.928 1.00 0.00 C ATOM 1981 O ASN A 127 -4.542 -11.427 19.052 1.00 0.00 O ATOM 1982 CB ASN A 127 -1.600 -11.090 17.961 1.00 0.00 C ATOM 1983 CG ASN A 127 -0.675 -11.516 19.102 1.00 0.00 C ATOM 1984 OD1 ASN A 127 -0.714 -10.984 20.200 1.00 0.00 O ATOM 1985 ND2 ASN A 127 0.157 -12.504 18.784 1.00 0.00 N ATOM 0 H ASN A 127 -3.509 -12.735 15.880 1.00 0.00 H new ATOM 0 HA ASN A 127 -2.539 -12.976 18.396 1.00 0.00 H new ATOM 0 HB2 ASN A 127 -1.017 -10.940 17.052 1.00 0.00 H new ATOM 0 HB3 ASN A 127 -2.065 -10.134 18.203 1.00 0.00 H new ATOM 0 HD21 ASN A 127 0.814 -12.861 19.478 1.00 0.00 H new ATOM 0 HD22 ASN A 127 0.138 -12.905 17.846 1.00 0.00 H new ATOM 1992 N CYS A 128 -4.610 -10.987 16.835 1.00 0.00 N ATOM 1993 CA CYS A 128 -5.904 -10.329 16.892 1.00 0.00 C ATOM 1994 C CYS A 128 -6.978 -11.400 17.093 1.00 0.00 C ATOM 1995 O CYS A 128 -8.057 -11.112 17.608 1.00 0.00 O ATOM 1996 CB CYS A 128 -6.166 -9.487 15.642 1.00 0.00 C ATOM 1997 SG CYS A 128 -6.874 -7.831 15.967 1.00 0.00 S ATOM 0 H CYS A 128 -4.195 -11.032 15.904 1.00 0.00 H new ATOM 0 HA CYS A 128 -5.924 -9.632 17.730 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -5.228 -9.366 15.100 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -6.844 -10.035 14.988 1.00 0.00 H new ATOM 2002 N GLY A 129 -6.644 -12.614 16.678 1.00 0.00 N ATOM 2003 CA GLY A 129 -7.567 -13.729 16.807 1.00 0.00 C ATOM 2004 C GLY A 129 -8.217 -14.060 15.463 1.00 0.00 C ATOM 2005 O GLY A 129 -9.354 -14.528 15.418 1.00 0.00 O ATOM 0 H GLY A 129 -5.747 -12.849 16.252 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -7.036 -14.603 17.184 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -8.338 -13.485 17.538 1.00 0.00 H new ATOM 2009 N VAL A 130 -7.469 -13.804 14.400 1.00 0.00 N ATOM 2010 CA VAL A 130 -7.958 -14.069 13.058 1.00 0.00 C ATOM 2011 C VAL A 130 -7.594 -15.501 12.660 1.00 0.00 C ATOM 2012 O VAL A 130 -8.155 -16.458 13.190 1.00 0.00 O ATOM 2013 CB VAL A 130 -7.413 -13.021 12.086 1.00 0.00 C ATOM 2014 CG1 VAL A 130 -6.134 -13.516 11.406 1.00 0.00 C ATOM 2015 CG2 VAL A 130 -8.469 -12.633 11.048 1.00 0.00 C ATOM 0 H VAL A 130 -6.527 -13.415 14.441 1.00 0.00 H new ATOM 0 HA VAL A 130 -9.045 -13.989 13.025 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.164 -12.129 12.661 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -5.767 -12.752 10.720 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.375 -13.719 12.162 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.347 -14.430 10.851 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -8.055 -11.887 10.370 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -8.763 -13.516 10.481 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -9.342 -12.220 11.554 1.00 0.00 H new TER 2025 VAL A 130