USER MOD reduce.3.24.130724 H: found=0, std=0, add=1488, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1486 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: B 47 THR OG1 : rot 136:sc= 0.956 USER MOD Set 1.2: B 49 SER OG : rot 86:sc= 1.22 USER MOD Set 1.3: B 50 ASN : amide:sc= 0.507 K(o=2.7,f=-1.2!) USER MOD Set 2.1: B 39 GLN : amide:sc= -1.18 X(o=-3.4,f=-3.5!) USER MOD Set 2.2: B 43 HIS :FLIP no HD1:sc= -2.18! X(o=-3.5,f=-3.4!) USER MOD Set 3.1: A 91 GLN : amide:sc= 0.186 K(o=-2.3,f=-7.5!) USER MOD Set 3.2: B 81 HIS : no HE2:sc= -2.52 K(o=-2.3,f=-4.6!) USER MOD Set 4.1: A 81 HIS : no HE2:sc= 0.49 K(o=1.6,f=-6.1!) USER MOD Set 4.2: B 91 GLN : amide:sc= 1.1 K(o=1.6,f=-5.2!) USER MOD Set 5.1: A 47 THR OG1 : rot 119:sc= 1.16 USER MOD Set 5.2: A 49 SER OG : rot 81:sc= 0.866 USER MOD Set 5.3: A 50 ASN : amide:sc= 0.188 K(o=2.2,f=0.78) USER MOD Set 6.1: A 39 GLN : amide:sc= -0.688 K(o=-1.9,f=-3.2!) USER MOD Set 6.2: A 43 HIS : no HD1:sc= -1.22 X(o=-1.9,f=-2.2) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0105 USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 35 CYS SG : rot 51:sc= 0.619 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 85:sc= 1.3 USER MOD Single : A 53 ASN : amide:sc= -0.0285 X(o=-0.029,f=-0.017) USER MOD Single : A 54 HIS : no HD1:sc= -0.335 K(o=-0.33,f=-1.2) USER MOD Single : A 56 SER OG : rot -75:sc= 1.2 USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.0824 USER MOD Single : A 68 TYR OH : rot -131:sc= 0.547 USER MOD Single : A 72 GLN : amide:sc= -0.751 K(o=-0.75,f=-4.3!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot -38:sc= 1.31 USER MOD Single : A 98 THR OG1 : rot -40:sc= 0.934 USER MOD Single : A 100 GLN : amide:sc= 0.239 K(o=0.24,f=-2.5!) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.0263 USER MOD Single : B 24 CYS SG : rot 180:sc= 0 USER MOD Single : B 35 CYS SG : rot 59:sc= 0.61 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 52 SER OG : rot 81:sc= 0.723 USER MOD Single : B 53 ASN : amide:sc=-0.00537 K(o=-0.0054,f=-4.1!) USER MOD Single : B 54 HIS : no HD1:sc= -0.304 K(o=-0.3,f=-1.6) USER MOD Single : B 56 SER OG : rot 180:sc= 0.0279 USER MOD Single : B 67 THR OG1 : rot 180:sc= -0.139 USER MOD Single : B 68 TYR OH : rot -130:sc= 0.267 USER MOD Single : B 72 GLN : amide:sc= 0.95 K(o=0.95,f=0) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot -53:sc= 1.3 USER MOD Single : B 98 THR OG1 : rot -41:sc= 1.26 USER MOD Single : B 100 GLN : amide:sc= 0.658 K(o=0.66,f=-2!) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 10 10.205 0.565 -11.666 1.00 0.00 N ATOM 2 CA ALA A 10 10.383 -0.373 -10.541 1.00 0.00 C ATOM 3 C ALA A 10 9.579 0.106 -9.318 1.00 0.00 C ATOM 4 O ALA A 10 10.109 0.651 -8.344 1.00 0.00 O ATOM 5 CB ALA A 10 11.874 -0.653 -10.267 1.00 0.00 C ATOM 0 HA ALA A 10 9.970 -1.346 -10.807 1.00 0.00 H new ATOM 0 HB1 ALA A 10 11.966 -1.348 -9.432 1.00 0.00 H new ATOM 0 HB2 ALA A 10 12.331 -1.090 -11.155 1.00 0.00 H new ATOM 0 HB3 ALA A 10 12.380 0.280 -10.020 1.00 0.00 H new ATOM 11 N LEU A 11 8.250 -0.020 -9.412 1.00 0.00 N ATOM 12 CA LEU A 11 7.319 0.577 -8.453 1.00 0.00 C ATOM 13 C LEU A 11 6.757 -0.425 -7.440 1.00 0.00 C ATOM 14 O LEU A 11 6.644 -0.048 -6.282 1.00 0.00 O ATOM 15 CB LEU A 11 6.195 1.303 -9.212 1.00 0.00 C ATOM 16 CG LEU A 11 6.474 2.698 -9.813 1.00 0.00 C ATOM 17 CD1 LEU A 11 7.050 3.697 -8.796 1.00 0.00 C ATOM 18 CD2 LEU A 11 7.376 2.619 -11.043 1.00 0.00 C ATOM 0 H LEU A 11 7.791 -0.541 -10.159 1.00 0.00 H new ATOM 0 HA LEU A 11 7.882 1.297 -7.859 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.875 0.653 -10.026 1.00 0.00 H new ATOM 0 HB3 LEU A 11 5.349 1.402 -8.531 1.00 0.00 H new ATOM 0 HG LEU A 11 5.499 3.077 -10.118 1.00 0.00 H new ATOM 0 HD11 LEU A 11 7.222 4.656 -9.285 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.344 3.829 -7.976 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.993 3.315 -8.405 1.00 0.00 H new ATOM 0 HD21 LEU A 11 7.547 3.622 -11.434 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.330 2.170 -10.766 1.00 0.00 H new ATOM 0 HD23 LEU A 11 6.896 2.008 -11.808 1.00 0.00 H new ATOM 30 N ALA A 12 6.449 -1.675 -7.790 1.00 0.00 N ATOM 31 CA ALA A 12 5.759 -2.623 -6.904 1.00 0.00 C ATOM 32 C ALA A 12 6.441 -2.799 -5.538 1.00 0.00 C ATOM 33 O ALA A 12 5.772 -2.820 -4.502 1.00 0.00 O ATOM 34 CB ALA A 12 5.644 -3.954 -7.649 1.00 0.00 C ATOM 0 H ALA A 12 6.673 -2.065 -8.706 1.00 0.00 H new ATOM 0 HA ALA A 12 4.773 -2.223 -6.667 1.00 0.00 H new ATOM 0 HB1 ALA A 12 5.135 -4.682 -7.017 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.074 -3.809 -8.567 1.00 0.00 H new ATOM 0 HB3 ALA A 12 6.641 -4.321 -7.895 1.00 0.00 H new ATOM 40 N ARG A 13 7.780 -2.805 -5.504 1.00 0.00 N ATOM 41 CA ARG A 13 8.544 -2.914 -4.255 1.00 0.00 C ATOM 42 C ARG A 13 8.153 -1.859 -3.195 1.00 0.00 C ATOM 43 O ARG A 13 8.318 -2.102 -2.002 1.00 0.00 O ATOM 44 CB ARG A 13 10.057 -2.954 -4.555 1.00 0.00 C ATOM 45 CG ARG A 13 10.838 -1.649 -4.336 1.00 0.00 C ATOM 46 CD ARG A 13 10.462 -0.476 -5.243 1.00 0.00 C ATOM 47 NE ARG A 13 10.892 0.767 -4.590 1.00 0.00 N ATOM 48 CZ ARG A 13 10.597 2.006 -4.948 1.00 0.00 C ATOM 49 NH1 ARG A 13 9.968 2.312 -6.061 1.00 0.00 N ATOM 50 NH2 ARG A 13 11.002 2.979 -4.176 1.00 0.00 N ATOM 0 H ARG A 13 8.362 -2.735 -6.339 1.00 0.00 H new ATOM 0 HA ARG A 13 8.275 -3.862 -3.789 1.00 0.00 H new ATOM 0 HB2 ARG A 13 10.507 -3.728 -3.934 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.190 -3.260 -5.592 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.702 -1.338 -3.300 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.899 -1.859 -4.469 1.00 0.00 H new ATOM 0 HD2 ARG A 13 10.942 -0.579 -6.216 1.00 0.00 H new ATOM 0 HD3 ARG A 13 9.386 -0.461 -5.418 1.00 0.00 H new ATOM 0 HE ARG A 13 11.486 0.663 -3.767 1.00 0.00 H new ATOM 0 HH11 ARG A 13 9.679 1.574 -6.703 1.00 0.00 H new ATOM 0 HH12 ARG A 13 9.769 3.287 -6.282 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.528 2.771 -3.327 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.792 3.946 -4.422 1.00 0.00 H new ATOM 64 N LEU A 14 7.577 -0.720 -3.606 1.00 0.00 N ATOM 65 CA LEU A 14 7.038 0.336 -2.749 1.00 0.00 C ATOM 66 C LEU A 14 5.982 -0.200 -1.776 1.00 0.00 C ATOM 67 O LEU A 14 6.055 0.145 -0.601 1.00 0.00 O ATOM 68 CB LEU A 14 6.481 1.425 -3.681 1.00 0.00 C ATOM 69 CG LEU A 14 5.871 2.719 -3.109 1.00 0.00 C ATOM 70 CD1 LEU A 14 4.524 2.538 -2.399 1.00 0.00 C ATOM 71 CD2 LEU A 14 6.880 3.446 -2.232 1.00 0.00 C ATOM 0 H LEU A 14 7.471 -0.503 -4.597 1.00 0.00 H new ATOM 0 HA LEU A 14 7.819 0.752 -2.112 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.291 1.721 -4.347 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.715 0.956 -4.299 1.00 0.00 H new ATOM 0 HG LEU A 14 5.637 3.340 -3.974 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.174 3.502 -2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 14 3.795 2.131 -3.100 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.644 1.851 -1.561 1.00 0.00 H new ATOM 0 HD21 LEU A 14 6.430 4.357 -1.838 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.175 2.800 -1.405 1.00 0.00 H new ATOM 0 HD23 LEU A 14 7.759 3.702 -2.824 1.00 0.00 H new ATOM 83 N GLY A 15 5.067 -1.088 -2.190 1.00 0.00 N ATOM 84 CA GLY A 15 4.047 -1.637 -1.285 1.00 0.00 C ATOM 85 C GLY A 15 4.665 -2.453 -0.148 1.00 0.00 C ATOM 86 O GLY A 15 4.240 -2.336 1.001 1.00 0.00 O ATOM 0 H GLY A 15 5.012 -1.441 -3.145 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.458 -0.821 -0.866 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.362 -2.267 -1.852 1.00 0.00 H new ATOM 90 N ARG A 16 5.759 -3.177 -0.433 1.00 0.00 N ATOM 91 CA ARG A 16 6.587 -3.844 0.584 1.00 0.00 C ATOM 92 C ARG A 16 7.390 -2.822 1.394 1.00 0.00 C ATOM 93 O ARG A 16 7.415 -2.919 2.612 1.00 0.00 O ATOM 94 CB ARG A 16 7.506 -4.892 -0.073 1.00 0.00 C ATOM 95 CG ARG A 16 8.155 -5.894 0.909 1.00 0.00 C ATOM 96 CD ARG A 16 9.311 -5.357 1.782 1.00 0.00 C ATOM 97 NE ARG A 16 8.962 -5.323 3.214 1.00 0.00 N ATOM 98 CZ ARG A 16 9.774 -5.063 4.231 1.00 0.00 C ATOM 99 NH1 ARG A 16 11.026 -4.686 4.082 1.00 0.00 N ATOM 100 NH2 ARG A 16 9.340 -5.142 5.465 1.00 0.00 N ATOM 0 H ARG A 16 6.097 -3.317 -1.385 1.00 0.00 H new ATOM 0 HA ARG A 16 5.928 -4.364 1.279 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.928 -5.450 -0.810 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.296 -4.372 -0.615 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.377 -6.275 1.571 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.528 -6.742 0.334 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.192 -5.983 1.640 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.577 -4.353 1.451 1.00 0.00 H new ATOM 0 HE ARG A 16 7.989 -5.521 3.449 1.00 0.00 H new ATOM 0 HH11 ARG A 16 11.419 -4.580 3.147 1.00 0.00 H new ATOM 0 HH12 ARG A 16 11.604 -4.500 4.902 1.00 0.00 H new ATOM 0 HH21 ARG A 16 8.372 -5.405 5.649 1.00 0.00 H new ATOM 0 HH22 ARG A 16 9.970 -4.941 6.241 1.00 0.00 H new ATOM 114 N ALA A 17 8.034 -1.839 0.765 1.00 0.00 N ATOM 115 CA ALA A 17 8.851 -0.839 1.451 1.00 0.00 C ATOM 116 C ALA A 17 8.033 0.050 2.403 1.00 0.00 C ATOM 117 O ALA A 17 8.597 0.577 3.362 1.00 0.00 O ATOM 118 CB ALA A 17 9.604 -0.020 0.394 1.00 0.00 C ATOM 0 H ALA A 17 8.002 -1.714 -0.247 1.00 0.00 H new ATOM 0 HA ALA A 17 9.567 -1.350 2.095 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.220 0.732 0.887 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.241 -0.682 -0.193 1.00 0.00 H new ATOM 0 HB3 ALA A 17 8.887 0.472 -0.264 1.00 0.00 H new ATOM 124 N LEU A 18 6.718 0.203 2.182 1.00 0.00 N ATOM 125 CA LEU A 18 5.834 0.849 3.158 1.00 0.00 C ATOM 126 C LEU A 18 5.379 -0.108 4.271 1.00 0.00 C ATOM 127 O LEU A 18 5.191 0.342 5.403 1.00 0.00 O ATOM 128 CB LEU A 18 4.670 1.598 2.470 1.00 0.00 C ATOM 129 CG LEU A 18 4.979 3.108 2.366 1.00 0.00 C ATOM 130 CD1 LEU A 18 6.123 3.401 1.388 1.00 0.00 C ATOM 131 CD2 LEU A 18 3.755 3.938 1.966 1.00 0.00 C ATOM 0 H LEU A 18 6.246 -0.113 1.335 1.00 0.00 H new ATOM 0 HA LEU A 18 6.423 1.612 3.667 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.504 1.186 1.475 1.00 0.00 H new ATOM 0 HB3 LEU A 18 3.750 1.448 3.035 1.00 0.00 H new ATOM 0 HG LEU A 18 5.284 3.403 3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.303 4.475 1.350 1.00 0.00 H new ATOM 0 HD12 LEU A 18 7.027 2.894 1.724 1.00 0.00 H new ATOM 0 HD13 LEU A 18 5.853 3.042 0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.032 4.991 1.909 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.391 3.605 0.994 1.00 0.00 H new ATOM 0 HD23 LEU A 18 2.969 3.810 2.711 1.00 0.00 H new ATOM 143 N ALA A 19 5.297 -1.404 3.986 1.00 0.00 N ATOM 144 CA ALA A 19 5.027 -2.485 4.927 1.00 0.00 C ATOM 145 C ALA A 19 6.314 -3.038 5.594 1.00 0.00 C ATOM 146 O ALA A 19 6.721 -4.177 5.363 1.00 0.00 O ATOM 147 CB ALA A 19 4.251 -3.530 4.125 1.00 0.00 C ATOM 0 H ALA A 19 5.425 -1.748 3.034 1.00 0.00 H new ATOM 0 HA ALA A 19 4.442 -2.141 5.780 1.00 0.00 H new ATOM 0 HB1 ALA A 19 4.011 -4.377 4.768 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.329 -3.088 3.748 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.859 -3.871 3.287 1.00 0.00 H new ATOM 153 N ASP A 20 6.949 -2.203 6.423 1.00 0.00 N ATOM 154 CA ASP A 20 8.222 -2.420 7.142 1.00 0.00 C ATOM 155 C ASP A 20 8.090 -1.742 8.532 1.00 0.00 C ATOM 156 O ASP A 20 7.604 -0.606 8.556 1.00 0.00 O ATOM 157 CB ASP A 20 9.358 -1.849 6.261 1.00 0.00 C ATOM 158 CG ASP A 20 10.784 -2.180 6.713 1.00 0.00 C ATOM 159 OD1 ASP A 20 11.127 -3.385 6.661 1.00 0.00 O ATOM 160 OD2 ASP A 20 11.523 -1.230 7.066 1.00 0.00 O ATOM 0 H ASP A 20 6.560 -1.283 6.629 1.00 0.00 H new ATOM 0 HA ASP A 20 8.456 -3.470 7.319 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.224 -2.219 5.244 1.00 0.00 H new ATOM 0 HB3 ASP A 20 9.252 -0.765 6.222 1.00 0.00 H new ATOM 165 N PRO A 21 8.515 -2.372 9.654 1.00 0.00 N ATOM 166 CA PRO A 21 8.173 -2.036 11.055 1.00 0.00 C ATOM 167 C PRO A 21 8.401 -0.576 11.493 1.00 0.00 C ATOM 168 O PRO A 21 7.580 0.296 11.195 1.00 0.00 O ATOM 169 CB PRO A 21 8.941 -3.067 11.908 1.00 0.00 C ATOM 170 CG PRO A 21 10.180 -3.295 11.049 1.00 0.00 C ATOM 171 CD PRO A 21 9.524 -3.428 9.680 1.00 0.00 C ATOM 0 HA PRO A 21 7.093 -2.100 11.189 1.00 0.00 H new ATOM 0 HB2 PRO A 21 9.190 -2.680 12.896 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.370 -3.983 12.059 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.881 -2.462 11.097 1.00 0.00 H new ATOM 0 HG3 PRO A 21 10.730 -4.191 11.338 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.251 -3.302 8.878 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.073 -4.412 9.550 1.00 0.00 H new ATOM 179 N THR A 22 9.481 -0.286 12.240 1.00 0.00 N ATOM 180 CA THR A 22 9.799 1.055 12.767 1.00 0.00 C ATOM 181 C THR A 22 9.869 2.071 11.634 1.00 0.00 C ATOM 182 O THR A 22 9.475 3.227 11.797 1.00 0.00 O ATOM 183 CB THR A 22 11.126 1.013 13.534 1.00 0.00 C ATOM 184 OG1 THR A 22 11.141 -0.096 14.401 1.00 0.00 O ATOM 185 CG2 THR A 22 11.353 2.282 14.358 1.00 0.00 C ATOM 0 H THR A 22 10.171 -0.990 12.500 1.00 0.00 H new ATOM 0 HA THR A 22 9.007 1.361 13.450 1.00 0.00 H new ATOM 0 HB THR A 22 11.924 0.935 12.795 1.00 0.00 H new ATOM 0 HG1 THR A 22 11.991 -0.119 14.887 1.00 0.00 H new ATOM 0 HG21 THR A 22 12.305 2.209 14.885 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.371 3.148 13.696 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.546 2.395 15.082 1.00 0.00 H new ATOM 193 N ARG A 23 10.273 1.615 10.447 1.00 0.00 N ATOM 194 CA ARG A 23 10.259 2.393 9.218 1.00 0.00 C ATOM 195 C ARG A 23 8.920 3.085 8.921 1.00 0.00 C ATOM 196 O ARG A 23 8.899 4.256 8.540 1.00 0.00 O ATOM 197 CB ARG A 23 10.652 1.479 8.074 1.00 0.00 C ATOM 198 CG ARG A 23 11.195 2.312 6.912 1.00 0.00 C ATOM 199 CD ARG A 23 10.469 2.015 5.591 1.00 0.00 C ATOM 200 NE ARG A 23 9.231 2.810 5.445 1.00 0.00 N ATOM 201 CZ ARG A 23 7.980 2.440 5.695 1.00 0.00 C ATOM 202 NH1 ARG A 23 7.665 1.277 6.199 1.00 0.00 N ATOM 203 NH2 ARG A 23 6.982 3.246 5.415 1.00 0.00 N ATOM 0 H ARG A 23 10.628 0.668 10.316 1.00 0.00 H new ATOM 0 HA ARG A 23 10.973 3.207 9.340 1.00 0.00 H new ATOM 0 HB2 ARG A 23 11.407 0.767 8.408 1.00 0.00 H new ATOM 0 HB3 ARG A 23 9.789 0.899 7.746 1.00 0.00 H new ATOM 0 HG2 ARG A 23 11.094 3.371 7.149 1.00 0.00 H new ATOM 0 HG3 ARG A 23 12.260 2.112 6.791 1.00 0.00 H new ATOM 0 HD2 ARG A 23 11.136 2.227 4.756 1.00 0.00 H new ATOM 0 HD3 ARG A 23 10.225 0.954 5.543 1.00 0.00 H new ATOM 0 HE ARG A 23 9.353 3.765 5.109 1.00 0.00 H new ATOM 0 HH11 ARG A 23 8.397 0.602 6.420 1.00 0.00 H new ATOM 0 HH12 ARG A 23 6.687 1.044 6.371 1.00 0.00 H new ATOM 0 HH21 ARG A 23 7.166 4.161 5.004 1.00 0.00 H new ATOM 0 HH22 ARG A 23 6.023 2.957 5.609 1.00 0.00 H new ATOM 217 N CYS A 24 7.791 2.403 9.131 1.00 0.00 N ATOM 218 CA CYS A 24 6.455 2.986 8.965 1.00 0.00 C ATOM 219 C CYS A 24 6.260 4.204 9.877 1.00 0.00 C ATOM 220 O CYS A 24 5.821 5.264 9.418 1.00 0.00 O ATOM 221 CB CYS A 24 5.426 1.874 9.207 1.00 0.00 C ATOM 222 SG CYS A 24 3.776 2.487 8.775 1.00 0.00 S ATOM 0 H CYS A 24 7.777 1.426 9.423 1.00 0.00 H new ATOM 0 HA CYS A 24 6.323 3.370 7.953 1.00 0.00 H new ATOM 0 HB2 CYS A 24 5.671 0.998 8.606 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.449 1.561 10.251 1.00 0.00 H new ATOM 0 HG CYS A 24 2.898 1.549 8.976 1.00 0.00 H new ATOM 228 N ARG A 25 6.700 4.093 11.138 1.00 0.00 N ATOM 229 CA ARG A 25 6.697 5.213 12.080 1.00 0.00 C ATOM 230 C ARG A 25 7.627 6.359 11.624 1.00 0.00 C ATOM 231 O ARG A 25 7.292 7.508 11.879 1.00 0.00 O ATOM 232 CB ARG A 25 6.989 4.707 13.501 1.00 0.00 C ATOM 233 CG ARG A 25 6.704 5.746 14.598 1.00 0.00 C ATOM 234 CD ARG A 25 5.229 6.085 14.829 1.00 0.00 C ATOM 235 NE ARG A 25 5.132 7.160 15.829 1.00 0.00 N ATOM 236 CZ ARG A 25 4.035 7.658 16.384 1.00 0.00 C ATOM 237 NH1 ARG A 25 2.828 7.194 16.122 1.00 0.00 N ATOM 238 NH2 ARG A 25 4.156 8.659 17.228 1.00 0.00 N ATOM 0 H ARG A 25 7.066 3.225 11.530 1.00 0.00 H new ATOM 0 HA ARG A 25 5.701 5.655 12.098 1.00 0.00 H new ATOM 0 HB2 ARG A 25 6.389 3.817 13.691 1.00 0.00 H new ATOM 0 HB3 ARG A 25 8.035 4.405 13.562 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.124 5.381 15.535 1.00 0.00 H new ATOM 0 HG3 ARG A 25 7.233 6.665 14.348 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.764 6.398 13.894 1.00 0.00 H new ATOM 0 HD3 ARG A 25 4.690 5.202 15.173 1.00 0.00 H new ATOM 0 HE ARG A 25 6.015 7.572 16.132 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.710 6.420 15.468 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.013 7.609 16.573 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.079 9.036 17.443 1.00 0.00 H new ATOM 0 HH22 ARG A 25 3.327 9.059 17.667 1.00 0.00 H new ATOM 252 N ILE A 26 8.721 6.104 10.885 1.00 0.00 N ATOM 253 CA ILE A 26 9.474 7.196 10.218 1.00 0.00 C ATOM 254 C ILE A 26 8.606 7.908 9.189 1.00 0.00 C ATOM 255 O ILE A 26 8.485 9.122 9.230 1.00 0.00 O ATOM 256 CB ILE A 26 10.785 6.761 9.508 1.00 0.00 C ATOM 257 CG1 ILE A 26 11.609 5.811 10.386 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.545 8.050 9.141 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.128 5.770 10.176 1.00 0.00 C ATOM 0 H ILE A 26 9.103 5.171 10.732 1.00 0.00 H new ATOM 0 HA ILE A 26 9.754 7.855 11.040 1.00 0.00 H new ATOM 0 HB ILE A 26 10.572 6.192 8.603 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.423 6.074 11.427 1.00 0.00 H new ATOM 0 HG13 ILE A 26 11.224 4.802 10.238 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.477 7.792 8.638 1.00 0.00 H new ATOM 0 HG22 ILE A 26 10.930 8.658 8.477 1.00 0.00 H new ATOM 0 HG23 ILE A 26 11.766 8.613 10.048 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.572 5.054 10.868 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.346 5.468 9.152 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.547 6.759 10.359 1.00 0.00 H new ATOM 271 N LEU A 27 8.006 7.172 8.254 1.00 0.00 N ATOM 272 CA LEU A 27 7.209 7.833 7.208 1.00 0.00 C ATOM 273 C LEU A 27 6.040 8.639 7.780 1.00 0.00 C ATOM 274 O LEU A 27 5.830 9.751 7.309 1.00 0.00 O ATOM 275 CB LEU A 27 6.741 6.900 6.081 1.00 0.00 C ATOM 276 CG LEU A 27 7.805 6.482 5.046 1.00 0.00 C ATOM 277 CD1 LEU A 27 7.095 5.992 3.774 1.00 0.00 C ATOM 278 CD2 LEU A 27 8.776 7.587 4.617 1.00 0.00 C ATOM 0 H LEU A 27 8.049 6.155 8.193 1.00 0.00 H new ATOM 0 HA LEU A 27 7.905 8.533 6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.332 5.997 6.534 1.00 0.00 H new ATOM 0 HB3 LEU A 27 5.923 7.389 5.551 1.00 0.00 H new ATOM 0 HG LEU A 27 8.396 5.714 5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 27 7.838 5.694 3.035 1.00 0.00 H new ATOM 0 HD12 LEU A 27 6.462 5.139 4.017 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.481 6.796 3.367 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.482 7.188 3.888 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.217 8.409 4.169 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.321 7.951 5.488 1.00 0.00 H new ATOM 290 N VAL A 28 5.334 8.164 8.810 1.00 0.00 N ATOM 291 CA VAL A 28 4.260 8.974 9.432 1.00 0.00 C ATOM 292 C VAL A 28 4.803 10.207 10.195 1.00 0.00 C ATOM 293 O VAL A 28 4.139 11.236 10.262 1.00 0.00 O ATOM 294 CB VAL A 28 3.300 8.101 10.276 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.721 7.932 11.744 1.00 0.00 C ATOM 296 CG2 VAL A 28 1.861 8.636 10.216 1.00 0.00 C ATOM 0 H VAL A 28 5.475 7.245 9.230 1.00 0.00 H new ATOM 0 HA VAL A 28 3.662 9.387 8.620 1.00 0.00 H new ATOM 0 HB VAL A 28 3.352 7.113 9.819 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.993 7.307 12.262 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.702 7.460 11.789 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.766 8.909 12.224 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.211 8.001 10.819 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.835 9.654 10.604 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.514 8.633 9.183 1.00 0.00 H new ATOM 306 N ALA A 29 6.043 10.131 10.694 1.00 0.00 N ATOM 307 CA ALA A 29 6.817 11.240 11.262 1.00 0.00 C ATOM 308 C ALA A 29 7.534 12.120 10.208 1.00 0.00 C ATOM 309 O ALA A 29 8.273 13.046 10.543 1.00 0.00 O ATOM 310 CB ALA A 29 7.801 10.617 12.251 1.00 0.00 C ATOM 0 H ALA A 29 6.558 9.251 10.713 1.00 0.00 H new ATOM 0 HA ALA A 29 6.139 11.937 11.754 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.406 11.402 12.706 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.250 10.088 13.028 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.450 9.917 11.726 1.00 0.00 H new ATOM 316 N LEU A 30 7.363 11.819 8.922 1.00 0.00 N ATOM 317 CA LEU A 30 7.771 12.675 7.803 1.00 0.00 C ATOM 318 C LEU A 30 6.581 13.414 7.188 1.00 0.00 C ATOM 319 O LEU A 30 6.782 14.408 6.493 1.00 0.00 O ATOM 320 CB LEU A 30 8.483 11.818 6.763 1.00 0.00 C ATOM 321 CG LEU A 30 10.008 11.683 6.941 1.00 0.00 C ATOM 322 CD1 LEU A 30 10.745 12.766 6.158 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.543 11.750 8.372 1.00 0.00 C ATOM 0 H LEU A 30 6.925 10.949 8.618 1.00 0.00 H new ATOM 0 HA LEU A 30 8.452 13.441 8.175 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.044 10.820 6.778 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.286 12.238 5.776 1.00 0.00 H new ATOM 0 HG LEU A 30 10.196 10.674 6.573 1.00 0.00 H new ATOM 0 HD11 LEU A 30 11.820 12.650 6.299 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.507 12.675 5.098 1.00 0.00 H new ATOM 0 HD13 LEU A 30 10.436 13.748 6.516 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.628 11.642 8.360 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.278 12.710 8.815 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.105 10.945 8.962 1.00 0.00 H new ATOM 335 N LEU A 31 5.376 12.901 7.433 1.00 0.00 N ATOM 336 CA LEU A 31 4.111 13.582 7.213 1.00 0.00 C ATOM 337 C LEU A 31 3.997 14.767 8.189 1.00 0.00 C ATOM 338 O LEU A 31 3.658 15.867 7.763 1.00 0.00 O ATOM 339 CB LEU A 31 2.988 12.559 7.423 1.00 0.00 C ATOM 340 CG LEU A 31 2.152 12.302 6.166 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.129 11.254 6.595 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.432 13.539 5.608 1.00 0.00 C ATOM 0 H LEU A 31 5.255 11.959 7.806 1.00 0.00 H new ATOM 0 HA LEU A 31 4.041 13.983 6.202 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.423 11.618 7.759 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.332 12.910 8.220 1.00 0.00 H new ATOM 0 HG LEU A 31 2.805 11.987 5.352 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.484 11.009 5.751 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.647 10.355 6.929 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.524 11.649 7.411 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.866 13.260 4.719 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.752 13.935 6.362 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.167 14.300 5.346 1.00 0.00 H new ATOM 354 N ASP A 32 4.350 14.523 9.459 1.00 0.00 N ATOM 355 CA ASP A 32 4.553 15.518 10.519 1.00 0.00 C ATOM 356 C ASP A 32 5.874 15.259 11.275 1.00 0.00 C ATOM 357 O ASP A 32 5.972 14.442 12.193 1.00 0.00 O ATOM 358 CB ASP A 32 3.363 15.568 11.492 1.00 0.00 C ATOM 359 CG ASP A 32 3.567 16.636 12.582 1.00 0.00 C ATOM 360 OD1 ASP A 32 4.184 17.681 12.270 1.00 0.00 O ATOM 361 OD2 ASP A 32 3.102 16.406 13.721 1.00 0.00 O ATOM 0 H ASP A 32 4.510 13.572 9.792 1.00 0.00 H new ATOM 0 HA ASP A 32 4.621 16.494 10.039 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.449 15.782 10.939 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.232 14.592 11.958 1.00 0.00 H new ATOM 366 N GLY A 33 6.916 15.971 10.848 1.00 0.00 N ATOM 367 CA GLY A 33 8.228 16.056 11.500 1.00 0.00 C ATOM 368 C GLY A 33 9.144 16.975 10.731 1.00 0.00 C ATOM 369 O GLY A 33 9.268 18.139 11.088 1.00 0.00 O ATOM 0 H GLY A 33 6.869 16.532 9.998 1.00 0.00 H new ATOM 0 HA2 GLY A 33 8.110 16.421 12.520 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.672 15.063 11.566 1.00 0.00 H new ATOM 373 N VAL A 34 9.797 16.459 9.687 1.00 0.00 N ATOM 374 CA VAL A 34 10.609 17.226 8.703 1.00 0.00 C ATOM 375 C VAL A 34 11.541 18.318 9.268 1.00 0.00 C ATOM 376 O VAL A 34 11.862 19.268 8.562 1.00 0.00 O ATOM 377 CB VAL A 34 9.762 17.801 7.540 1.00 0.00 C ATOM 378 CG1 VAL A 34 9.019 16.648 6.870 1.00 0.00 C ATOM 379 CG2 VAL A 34 8.755 18.899 7.924 1.00 0.00 C ATOM 0 H VAL A 34 9.783 15.459 9.485 1.00 0.00 H new ATOM 0 HA VAL A 34 11.278 16.453 8.324 1.00 0.00 H new ATOM 0 HB VAL A 34 10.470 18.292 6.872 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.416 17.033 6.047 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.739 15.926 6.485 1.00 0.00 H new ATOM 0 HG13 VAL A 34 8.370 16.161 7.598 1.00 0.00 H new ATOM 0 HG21 VAL A 34 8.218 19.228 7.034 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.045 18.504 8.651 1.00 0.00 H new ATOM 0 HG23 VAL A 34 9.287 19.745 8.360 1.00 0.00 H new ATOM 389 N CYS A 35 11.981 18.214 10.524 1.00 0.00 N ATOM 390 CA CYS A 35 12.899 19.191 11.110 1.00 0.00 C ATOM 391 C CYS A 35 14.337 18.848 10.728 1.00 0.00 C ATOM 392 O CYS A 35 14.916 19.464 9.844 1.00 0.00 O ATOM 393 CB CYS A 35 12.666 19.263 12.628 1.00 0.00 C ATOM 394 SG CYS A 35 11.063 20.030 12.976 1.00 0.00 S ATOM 0 H CYS A 35 11.714 17.459 11.156 1.00 0.00 H new ATOM 0 HA CYS A 35 12.707 20.188 10.713 1.00 0.00 H new ATOM 0 HB2 CYS A 35 12.699 18.261 13.057 1.00 0.00 H new ATOM 0 HB3 CYS A 35 13.463 19.838 13.099 1.00 0.00 H new ATOM 0 HG CYS A 35 10.137 19.434 12.285 1.00 0.00 H new ATOM 400 N TYR A 36 14.902 17.834 11.385 1.00 0.00 N ATOM 401 CA TYR A 36 16.331 17.520 11.274 1.00 0.00 C ATOM 402 C TYR A 36 16.608 16.007 11.198 1.00 0.00 C ATOM 403 O TYR A 36 15.802 15.233 11.721 1.00 0.00 O ATOM 404 CB TYR A 36 17.091 18.107 12.491 1.00 0.00 C ATOM 405 CG TYR A 36 16.461 19.262 13.257 1.00 0.00 C ATOM 406 CD1 TYR A 36 16.379 20.553 12.699 1.00 0.00 C ATOM 407 CD2 TYR A 36 15.976 19.038 14.564 1.00 0.00 C ATOM 408 CE1 TYR A 36 15.817 21.612 13.442 1.00 0.00 C ATOM 409 CE2 TYR A 36 15.402 20.088 15.303 1.00 0.00 C ATOM 410 CZ TYR A 36 15.326 21.385 14.746 1.00 0.00 C ATOM 411 OH TYR A 36 14.776 22.399 15.469 1.00 0.00 O ATOM 0 H TYR A 36 14.387 17.209 12.006 1.00 0.00 H new ATOM 0 HA TYR A 36 16.680 17.967 10.343 1.00 0.00 H new ATOM 0 HB2 TYR A 36 17.261 17.295 13.198 1.00 0.00 H new ATOM 0 HB3 TYR A 36 18.070 18.436 12.142 1.00 0.00 H new ATOM 0 HD1 TYR A 36 16.747 20.732 11.700 1.00 0.00 H new ATOM 0 HD2 TYR A 36 16.046 18.052 15.000 1.00 0.00 H new ATOM 0 HE1 TYR A 36 15.762 22.601 13.011 1.00 0.00 H new ATOM 0 HE2 TYR A 36 15.019 19.903 16.296 1.00 0.00 H new ATOM 0 HH TYR A 36 14.491 22.060 16.343 1.00 0.00 H new ATOM 421 N PRO A 37 17.778 15.560 10.693 1.00 0.00 N ATOM 422 CA PRO A 37 18.155 14.144 10.675 1.00 0.00 C ATOM 423 C PRO A 37 18.168 13.462 12.053 1.00 0.00 C ATOM 424 O PRO A 37 18.087 12.240 12.104 1.00 0.00 O ATOM 425 CB PRO A 37 19.537 14.094 10.008 1.00 0.00 C ATOM 426 CG PRO A 37 20.089 15.506 10.179 1.00 0.00 C ATOM 427 CD PRO A 37 18.828 16.352 10.070 1.00 0.00 C ATOM 0 HA PRO A 37 17.402 13.577 10.127 1.00 0.00 H new ATOM 0 HB2 PRO A 37 20.182 13.355 10.483 1.00 0.00 H new ATOM 0 HB3 PRO A 37 19.461 13.821 8.955 1.00 0.00 H new ATOM 0 HG2 PRO A 37 20.586 15.636 11.140 1.00 0.00 H new ATOM 0 HG3 PRO A 37 20.817 15.756 9.407 1.00 0.00 H new ATOM 0 HD2 PRO A 37 18.952 17.309 10.577 1.00 0.00 H new ATOM 0 HD3 PRO A 37 18.590 16.571 9.029 1.00 0.00 H new ATOM 435 N GLY A 38 18.226 14.218 13.162 1.00 0.00 N ATOM 436 CA GLY A 38 18.090 13.673 14.519 1.00 0.00 C ATOM 437 C GLY A 38 16.693 13.775 15.141 1.00 0.00 C ATOM 438 O GLY A 38 16.503 13.241 16.226 1.00 0.00 O ATOM 0 H GLY A 38 18.369 15.228 13.140 1.00 0.00 H new ATOM 0 HA2 GLY A 38 18.383 12.623 14.500 1.00 0.00 H new ATOM 0 HA3 GLY A 38 18.796 14.189 15.170 1.00 0.00 H new ATOM 442 N GLN A 39 15.719 14.446 14.514 1.00 0.00 N ATOM 443 CA GLN A 39 14.423 14.754 15.149 1.00 0.00 C ATOM 444 C GLN A 39 13.545 13.523 15.347 1.00 0.00 C ATOM 445 O GLN A 39 12.782 13.473 16.307 1.00 0.00 O ATOM 446 CB GLN A 39 13.683 15.847 14.356 1.00 0.00 C ATOM 447 CG GLN A 39 13.001 15.353 13.061 1.00 0.00 C ATOM 448 CD GLN A 39 11.559 14.857 13.184 1.00 0.00 C ATOM 449 OE1 GLN A 39 11.169 13.945 12.488 1.00 0.00 O ATOM 450 NE2 GLN A 39 10.706 15.420 14.008 1.00 0.00 N ATOM 0 H GLN A 39 15.802 14.791 13.558 1.00 0.00 H new ATOM 0 HA GLN A 39 14.641 15.129 16.149 1.00 0.00 H new ATOM 0 HB2 GLN A 39 12.927 16.296 15.000 1.00 0.00 H new ATOM 0 HB3 GLN A 39 14.392 16.634 14.100 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.019 16.167 12.336 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.604 14.544 12.647 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.007 16.190 14.606 1.00 0.00 H new ATOM 0 HE22 GLN A 39 9.743 15.088 14.050 1.00 0.00 H new ATOM 459 N LEU A 40 13.702 12.519 14.481 1.00 0.00 N ATOM 460 CA LEU A 40 12.964 11.266 14.550 1.00 0.00 C ATOM 461 C LEU A 40 13.285 10.491 15.825 1.00 0.00 C ATOM 462 O LEU A 40 12.496 9.651 16.227 1.00 0.00 O ATOM 463 CB LEU A 40 13.268 10.430 13.300 1.00 0.00 C ATOM 464 CG LEU A 40 12.735 11.062 12.009 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.530 10.495 10.827 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.229 10.806 11.902 1.00 0.00 C ATOM 0 H LEU A 40 14.358 12.560 13.701 1.00 0.00 H new ATOM 0 HA LEU A 40 11.898 11.490 14.581 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.346 10.296 13.213 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.832 9.438 13.419 1.00 0.00 H new ATOM 0 HG LEU A 40 12.869 12.144 12.008 1.00 0.00 H new ATOM 0 HD11 LEU A 40 13.164 10.934 9.899 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.586 10.735 10.950 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.406 9.413 10.791 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.848 11.255 10.985 1.00 0.00 H new ATOM 0 HD22 LEU A 40 11.043 9.732 11.885 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.723 11.249 12.760 1.00 0.00 H new ATOM 478 N ALA A 41 14.401 10.803 16.487 1.00 0.00 N ATOM 479 CA ALA A 41 14.791 10.169 17.745 1.00 0.00 C ATOM 480 C ALA A 41 13.660 10.247 18.792 1.00 0.00 C ATOM 481 O ALA A 41 13.316 9.245 19.416 1.00 0.00 O ATOM 482 CB ALA A 41 16.072 10.857 18.243 1.00 0.00 C ATOM 0 H ALA A 41 15.063 11.508 16.162 1.00 0.00 H new ATOM 0 HA ALA A 41 14.980 9.108 17.583 1.00 0.00 H new ATOM 0 HB1 ALA A 41 16.387 10.403 19.183 1.00 0.00 H new ATOM 0 HB2 ALA A 41 16.861 10.738 17.500 1.00 0.00 H new ATOM 0 HB3 ALA A 41 15.878 11.918 18.400 1.00 0.00 H new ATOM 488 N ALA A 42 13.033 11.423 18.929 1.00 0.00 N ATOM 489 CA ALA A 42 11.898 11.641 19.829 1.00 0.00 C ATOM 490 C ALA A 42 10.618 10.956 19.324 1.00 0.00 C ATOM 491 O ALA A 42 9.900 10.334 20.099 1.00 0.00 O ATOM 492 CB ALA A 42 11.709 13.154 19.996 1.00 0.00 C ATOM 0 H ALA A 42 13.305 12.258 18.411 1.00 0.00 H new ATOM 0 HA ALA A 42 12.108 11.186 20.797 1.00 0.00 H new ATOM 0 HB1 ALA A 42 10.868 13.344 20.663 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.614 13.589 20.420 1.00 0.00 H new ATOM 0 HB3 ALA A 42 11.510 13.605 19.024 1.00 0.00 H new ATOM 498 N HIS A 43 10.348 11.011 18.016 1.00 0.00 N ATOM 499 CA HIS A 43 9.191 10.321 17.418 1.00 0.00 C ATOM 500 C HIS A 43 9.230 8.775 17.518 1.00 0.00 C ATOM 501 O HIS A 43 8.180 8.134 17.366 1.00 0.00 O ATOM 502 CB HIS A 43 9.063 10.737 15.944 1.00 0.00 C ATOM 503 CG HIS A 43 8.255 11.981 15.701 1.00 0.00 C ATOM 504 ND1 HIS A 43 6.987 12.225 16.232 1.00 0.00 N ATOM 505 CD2 HIS A 43 8.501 12.874 14.702 1.00 0.00 C ATOM 506 CE1 HIS A 43 6.497 13.259 15.528 1.00 0.00 C ATOM 507 NE2 HIS A 43 7.372 13.659 14.589 1.00 0.00 N ATOM 0 H HIS A 43 10.916 11.528 17.345 1.00 0.00 H new ATOM 0 HA HIS A 43 8.324 10.630 18.001 1.00 0.00 H new ATOM 0 HB2 HIS A 43 10.063 10.886 15.537 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.612 9.915 15.388 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.403 12.952 14.114 1.00 0.00 H new ATOM 0 HE1 HIS A 43 5.529 13.709 15.694 1.00 0.00 H new ATOM 0 HE2 HIS A 43 7.227 14.409 13.913 1.00 0.00 H new ATOM 515 N LEU A 44 10.423 8.189 17.707 1.00 0.00 N ATOM 516 CA LEU A 44 10.687 6.739 17.671 1.00 0.00 C ATOM 517 C LEU A 44 11.145 6.154 19.013 1.00 0.00 C ATOM 518 O LEU A 44 11.164 4.934 19.146 1.00 0.00 O ATOM 519 CB LEU A 44 11.730 6.438 16.569 1.00 0.00 C ATOM 520 CG LEU A 44 11.261 6.921 15.185 1.00 0.00 C ATOM 521 CD1 LEU A 44 12.269 6.708 14.083 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.941 6.290 14.740 1.00 0.00 C ATOM 0 H LEU A 44 11.265 8.733 17.897 1.00 0.00 H new ATOM 0 HA LEU A 44 9.738 6.252 17.448 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.674 6.921 16.821 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.921 5.365 16.533 1.00 0.00 H new ATOM 0 HG LEU A 44 11.126 7.992 15.336 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.861 7.075 13.141 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.185 7.250 14.318 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.490 5.644 13.993 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.668 6.673 13.757 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.054 5.207 14.689 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.159 6.539 15.457 1.00 0.00 H new ATOM 534 N GLY A 45 11.567 6.986 19.972 1.00 0.00 N ATOM 535 CA GLY A 45 12.219 6.546 21.215 1.00 0.00 C ATOM 536 C GLY A 45 13.647 6.025 21.003 1.00 0.00 C ATOM 537 O GLY A 45 14.267 5.530 21.943 1.00 0.00 O ATOM 0 H GLY A 45 11.465 7.999 19.907 1.00 0.00 H new ATOM 0 HA2 GLY A 45 12.245 7.379 21.918 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.618 5.761 21.673 1.00 0.00 H new ATOM 541 N LEU A 46 14.158 6.106 19.769 1.00 0.00 N ATOM 542 CA LEU A 46 15.470 5.591 19.372 1.00 0.00 C ATOM 543 C LEU A 46 16.500 6.721 19.257 1.00 0.00 C ATOM 544 O LEU A 46 16.180 7.901 19.339 1.00 0.00 O ATOM 545 CB LEU A 46 15.316 4.807 18.051 1.00 0.00 C ATOM 546 CG LEU A 46 14.592 3.450 18.165 1.00 0.00 C ATOM 547 CD1 LEU A 46 14.460 2.853 16.756 1.00 0.00 C ATOM 548 CD2 LEU A 46 15.343 2.458 19.069 1.00 0.00 C ATOM 0 H LEU A 46 13.654 6.545 18.998 1.00 0.00 H new ATOM 0 HA LEU A 46 15.847 4.915 20.140 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.773 5.430 17.340 1.00 0.00 H new ATOM 0 HB3 LEU A 46 16.308 4.636 17.633 1.00 0.00 H new ATOM 0 HG LEU A 46 13.615 3.622 18.617 1.00 0.00 H new ATOM 0 HD11 LEU A 46 13.950 1.892 16.815 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.885 3.531 16.126 1.00 0.00 H new ATOM 0 HD13 LEU A 46 15.452 2.712 16.326 1.00 0.00 H new ATOM 0 HD21 LEU A 46 14.792 1.519 19.116 1.00 0.00 H new ATOM 0 HD22 LEU A 46 16.337 2.275 18.661 1.00 0.00 H new ATOM 0 HD23 LEU A 46 15.433 2.876 20.072 1.00 0.00 H new ATOM 560 N THR A 47 17.765 6.355 19.045 1.00 0.00 N ATOM 561 CA THR A 47 18.859 7.309 18.821 1.00 0.00 C ATOM 562 C THR A 47 18.940 7.675 17.341 1.00 0.00 C ATOM 563 O THR A 47 18.549 6.888 16.476 1.00 0.00 O ATOM 564 CB THR A 47 20.190 6.728 19.306 1.00 0.00 C ATOM 565 OG1 THR A 47 20.505 5.695 18.425 1.00 0.00 O ATOM 566 CG2 THR A 47 20.143 6.122 20.708 1.00 0.00 C ATOM 0 H THR A 47 18.065 5.380 19.023 1.00 0.00 H new ATOM 0 HA THR A 47 18.656 8.214 19.394 1.00 0.00 H new ATOM 0 HB THR A 47 20.914 7.542 19.340 1.00 0.00 H new ATOM 0 HG1 THR A 47 21.357 5.891 17.982 1.00 0.00 H new ATOM 0 HG21 THR A 47 21.128 5.735 20.970 1.00 0.00 H new ATOM 0 HG22 THR A 47 19.851 6.888 21.426 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.416 5.310 20.729 1.00 0.00 H new ATOM 574 N ARG A 48 19.550 8.823 17.023 1.00 0.00 N ATOM 575 CA ARG A 48 19.786 9.212 15.623 1.00 0.00 C ATOM 576 C ARG A 48 20.697 8.236 14.854 1.00 0.00 C ATOM 577 O ARG A 48 20.647 8.200 13.627 1.00 0.00 O ATOM 578 CB ARG A 48 20.278 10.663 15.519 1.00 0.00 C ATOM 579 CG ARG A 48 21.719 10.877 16.006 1.00 0.00 C ATOM 580 CD ARG A 48 22.164 12.320 15.757 1.00 0.00 C ATOM 581 NE ARG A 48 23.596 12.478 16.063 1.00 0.00 N ATOM 582 CZ ARG A 48 24.429 13.363 15.524 1.00 0.00 C ATOM 583 NH1 ARG A 48 24.010 14.282 14.680 1.00 0.00 N ATOM 584 NH2 ARG A 48 25.708 13.323 15.831 1.00 0.00 N ATOM 0 H ARG A 48 19.888 9.497 17.710 1.00 0.00 H new ATOM 0 HA ARG A 48 18.817 9.151 15.128 1.00 0.00 H new ATOM 0 HB2 ARG A 48 20.206 10.985 14.480 1.00 0.00 H new ATOM 0 HB3 ARG A 48 19.612 11.303 16.098 1.00 0.00 H new ATOM 0 HG2 ARG A 48 21.787 10.648 17.070 1.00 0.00 H new ATOM 0 HG3 ARG A 48 22.389 10.190 15.489 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.976 12.591 14.718 1.00 0.00 H new ATOM 0 HD3 ARG A 48 21.577 13.000 16.375 1.00 0.00 H new ATOM 0 HE ARG A 48 23.988 11.844 16.759 1.00 0.00 H new ATOM 0 HH11 ARG A 48 23.024 14.328 14.424 1.00 0.00 H new ATOM 0 HH12 ARG A 48 24.672 14.948 14.282 1.00 0.00 H new ATOM 0 HH21 ARG A 48 26.055 12.616 16.479 1.00 0.00 H new ATOM 0 HH22 ARG A 48 26.352 13.999 15.421 1.00 0.00 H new ATOM 598 N SER A 49 21.516 7.429 15.535 1.00 0.00 N ATOM 599 CA SER A 49 22.223 6.321 14.884 1.00 0.00 C ATOM 600 C SER A 49 21.238 5.189 14.577 1.00 0.00 C ATOM 601 O SER A 49 21.104 4.810 13.419 1.00 0.00 O ATOM 602 CB SER A 49 23.408 5.841 15.743 1.00 0.00 C ATOM 603 OG SER A 49 23.053 5.639 17.103 1.00 0.00 O ATOM 0 H SER A 49 21.706 7.521 16.533 1.00 0.00 H new ATOM 0 HA SER A 49 22.642 6.669 13.940 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.796 4.910 15.331 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.213 6.574 15.687 1.00 0.00 H new ATOM 0 HG SER A 49 22.611 4.770 17.200 1.00 0.00 H new ATOM 609 N ASN A 50 20.471 4.720 15.567 1.00 0.00 N ATOM 610 CA ASN A 50 19.588 3.552 15.440 1.00 0.00 C ATOM 611 C ASN A 50 18.374 3.825 14.523 1.00 0.00 C ATOM 612 O ASN A 50 17.901 2.935 13.823 1.00 0.00 O ATOM 613 CB ASN A 50 19.174 3.065 16.837 1.00 0.00 C ATOM 614 CG ASN A 50 20.351 2.494 17.638 1.00 0.00 C ATOM 615 OD1 ASN A 50 21.379 3.135 17.841 1.00 0.00 O ATOM 616 ND2 ASN A 50 20.233 1.280 18.144 1.00 0.00 N ATOM 0 H ASN A 50 20.445 5.146 16.493 1.00 0.00 H new ATOM 0 HA ASN A 50 20.143 2.753 14.948 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.732 3.894 17.390 1.00 0.00 H new ATOM 0 HB3 ASN A 50 18.403 2.301 16.737 1.00 0.00 H new ATOM 0 HD21 ASN A 50 20.992 0.882 18.698 1.00 0.00 H new ATOM 0 HD22 ASN A 50 19.383 0.740 17.981 1.00 0.00 H new ATOM 623 N VAL A 51 17.896 5.071 14.457 1.00 0.00 N ATOM 624 CA VAL A 51 16.925 5.499 13.436 1.00 0.00 C ATOM 625 C VAL A 51 17.542 5.493 12.021 1.00 0.00 C ATOM 626 O VAL A 51 16.831 5.241 11.046 1.00 0.00 O ATOM 627 CB VAL A 51 16.348 6.895 13.778 1.00 0.00 C ATOM 628 CG1 VAL A 51 15.442 7.403 12.652 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.533 6.854 15.089 1.00 0.00 C ATOM 0 H VAL A 51 18.167 5.811 15.105 1.00 0.00 H new ATOM 0 HA VAL A 51 16.108 4.777 13.439 1.00 0.00 H new ATOM 0 HB VAL A 51 17.194 7.571 13.899 1.00 0.00 H new ATOM 0 HG11 VAL A 51 15.049 8.385 12.916 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.016 7.478 11.729 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.615 6.708 12.509 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.140 7.848 15.304 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.706 6.152 14.982 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.177 6.533 15.908 1.00 0.00 H new ATOM 639 N SER A 52 18.852 5.731 11.867 1.00 0.00 N ATOM 640 CA SER A 52 19.458 5.828 10.528 1.00 0.00 C ATOM 641 C SER A 52 19.536 4.491 9.777 1.00 0.00 C ATOM 642 O SER A 52 19.669 4.505 8.549 1.00 0.00 O ATOM 643 CB SER A 52 20.836 6.487 10.541 1.00 0.00 C ATOM 644 OG SER A 52 20.794 7.848 10.942 1.00 0.00 O ATOM 0 H SER A 52 19.506 5.859 12.639 1.00 0.00 H new ATOM 0 HA SER A 52 18.768 6.472 9.982 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.491 5.935 11.215 1.00 0.00 H new ATOM 0 HB3 SER A 52 21.274 6.420 9.545 1.00 0.00 H new ATOM 0 HG SER A 52 20.821 7.902 11.920 1.00 0.00 H new ATOM 650 N ASN A 53 19.379 3.359 10.474 1.00 0.00 N ATOM 651 CA ASN A 53 19.211 2.040 9.858 1.00 0.00 C ATOM 652 C ASN A 53 18.048 2.055 8.856 1.00 0.00 C ATOM 653 O ASN A 53 18.236 1.879 7.650 1.00 0.00 O ATOM 654 CB ASN A 53 18.955 0.997 10.956 1.00 0.00 C ATOM 655 CG ASN A 53 20.096 0.884 11.954 1.00 0.00 C ATOM 656 OD1 ASN A 53 19.894 0.973 13.151 1.00 0.00 O ATOM 657 ND2 ASN A 53 21.308 0.665 11.508 1.00 0.00 N ATOM 0 H ASN A 53 19.365 3.335 11.494 1.00 0.00 H new ATOM 0 HA ASN A 53 20.120 1.781 9.316 1.00 0.00 H new ATOM 0 HB2 ASN A 53 18.040 1.257 11.488 1.00 0.00 H new ATOM 0 HB3 ASN A 53 18.789 0.025 10.492 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.083 0.569 12.164 1.00 0.00 H new ATOM 0 HD22 ASN A 53 21.477 0.591 10.505 1.00 0.00 H new ATOM 664 N HIS A 54 16.846 2.388 9.330 1.00 0.00 N ATOM 665 CA HIS A 54 15.663 2.464 8.479 1.00 0.00 C ATOM 666 C HIS A 54 15.601 3.743 7.609 1.00 0.00 C ATOM 667 O HIS A 54 14.842 3.743 6.641 1.00 0.00 O ATOM 668 CB HIS A 54 14.406 2.255 9.339 1.00 0.00 C ATOM 669 CG HIS A 54 14.141 0.804 9.697 1.00 0.00 C ATOM 670 ND1 HIS A 54 13.703 -0.201 8.852 1.00 0.00 N ATOM 671 CD2 HIS A 54 14.219 0.245 10.947 1.00 0.00 C ATOM 672 CE1 HIS A 54 13.507 -1.310 9.584 1.00 0.00 C ATOM 673 NE2 HIS A 54 13.801 -1.080 10.872 1.00 0.00 N ATOM 0 H HIS A 54 16.668 2.611 10.309 1.00 0.00 H new ATOM 0 HA HIS A 54 15.722 1.659 7.747 1.00 0.00 H new ATOM 0 HB2 HIS A 54 14.506 2.833 10.257 1.00 0.00 H new ATOM 0 HB3 HIS A 54 13.542 2.651 8.805 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.550 0.750 11.842 1.00 0.00 H new ATOM 0 HE1 HIS A 54 13.161 -2.254 9.190 1.00 0.00 H new ATOM 0 HE2 HIS A 54 13.732 -1.744 11.643 1.00 0.00 H new ATOM 681 N LEU A 55 16.394 4.801 7.865 1.00 0.00 N ATOM 682 CA LEU A 55 16.507 5.915 6.904 1.00 0.00 C ATOM 683 C LEU A 55 17.276 5.502 5.649 1.00 0.00 C ATOM 684 O LEU A 55 17.055 6.110 4.606 1.00 0.00 O ATOM 685 CB LEU A 55 17.185 7.173 7.483 1.00 0.00 C ATOM 686 CG LEU A 55 16.391 7.916 8.571 1.00 0.00 C ATOM 687 CD1 LEU A 55 17.274 8.995 9.216 1.00 0.00 C ATOM 688 CD2 LEU A 55 15.163 8.597 7.954 1.00 0.00 C ATOM 0 H LEU A 55 16.955 4.908 8.710 1.00 0.00 H new ATOM 0 HA LEU A 55 15.475 6.164 6.659 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.151 6.885 7.897 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.382 7.866 6.665 1.00 0.00 H new ATOM 0 HG LEU A 55 16.075 7.193 9.323 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.706 9.518 9.986 1.00 0.00 H new ATOM 0 HD12 LEU A 55 18.150 8.527 9.666 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.594 9.707 8.455 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.608 9.120 8.732 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.485 9.311 7.196 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.522 7.845 7.495 1.00 0.00 H new ATOM 700 N SER A 56 18.179 4.523 5.725 1.00 0.00 N ATOM 701 CA SER A 56 19.015 4.159 4.574 1.00 0.00 C ATOM 702 C SER A 56 18.217 3.716 3.338 1.00 0.00 C ATOM 703 O SER A 56 18.453 4.254 2.256 1.00 0.00 O ATOM 704 CB SER A 56 20.052 3.103 4.988 1.00 0.00 C ATOM 705 OG SER A 56 19.501 1.826 5.240 1.00 0.00 O ATOM 0 H SER A 56 18.351 3.970 6.564 1.00 0.00 H new ATOM 0 HA SER A 56 19.532 5.067 4.263 1.00 0.00 H new ATOM 0 HB2 SER A 56 20.801 3.016 4.201 1.00 0.00 H new ATOM 0 HB3 SER A 56 20.569 3.448 5.883 1.00 0.00 H new ATOM 0 HG SER A 56 19.044 1.832 6.107 1.00 0.00 H new ATOM 711 N CYS A 57 17.229 2.828 3.494 1.00 0.00 N ATOM 712 CA CYS A 57 16.321 2.459 2.418 1.00 0.00 C ATOM 713 C CYS A 57 15.314 3.586 2.105 1.00 0.00 C ATOM 714 O CYS A 57 15.061 3.864 0.940 1.00 0.00 O ATOM 715 CB CYS A 57 15.650 1.137 2.795 1.00 0.00 C ATOM 716 SG CYS A 57 14.489 0.541 1.515 1.00 0.00 S ATOM 0 H CYS A 57 17.041 2.348 4.374 1.00 0.00 H new ATOM 0 HA CYS A 57 16.875 2.317 1.490 1.00 0.00 H new ATOM 0 HB2 CYS A 57 16.417 0.381 2.964 1.00 0.00 H new ATOM 0 HB3 CYS A 57 15.113 1.262 3.735 1.00 0.00 H new ATOM 721 N LEU A 58 14.807 4.306 3.118 1.00 0.00 N ATOM 722 CA LEU A 58 13.891 5.446 2.946 1.00 0.00 C ATOM 723 C LEU A 58 14.420 6.473 1.941 1.00 0.00 C ATOM 724 O LEU A 58 13.680 6.912 1.055 1.00 0.00 O ATOM 725 CB LEU A 58 13.690 6.125 4.318 1.00 0.00 C ATOM 726 CG LEU A 58 12.233 6.326 4.746 1.00 0.00 C ATOM 727 CD1 LEU A 58 11.547 4.982 4.928 1.00 0.00 C ATOM 728 CD2 LEU A 58 12.218 7.069 6.081 1.00 0.00 C ATOM 0 H LEU A 58 15.025 4.110 4.095 1.00 0.00 H new ATOM 0 HA LEU A 58 12.948 5.067 2.553 1.00 0.00 H new ATOM 0 HB2 LEU A 58 14.195 5.527 5.077 1.00 0.00 H new ATOM 0 HB3 LEU A 58 14.182 7.097 4.299 1.00 0.00 H new ATOM 0 HG LEU A 58 11.707 6.894 3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.512 5.140 5.232 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.569 4.432 3.987 1.00 0.00 H new ATOM 0 HD13 LEU A 58 12.067 4.409 5.695 1.00 0.00 H new ATOM 0 HD21 LEU A 58 11.187 7.221 6.401 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.748 6.481 6.831 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.708 8.036 5.965 1.00 0.00 H new ATOM 740 N ARG A 59 15.691 6.854 2.124 1.00 0.00 N ATOM 741 CA ARG A 59 16.396 7.864 1.343 1.00 0.00 C ATOM 742 C ARG A 59 17.100 7.298 0.099 1.00 0.00 C ATOM 743 O ARG A 59 17.661 8.083 -0.655 1.00 0.00 O ATOM 744 CB ARG A 59 17.412 8.584 2.233 1.00 0.00 C ATOM 745 CG ARG A 59 16.803 9.244 3.482 1.00 0.00 C ATOM 746 CD ARG A 59 17.790 10.218 4.102 1.00 0.00 C ATOM 747 NE ARG A 59 18.891 9.550 4.811 1.00 0.00 N ATOM 748 CZ ARG A 59 20.143 9.986 4.851 1.00 0.00 C ATOM 749 NH1 ARG A 59 20.594 10.922 4.038 1.00 0.00 N ATOM 750 NH2 ARG A 59 20.977 9.484 5.730 1.00 0.00 N ATOM 0 H ARG A 59 16.276 6.446 2.853 1.00 0.00 H new ATOM 0 HA ARG A 59 15.642 8.562 0.979 1.00 0.00 H new ATOM 0 HB2 ARG A 59 18.172 7.869 2.548 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.918 9.348 1.643 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.886 9.768 3.213 1.00 0.00 H new ATOM 0 HG3 ARG A 59 16.532 8.479 4.210 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.203 10.855 3.320 1.00 0.00 H new ATOM 0 HD3 ARG A 59 17.260 10.870 4.797 1.00 0.00 H new ATOM 0 HE ARG A 59 18.676 8.687 5.310 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.972 11.339 3.345 1.00 0.00 H new ATOM 0 HH12 ARG A 59 21.565 11.229 4.102 1.00 0.00 H new ATOM 0 HH21 ARG A 59 20.662 8.762 6.378 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.941 9.815 5.765 1.00 0.00 H new ATOM 764 N GLY A 60 17.113 5.970 -0.103 1.00 0.00 N ATOM 765 CA GLY A 60 17.665 5.289 -1.288 1.00 0.00 C ATOM 766 C GLY A 60 16.583 4.861 -2.285 1.00 0.00 C ATOM 767 O GLY A 60 16.715 5.031 -3.487 1.00 0.00 O ATOM 0 H GLY A 60 16.726 5.317 0.578 1.00 0.00 H new ATOM 0 HA2 GLY A 60 18.370 5.953 -1.787 1.00 0.00 H new ATOM 0 HA3 GLY A 60 18.226 4.411 -0.968 1.00 0.00 H new ATOM 771 N CYS A 61 15.464 4.341 -1.789 1.00 0.00 N ATOM 772 CA CYS A 61 14.257 4.079 -2.557 1.00 0.00 C ATOM 773 C CYS A 61 13.422 5.356 -2.843 1.00 0.00 C ATOM 774 O CYS A 61 12.265 5.243 -3.260 1.00 0.00 O ATOM 775 CB CYS A 61 13.493 2.957 -1.828 1.00 0.00 C ATOM 776 SG CYS A 61 14.002 1.277 -2.323 1.00 0.00 S ATOM 0 H CYS A 61 15.372 4.082 -0.807 1.00 0.00 H new ATOM 0 HA CYS A 61 14.508 3.741 -3.562 1.00 0.00 H new ATOM 0 HB2 CYS A 61 13.640 3.069 -0.754 1.00 0.00 H new ATOM 0 HB3 CYS A 61 12.426 3.074 -2.018 1.00 0.00 H new ATOM 781 N GLY A 62 13.931 6.558 -2.544 1.00 0.00 N ATOM 782 CA GLY A 62 13.234 7.812 -2.856 1.00 0.00 C ATOM 783 C GLY A 62 11.844 7.929 -2.220 1.00 0.00 C ATOM 784 O GLY A 62 10.939 8.467 -2.851 1.00 0.00 O ATOM 0 H GLY A 62 14.831 6.688 -2.082 1.00 0.00 H new ATOM 0 HA2 GLY A 62 13.847 8.649 -2.521 1.00 0.00 H new ATOM 0 HA3 GLY A 62 13.136 7.901 -3.938 1.00 0.00 H new ATOM 788 N LEU A 63 11.630 7.395 -1.007 1.00 0.00 N ATOM 789 CA LEU A 63 10.407 7.580 -0.216 1.00 0.00 C ATOM 790 C LEU A 63 10.419 8.900 0.557 1.00 0.00 C ATOM 791 O LEU A 63 9.372 9.487 0.839 1.00 0.00 O ATOM 792 CB LEU A 63 10.308 6.400 0.736 1.00 0.00 C ATOM 793 CG LEU A 63 10.479 5.052 0.010 1.00 0.00 C ATOM 794 CD1 LEU A 63 10.188 4.004 1.054 1.00 0.00 C ATOM 795 CD2 LEU A 63 9.546 4.864 -1.187 1.00 0.00 C ATOM 0 H LEU A 63 12.321 6.808 -0.539 1.00 0.00 H new ATOM 0 HA LEU A 63 9.542 7.624 -0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.071 6.494 1.509 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.341 6.420 1.238 1.00 0.00 H new ATOM 0 HG LEU A 63 11.483 4.989 -0.409 1.00 0.00 H new ATOM 0 HD11 LEU A 63 10.289 3.013 0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 63 10.892 4.107 1.879 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.172 4.133 1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 63 9.730 3.891 -1.642 1.00 0.00 H new ATOM 0 HD22 LEU A 63 8.510 4.919 -0.853 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.732 5.649 -1.920 1.00 0.00 H new ATOM 807 N VAL A 64 11.624 9.380 0.844 1.00 0.00 N ATOM 808 CA VAL A 64 11.939 10.642 1.497 1.00 0.00 C ATOM 809 C VAL A 64 13.052 11.340 0.734 1.00 0.00 C ATOM 810 O VAL A 64 13.905 10.685 0.139 1.00 0.00 O ATOM 811 CB VAL A 64 12.397 10.439 2.954 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.190 10.226 3.860 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.324 9.255 3.110 1.00 0.00 C ATOM 0 H VAL A 64 12.467 8.857 0.608 1.00 0.00 H new ATOM 0 HA VAL A 64 11.031 11.244 1.503 1.00 0.00 H new ATOM 0 HB VAL A 64 12.940 11.341 3.237 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.527 10.084 4.887 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.538 11.098 3.809 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.641 9.343 3.533 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.617 9.157 4.155 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.812 8.347 2.790 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.213 9.406 2.497 1.00 0.00 H new ATOM 823 N VAL A 65 13.022 12.666 0.774 1.00 0.00 N ATOM 824 CA VAL A 65 13.948 13.552 0.055 1.00 0.00 C ATOM 825 C VAL A 65 14.543 14.580 1.023 1.00 0.00 C ATOM 826 O VAL A 65 13.827 15.150 1.848 1.00 0.00 O ATOM 827 CB VAL A 65 13.212 14.221 -1.134 1.00 0.00 C ATOM 828 CG1 VAL A 65 13.969 15.401 -1.759 1.00 0.00 C ATOM 829 CG2 VAL A 65 12.940 13.184 -2.241 1.00 0.00 C ATOM 0 H VAL A 65 12.332 13.178 1.324 1.00 0.00 H new ATOM 0 HA VAL A 65 14.777 12.974 -0.354 1.00 0.00 H new ATOM 0 HB VAL A 65 12.286 14.614 -0.714 1.00 0.00 H new ATOM 0 HG11 VAL A 65 13.386 15.812 -2.583 1.00 0.00 H new ATOM 0 HG12 VAL A 65 14.126 16.173 -1.005 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.934 15.057 -2.133 1.00 0.00 H new ATOM 0 HG21 VAL A 65 12.423 13.665 -3.071 1.00 0.00 H new ATOM 0 HG22 VAL A 65 13.885 12.771 -2.593 1.00 0.00 H new ATOM 0 HG23 VAL A 65 12.319 12.381 -1.843 1.00 0.00 H new ATOM 839 N ALA A 66 15.858 14.803 0.927 1.00 0.00 N ATOM 840 CA ALA A 66 16.576 15.869 1.630 1.00 0.00 C ATOM 841 C ALA A 66 16.291 17.263 1.051 1.00 0.00 C ATOM 842 O ALA A 66 16.037 17.441 -0.141 1.00 0.00 O ATOM 843 CB ALA A 66 18.075 15.535 1.619 1.00 0.00 C ATOM 0 H ALA A 66 16.468 14.231 0.342 1.00 0.00 H new ATOM 0 HA ALA A 66 16.218 15.914 2.659 1.00 0.00 H new ATOM 0 HB1 ALA A 66 18.626 16.319 2.139 1.00 0.00 H new ATOM 0 HB2 ALA A 66 18.239 14.582 2.121 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.425 15.467 0.589 1.00 0.00 H new ATOM 849 N THR A 67 16.318 18.276 1.921 1.00 0.00 N ATOM 850 CA THR A 67 16.057 19.696 1.622 1.00 0.00 C ATOM 851 C THR A 67 16.679 20.500 2.755 1.00 0.00 C ATOM 852 O THR A 67 16.929 19.930 3.806 1.00 0.00 O ATOM 853 CB THR A 67 14.543 19.956 1.541 1.00 0.00 C ATOM 854 OG1 THR A 67 13.921 19.076 0.633 1.00 0.00 O ATOM 855 CG2 THR A 67 14.171 21.365 1.077 1.00 0.00 C ATOM 0 H THR A 67 16.533 18.125 2.906 1.00 0.00 H new ATOM 0 HA THR A 67 16.485 19.982 0.661 1.00 0.00 H new ATOM 0 HB THR A 67 14.200 19.810 2.565 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.959 19.263 0.603 1.00 0.00 H new ATOM 0 HG21 THR A 67 13.086 21.464 1.048 1.00 0.00 H new ATOM 0 HG22 THR A 67 14.584 22.097 1.771 1.00 0.00 H new ATOM 0 HG23 THR A 67 14.578 21.539 0.081 1.00 0.00 H new ATOM 863 N TYR A 68 16.908 21.800 2.603 1.00 0.00 N ATOM 864 CA TYR A 68 17.283 22.657 3.741 1.00 0.00 C ATOM 865 C TYR A 68 16.030 23.205 4.454 1.00 0.00 C ATOM 866 O TYR A 68 15.061 23.574 3.789 1.00 0.00 O ATOM 867 CB TYR A 68 18.236 23.775 3.270 1.00 0.00 C ATOM 868 CG TYR A 68 19.482 23.898 4.125 1.00 0.00 C ATOM 869 CD1 TYR A 68 20.346 22.793 4.251 1.00 0.00 C ATOM 870 CD2 TYR A 68 19.776 25.094 4.810 1.00 0.00 C ATOM 871 CE1 TYR A 68 21.474 22.861 5.088 1.00 0.00 C ATOM 872 CE2 TYR A 68 20.906 25.172 5.644 1.00 0.00 C ATOM 873 CZ TYR A 68 21.752 24.050 5.799 1.00 0.00 C ATOM 874 OH TYR A 68 22.818 24.102 6.645 1.00 0.00 O ATOM 0 H TYR A 68 16.843 22.289 1.710 1.00 0.00 H new ATOM 0 HA TYR A 68 17.821 22.060 4.478 1.00 0.00 H new ATOM 0 HB2 TYR A 68 18.529 23.583 2.238 1.00 0.00 H new ATOM 0 HB3 TYR A 68 17.703 24.725 3.278 1.00 0.00 H new ATOM 0 HD1 TYR A 68 20.141 21.887 3.701 1.00 0.00 H new ATOM 0 HD2 TYR A 68 19.132 25.953 4.694 1.00 0.00 H new ATOM 0 HE1 TYR A 68 22.127 22.006 5.187 1.00 0.00 H new ATOM 0 HE2 TYR A 68 21.128 26.091 6.167 1.00 0.00 H new ATOM 0 HH TYR A 68 22.533 24.467 7.509 1.00 0.00 H new ATOM 884 N GLU A 69 16.026 23.242 5.792 1.00 0.00 N ATOM 885 CA GLU A 69 14.988 23.946 6.572 1.00 0.00 C ATOM 886 C GLU A 69 15.266 25.462 6.681 1.00 0.00 C ATOM 887 O GLU A 69 14.333 26.251 6.834 1.00 0.00 O ATOM 888 CB GLU A 69 14.669 23.223 7.907 1.00 0.00 C ATOM 889 CG GLU A 69 15.755 22.792 8.900 1.00 0.00 C ATOM 890 CD GLU A 69 16.371 23.917 9.715 1.00 0.00 C ATOM 891 OE1 GLU A 69 16.918 24.846 9.095 1.00 0.00 O ATOM 892 OE2 GLU A 69 16.482 23.799 10.952 1.00 0.00 O ATOM 0 H GLU A 69 16.736 22.789 6.367 1.00 0.00 H new ATOM 0 HA GLU A 69 14.052 23.893 6.015 1.00 0.00 H new ATOM 0 HB2 GLU A 69 13.987 23.872 8.456 1.00 0.00 H new ATOM 0 HB3 GLU A 69 14.112 22.323 7.647 1.00 0.00 H new ATOM 0 HG2 GLU A 69 15.328 22.060 9.586 1.00 0.00 H new ATOM 0 HG3 GLU A 69 16.549 22.287 8.349 1.00 0.00 H new ATOM 899 N GLY A 70 16.523 25.871 6.463 1.00 0.00 N ATOM 900 CA GLY A 70 16.982 27.261 6.427 1.00 0.00 C ATOM 901 C GLY A 70 18.336 27.441 7.113 1.00 0.00 C ATOM 902 O GLY A 70 19.243 28.037 6.538 1.00 0.00 O ATOM 0 H GLY A 70 17.281 25.208 6.300 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.055 27.591 5.391 1.00 0.00 H new ATOM 0 HA3 GLY A 70 16.243 27.898 6.913 1.00 0.00 H new ATOM 906 N ARG A 71 18.489 26.879 8.313 1.00 0.00 N ATOM 907 CA ARG A 71 19.739 26.774 9.077 1.00 0.00 C ATOM 908 C ARG A 71 20.368 25.372 8.966 1.00 0.00 C ATOM 909 O ARG A 71 21.585 25.227 9.085 1.00 0.00 O ATOM 910 CB ARG A 71 19.422 27.102 10.549 1.00 0.00 C ATOM 911 CG ARG A 71 20.685 27.381 11.383 1.00 0.00 C ATOM 912 CD ARG A 71 20.377 27.599 12.873 1.00 0.00 C ATOM 913 NE ARG A 71 20.497 26.355 13.655 1.00 0.00 N ATOM 914 CZ ARG A 71 20.466 26.237 14.977 1.00 0.00 C ATOM 915 NH1 ARG A 71 20.224 27.259 15.772 1.00 0.00 N ATOM 916 NH2 ARG A 71 20.686 25.059 15.511 1.00 0.00 N ATOM 0 H ARG A 71 17.701 26.461 8.808 1.00 0.00 H new ATOM 0 HA ARG A 71 20.467 27.476 8.670 1.00 0.00 H new ATOM 0 HB2 ARG A 71 18.766 27.971 10.590 1.00 0.00 H new ATOM 0 HB3 ARG A 71 18.876 26.270 10.993 1.00 0.00 H new ATOM 0 HG2 ARG A 71 21.377 26.545 11.278 1.00 0.00 H new ATOM 0 HG3 ARG A 71 21.189 28.263 10.988 1.00 0.00 H new ATOM 0 HD2 ARG A 71 21.059 28.347 13.277 1.00 0.00 H new ATOM 0 HD3 ARG A 71 19.368 27.997 12.979 1.00 0.00 H new ATOM 0 HE ARG A 71 20.617 25.493 13.123 1.00 0.00 H new ATOM 0 HH11 ARG A 71 20.052 28.183 15.376 1.00 0.00 H new ATOM 0 HH12 ARG A 71 20.209 27.126 16.783 1.00 0.00 H new ATOM 0 HH21 ARG A 71 20.876 24.255 14.913 1.00 0.00 H new ATOM 0 HH22 ARG A 71 20.667 24.947 16.525 1.00 0.00 H new ATOM 930 N GLN A 72 19.569 24.325 8.786 1.00 0.00 N ATOM 931 CA GLN A 72 19.952 22.913 8.843 1.00 0.00 C ATOM 932 C GLN A 72 19.400 22.145 7.630 1.00 0.00 C ATOM 933 O GLN A 72 18.565 22.652 6.885 1.00 0.00 O ATOM 934 CB GLN A 72 19.391 22.278 10.138 1.00 0.00 C ATOM 935 CG GLN A 72 19.496 23.074 11.461 1.00 0.00 C ATOM 936 CD GLN A 72 20.885 23.286 12.068 1.00 0.00 C ATOM 937 OE1 GLN A 72 21.048 23.359 13.278 1.00 0.00 O ATOM 938 NE2 GLN A 72 21.943 23.497 11.317 1.00 0.00 N ATOM 0 H GLN A 72 18.576 24.444 8.584 1.00 0.00 H new ATOM 0 HA GLN A 72 21.040 22.852 8.833 1.00 0.00 H new ATOM 0 HB2 GLN A 72 18.337 22.057 9.968 1.00 0.00 H new ATOM 0 HB3 GLN A 72 19.898 21.324 10.285 1.00 0.00 H new ATOM 0 HG2 GLN A 72 19.051 24.055 11.296 1.00 0.00 H new ATOM 0 HG3 GLN A 72 18.881 22.567 12.205 1.00 0.00 H new ATOM 0 HE21 GLN A 72 21.865 23.449 10.301 1.00 0.00 H new ATOM 0 HE22 GLN A 72 22.842 23.709 11.750 1.00 0.00 H new ATOM 947 N VAL A 73 19.825 20.889 7.462 1.00 0.00 N ATOM 948 CA VAL A 73 19.238 19.943 6.499 1.00 0.00 C ATOM 949 C VAL A 73 18.062 19.213 7.154 1.00 0.00 C ATOM 950 O VAL A 73 18.120 18.889 8.343 1.00 0.00 O ATOM 951 CB VAL A 73 20.304 18.961 5.951 1.00 0.00 C ATOM 952 CG1 VAL A 73 20.876 18.020 7.027 1.00 0.00 C ATOM 953 CG2 VAL A 73 19.790 18.132 4.763 1.00 0.00 C ATOM 0 H VAL A 73 20.597 20.492 7.997 1.00 0.00 H new ATOM 0 HA VAL A 73 18.861 20.496 5.638 1.00 0.00 H new ATOM 0 HB VAL A 73 21.113 19.603 5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 73 21.616 17.359 6.576 1.00 0.00 H new ATOM 0 HG12 VAL A 73 21.347 18.610 7.813 1.00 0.00 H new ATOM 0 HG13 VAL A 73 20.070 17.424 7.455 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.578 17.461 4.419 1.00 0.00 H new ATOM 0 HG22 VAL A 73 18.925 17.546 5.075 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.502 18.800 3.951 1.00 0.00 H new ATOM 963 N ARG A 74 17.023 18.924 6.367 1.00 0.00 N ATOM 964 CA ARG A 74 15.813 18.213 6.763 1.00 0.00 C ATOM 965 C ARG A 74 15.546 17.073 5.791 1.00 0.00 C ATOM 966 O ARG A 74 16.181 16.948 4.746 1.00 0.00 O ATOM 967 CB ARG A 74 14.591 19.154 6.809 1.00 0.00 C ATOM 968 CG ARG A 74 13.900 19.504 5.473 1.00 0.00 C ATOM 969 CD ARG A 74 12.607 20.298 5.677 1.00 0.00 C ATOM 970 NE ARG A 74 12.066 20.788 4.391 1.00 0.00 N ATOM 971 CZ ARG A 74 10.854 20.568 3.889 1.00 0.00 C ATOM 972 NH1 ARG A 74 9.945 19.855 4.525 1.00 0.00 N ATOM 973 NH2 ARG A 74 10.533 21.083 2.721 1.00 0.00 N ATOM 0 H ARG A 74 17.006 19.196 5.384 1.00 0.00 H new ATOM 0 HA ARG A 74 15.970 17.816 7.766 1.00 0.00 H new ATOM 0 HB2 ARG A 74 13.845 18.703 7.463 1.00 0.00 H new ATOM 0 HB3 ARG A 74 14.904 20.087 7.278 1.00 0.00 H new ATOM 0 HG2 ARG A 74 14.585 20.083 4.853 1.00 0.00 H new ATOM 0 HG3 ARG A 74 13.678 18.585 4.930 1.00 0.00 H new ATOM 0 HD2 ARG A 74 11.866 19.669 6.169 1.00 0.00 H new ATOM 0 HD3 ARG A 74 12.798 21.143 6.339 1.00 0.00 H new ATOM 0 HE ARG A 74 12.693 21.359 3.825 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.160 19.449 5.436 1.00 0.00 H new ATOM 0 HH12 ARG A 74 9.026 19.709 4.106 1.00 0.00 H new ATOM 0 HH21 ARG A 74 11.212 21.646 2.208 1.00 0.00 H new ATOM 0 HH22 ARG A 74 9.606 20.919 2.329 1.00 0.00 H new ATOM 987 N TYR A 75 14.539 16.278 6.113 1.00 0.00 N ATOM 988 CA TYR A 75 13.931 15.310 5.206 1.00 0.00 C ATOM 989 C TYR A 75 12.455 15.695 4.973 1.00 0.00 C ATOM 990 O TYR A 75 11.938 16.580 5.653 1.00 0.00 O ATOM 991 CB TYR A 75 14.128 13.911 5.807 1.00 0.00 C ATOM 992 CG TYR A 75 15.580 13.504 6.026 1.00 0.00 C ATOM 993 CD1 TYR A 75 16.558 13.769 5.045 1.00 0.00 C ATOM 994 CD2 TYR A 75 15.959 12.872 7.226 1.00 0.00 C ATOM 995 CE1 TYR A 75 17.911 13.467 5.280 1.00 0.00 C ATOM 996 CE2 TYR A 75 17.307 12.534 7.456 1.00 0.00 C ATOM 997 CZ TYR A 75 18.289 12.849 6.491 1.00 0.00 C ATOM 998 OH TYR A 75 19.597 12.556 6.722 1.00 0.00 O ATOM 0 H TYR A 75 14.108 16.286 7.037 1.00 0.00 H new ATOM 0 HA TYR A 75 14.401 15.308 4.222 1.00 0.00 H new ATOM 0 HB2 TYR A 75 13.605 13.865 6.762 1.00 0.00 H new ATOM 0 HB3 TYR A 75 13.656 13.180 5.150 1.00 0.00 H new ATOM 0 HD1 TYR A 75 16.265 14.209 4.103 1.00 0.00 H new ATOM 0 HD2 TYR A 75 15.213 12.645 7.973 1.00 0.00 H new ATOM 0 HE1 TYR A 75 18.657 13.707 4.537 1.00 0.00 H new ATOM 0 HE2 TYR A 75 17.590 12.034 8.371 1.00 0.00 H new ATOM 0 HH TYR A 75 19.687 12.134 7.602 1.00 0.00 H new ATOM 1008 N ALA A 76 11.774 15.045 4.031 1.00 0.00 N ATOM 1009 CA ALA A 76 10.355 15.227 3.697 1.00 0.00 C ATOM 1010 C ALA A 76 9.882 14.046 2.835 1.00 0.00 C ATOM 1011 O ALA A 76 10.724 13.443 2.172 1.00 0.00 O ATOM 1012 CB ALA A 76 10.175 16.559 2.952 1.00 0.00 C ATOM 0 H ALA A 76 12.218 14.337 3.446 1.00 0.00 H new ATOM 0 HA ALA A 76 9.754 15.255 4.606 1.00 0.00 H new ATOM 0 HB1 ALA A 76 9.123 16.697 2.703 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.508 17.379 3.588 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.766 16.547 2.036 1.00 0.00 H new ATOM 1018 N LEU A 77 8.580 13.717 2.828 1.00 0.00 N ATOM 1019 CA LEU A 77 7.991 12.734 1.904 1.00 0.00 C ATOM 1020 C LEU A 77 8.252 13.106 0.439 1.00 0.00 C ATOM 1021 O LEU A 77 8.195 14.279 0.078 1.00 0.00 O ATOM 1022 CB LEU A 77 6.476 12.611 2.164 1.00 0.00 C ATOM 1023 CG LEU A 77 6.036 11.152 2.178 1.00 0.00 C ATOM 1024 CD1 LEU A 77 6.510 10.385 3.410 1.00 0.00 C ATOM 1025 CD2 LEU A 77 4.522 11.176 2.194 1.00 0.00 C ATOM 0 H LEU A 77 7.901 14.129 3.468 1.00 0.00 H new ATOM 0 HA LEU A 77 8.469 11.772 2.088 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.229 13.077 3.118 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.927 13.152 1.393 1.00 0.00 H new ATOM 0 HG LEU A 77 6.465 10.648 1.312 1.00 0.00 H new ATOM 0 HD11 LEU A 77 6.161 9.354 3.353 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.599 10.398 3.450 1.00 0.00 H new ATOM 0 HD13 LEU A 77 6.109 10.855 4.308 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.142 10.154 2.205 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.176 11.701 3.084 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.157 11.690 1.305 1.00 0.00 H new ATOM 1037 N ALA A 78 8.503 12.107 -0.413 1.00 0.00 N ATOM 1038 CA ALA A 78 8.993 12.328 -1.778 1.00 0.00 C ATOM 1039 C ALA A 78 7.922 12.651 -2.844 1.00 0.00 C ATOM 1040 O ALA A 78 8.246 12.596 -4.027 1.00 0.00 O ATOM 1041 CB ALA A 78 9.812 11.094 -2.158 1.00 0.00 C ATOM 0 H ALA A 78 8.373 11.123 -0.177 1.00 0.00 H new ATOM 0 HA ALA A 78 9.591 13.239 -1.768 1.00 0.00 H new ATOM 0 HB1 ALA A 78 10.199 11.212 -3.170 1.00 0.00 H new ATOM 0 HB2 ALA A 78 10.643 10.981 -1.462 1.00 0.00 H new ATOM 0 HB3 ALA A 78 9.178 10.209 -2.113 1.00 0.00 H new ATOM 1047 N ASP A 79 6.675 12.937 -2.445 1.00 0.00 N ATOM 1048 CA ASP A 79 5.493 13.272 -3.271 1.00 0.00 C ATOM 1049 C ASP A 79 4.201 13.179 -2.442 1.00 0.00 C ATOM 1050 O ASP A 79 4.024 12.302 -1.594 1.00 0.00 O ATOM 1051 CB ASP A 79 5.409 12.409 -4.559 1.00 0.00 C ATOM 1052 CG ASP A 79 4.175 12.492 -5.468 1.00 0.00 C ATOM 1053 OD1 ASP A 79 3.321 13.399 -5.349 1.00 0.00 O ATOM 1054 OD2 ASP A 79 4.093 11.551 -6.291 1.00 0.00 O ATOM 0 H ASP A 79 6.441 12.942 -1.452 1.00 0.00 H new ATOM 0 HA ASP A 79 5.610 14.305 -3.599 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.277 12.656 -5.170 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.518 11.367 -4.257 1.00 0.00 H new ATOM 1059 N SER A 80 3.274 14.077 -2.760 1.00 0.00 N ATOM 1060 CA SER A 80 1.866 14.077 -2.343 1.00 0.00 C ATOM 1061 C SER A 80 1.171 12.708 -2.476 1.00 0.00 C ATOM 1062 O SER A 80 0.282 12.386 -1.685 1.00 0.00 O ATOM 1063 CB SER A 80 1.123 15.085 -3.235 1.00 0.00 C ATOM 1064 OG SER A 80 1.029 14.646 -4.586 1.00 0.00 O ATOM 0 H SER A 80 3.495 14.877 -3.353 1.00 0.00 H new ATOM 0 HA SER A 80 1.839 14.336 -1.285 1.00 0.00 H new ATOM 0 HB2 SER A 80 0.121 15.248 -2.838 1.00 0.00 H new ATOM 0 HB3 SER A 80 1.639 16.045 -3.202 1.00 0.00 H new ATOM 0 HG SER A 80 1.863 14.201 -4.844 1.00 0.00 H new ATOM 1070 N HIS A 81 1.597 11.879 -3.440 1.00 0.00 N ATOM 1071 CA HIS A 81 1.113 10.516 -3.617 1.00 0.00 C ATOM 1072 C HIS A 81 1.409 9.626 -2.418 1.00 0.00 C ATOM 1073 O HIS A 81 0.495 8.949 -1.952 1.00 0.00 O ATOM 1074 CB HIS A 81 1.743 9.877 -4.860 1.00 0.00 C ATOM 1075 CG HIS A 81 1.052 10.176 -6.160 1.00 0.00 C ATOM 1076 ND1 HIS A 81 -0.304 10.322 -6.327 1.00 0.00 N ATOM 1077 CD2 HIS A 81 1.579 9.894 -7.383 1.00 0.00 C ATOM 1078 CE1 HIS A 81 -0.620 10.017 -7.592 1.00 0.00 C ATOM 1079 NE2 HIS A 81 0.526 9.825 -8.284 1.00 0.00 N ATOM 0 H HIS A 81 2.301 12.149 -4.127 1.00 0.00 H new ATOM 0 HA HIS A 81 0.032 10.592 -3.730 1.00 0.00 H new ATOM 0 HB2 HIS A 81 2.778 10.210 -4.934 1.00 0.00 H new ATOM 0 HB3 HIS A 81 1.765 8.796 -4.720 1.00 0.00 H new ATOM 0 HD1 HIS A 81 -0.962 10.615 -5.605 1.00 0.00 H new ATOM 0 HD2 HIS A 81 2.625 9.750 -7.610 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.620 9.938 -7.992 1.00 0.00 H new ATOM 1088 N LEU A 82 2.653 9.596 -1.919 1.00 0.00 N ATOM 1089 CA LEU A 82 2.941 8.812 -0.714 1.00 0.00 C ATOM 1090 C LEU A 82 2.094 9.366 0.427 1.00 0.00 C ATOM 1091 O LEU A 82 1.461 8.583 1.121 1.00 0.00 O ATOM 1092 CB LEU A 82 4.438 8.804 -0.345 1.00 0.00 C ATOM 1093 CG LEU A 82 5.413 8.343 -1.437 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.837 8.293 -0.882 1.00 0.00 C ATOM 1095 CD2 LEU A 82 5.053 6.984 -2.047 1.00 0.00 C ATOM 0 H LEU A 82 3.452 10.089 -2.317 1.00 0.00 H new ATOM 0 HA LEU A 82 2.685 7.770 -0.907 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.719 9.812 -0.041 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.571 8.160 0.524 1.00 0.00 H new ATOM 0 HG LEU A 82 5.341 9.077 -2.239 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.521 7.965 -1.664 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.128 9.285 -0.538 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.878 7.593 -0.047 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.785 6.723 -2.811 1.00 0.00 H new ATOM 0 HD22 LEU A 82 5.055 6.223 -1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.062 7.039 -2.498 1.00 0.00 H new ATOM 1107 N ALA A 83 2.002 10.700 0.542 1.00 0.00 N ATOM 1108 CA ALA A 83 1.334 11.396 1.644 1.00 0.00 C ATOM 1109 C ALA A 83 -0.129 10.950 1.805 1.00 0.00 C ATOM 1110 O ALA A 83 -0.597 10.859 2.934 1.00 0.00 O ATOM 1111 CB ALA A 83 1.439 12.916 1.433 1.00 0.00 C ATOM 0 H ALA A 83 2.401 11.337 -0.148 1.00 0.00 H new ATOM 0 HA ALA A 83 1.839 11.132 2.573 1.00 0.00 H new ATOM 0 HB1 ALA A 83 0.941 13.433 2.254 1.00 0.00 H new ATOM 0 HB2 ALA A 83 2.489 13.208 1.404 1.00 0.00 H new ATOM 0 HB3 ALA A 83 0.961 13.186 0.491 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.825 10.625 0.704 1.00 0.00 N ATOM 1118 CA ARG A 84 -2.209 10.130 0.712 1.00 0.00 C ATOM 1119 C ARG A 84 -2.335 8.697 1.241 1.00 0.00 C ATOM 1120 O ARG A 84 -2.971 8.518 2.275 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.795 10.201 -0.703 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.223 11.609 -1.141 1.00 0.00 C ATOM 1123 CD ARG A 84 -3.479 11.593 -2.654 1.00 0.00 C ATOM 1124 NE ARG A 84 -4.560 12.508 -3.070 1.00 0.00 N ATOM 1125 CZ ARG A 84 -5.742 12.131 -3.559 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -6.126 10.874 -3.635 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -6.585 13.046 -3.992 1.00 0.00 N ATOM 0 H ARG A 84 -0.433 10.701 -0.235 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.766 10.774 1.393 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -2.056 9.823 -1.409 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -3.658 9.538 -0.760 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -4.124 11.914 -0.608 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -2.447 12.334 -0.896 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -2.561 11.865 -3.174 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -3.731 10.579 -2.963 1.00 0.00 H new ATOM 0 HE ARG A 84 -4.389 13.509 -2.976 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -5.507 10.131 -3.310 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -7.042 10.643 -4.019 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -6.331 14.033 -3.952 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -7.491 12.767 -4.368 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.710 7.692 0.621 1.00 0.00 N ATOM 1142 CA ALA A 85 -1.794 6.293 1.078 1.00 0.00 C ATOM 1143 C ALA A 85 -1.227 6.100 2.503 1.00 0.00 C ATOM 1144 O ALA A 85 -1.746 5.320 3.310 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.063 5.424 0.047 1.00 0.00 C ATOM 0 H ALA A 85 -1.132 7.820 -0.210 1.00 0.00 H new ATOM 0 HA ALA A 85 -2.840 5.994 1.148 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.106 4.379 0.356 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.541 5.535 -0.926 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.022 5.739 -0.022 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.183 6.871 2.823 1.00 0.00 N ATOM 1152 CA LEU A 86 0.375 7.034 4.160 1.00 0.00 C ATOM 1153 C LEU A 86 -0.663 7.658 5.114 1.00 0.00 C ATOM 1154 O LEU A 86 -0.898 7.098 6.179 1.00 0.00 O ATOM 1155 CB LEU A 86 1.629 7.910 4.000 1.00 0.00 C ATOM 1156 CG LEU A 86 2.362 8.269 5.290 1.00 0.00 C ATOM 1157 CD1 LEU A 86 2.956 7.131 6.104 1.00 0.00 C ATOM 1158 CD2 LEU A 86 3.480 9.246 4.928 1.00 0.00 C ATOM 0 H LEU A 86 0.315 7.421 2.123 1.00 0.00 H new ATOM 0 HA LEU A 86 0.642 6.076 4.607 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.327 7.394 3.340 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.341 8.834 3.499 1.00 0.00 H new ATOM 0 HG LEU A 86 1.594 8.681 5.944 1.00 0.00 H new ATOM 0 HD11 LEU A 86 3.445 7.534 6.991 1.00 0.00 H new ATOM 0 HD12 LEU A 86 2.163 6.447 6.406 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.687 6.594 5.499 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.026 9.524 5.829 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.162 8.773 4.222 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.050 10.139 4.474 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.310 8.764 4.721 1.00 0.00 N ATOM 1171 CA GLY A 87 -2.274 9.548 5.515 1.00 0.00 C ATOM 1172 C GLY A 87 -3.590 8.815 5.795 1.00 0.00 C ATOM 1173 O GLY A 87 -4.084 8.833 6.919 1.00 0.00 O ATOM 0 H GLY A 87 -1.169 9.159 3.791 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.812 9.820 6.464 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -2.492 10.477 4.989 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.092 8.090 4.797 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.195 7.121 4.855 1.00 0.00 C ATOM 1179 C GLU A 88 -4.864 5.889 5.737 1.00 0.00 C ATOM 1180 O GLU A 88 -5.708 5.031 6.030 1.00 0.00 O ATOM 1181 CB GLU A 88 -5.443 6.748 3.386 1.00 0.00 C ATOM 1182 CG GLU A 88 -6.533 5.726 3.102 1.00 0.00 C ATOM 1183 CD GLU A 88 -7.928 6.131 3.586 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -8.188 7.318 3.876 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -8.798 5.230 3.642 1.00 0.00 O ATOM 0 H GLU A 88 -3.712 8.168 3.853 1.00 0.00 H new ATOM 0 HA GLU A 88 -6.084 7.539 5.328 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.686 7.661 2.842 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.509 6.369 2.971 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -6.573 5.546 2.028 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.259 4.782 3.573 1.00 0.00 H new ATOM 1192 N LEU A 89 -3.597 5.805 6.161 1.00 0.00 N ATOM 1193 CA LEU A 89 -3.021 4.895 7.158 1.00 0.00 C ATOM 1194 C LEU A 89 -3.037 3.453 6.644 1.00 0.00 C ATOM 1195 O LEU A 89 -3.339 2.507 7.373 1.00 0.00 O ATOM 1196 CB LEU A 89 -3.708 5.084 8.527 1.00 0.00 C ATOM 1197 CG LEU A 89 -2.852 4.498 9.671 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -1.747 5.473 10.107 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -3.736 4.135 10.872 1.00 0.00 C ATOM 0 H LEU A 89 -2.885 6.429 5.780 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.971 5.142 7.316 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.880 6.145 8.706 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.684 4.600 8.516 1.00 0.00 H new ATOM 0 HG LEU A 89 -2.374 3.594 9.293 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.165 5.027 10.913 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.093 5.683 9.261 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -2.198 6.402 10.456 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -3.116 3.724 11.669 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -4.245 5.029 11.233 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.476 3.394 10.569 1.00 0.00 H new ATOM 1211 N VAL A 90 -2.806 3.312 5.340 1.00 0.00 N ATOM 1212 CA VAL A 90 -2.945 2.153 4.446 1.00 0.00 C ATOM 1213 C VAL A 90 -4.266 1.364 4.510 1.00 0.00 C ATOM 1214 O VAL A 90 -4.523 0.535 3.638 1.00 0.00 O ATOM 1215 CB VAL A 90 -1.798 1.136 4.543 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -0.496 1.532 3.855 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -1.490 0.662 5.972 1.00 0.00 C ATOM 0 H VAL A 90 -2.471 4.117 4.810 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.923 2.672 3.488 1.00 0.00 H new ATOM 0 HB VAL A 90 -2.216 0.303 3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.241 0.740 3.988 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.678 1.683 2.791 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.119 2.456 4.293 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -0.668 -0.054 5.949 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.209 1.517 6.586 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -2.374 0.185 6.396 1.00 0.00 H new ATOM 1227 N GLN A 91 -5.049 1.515 5.579 1.00 0.00 N ATOM 1228 CA GLN A 91 -6.272 0.808 5.903 1.00 0.00 C ATOM 1229 C GLN A 91 -6.062 -0.672 6.279 1.00 0.00 C ATOM 1230 O GLN A 91 -6.979 -1.293 6.784 1.00 0.00 O ATOM 1231 CB GLN A 91 -7.277 0.999 4.778 1.00 0.00 C ATOM 1232 CG GLN A 91 -7.801 2.438 4.634 1.00 0.00 C ATOM 1233 CD GLN A 91 -8.703 2.979 5.740 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -9.883 2.666 5.826 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -8.191 3.753 6.675 1.00 0.00 N ATOM 0 H GLN A 91 -4.815 2.198 6.299 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.676 1.247 6.815 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -6.814 0.698 3.838 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.123 0.332 4.945 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -6.940 3.101 4.549 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -8.348 2.503 3.693 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -7.210 4.029 6.628 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -8.775 4.076 7.446 1.00 0.00 H new ATOM 1244 N VAL A 92 -4.858 -1.229 6.143 1.00 0.00 N ATOM 1245 CA VAL A 92 -4.441 -2.588 6.640 1.00 0.00 C ATOM 1246 C VAL A 92 -4.408 -2.722 8.155 1.00 0.00 C ATOM 1247 O VAL A 92 -4.282 -3.803 8.723 1.00 0.00 O ATOM 1248 CB VAL A 92 -3.081 -3.065 6.059 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -2.850 -2.395 4.722 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -1.862 -2.756 6.950 1.00 0.00 C ATOM 0 H VAL A 92 -4.098 -0.744 5.667 1.00 0.00 H new ATOM 0 HA VAL A 92 -5.234 -3.237 6.267 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.159 -4.149 5.981 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.897 -2.726 4.309 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.655 -2.663 4.037 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.832 -1.313 4.855 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.956 -3.123 6.468 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.783 -1.679 7.098 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -1.983 -3.247 7.916 1.00 0.00 H new ATOM 1260 N VAL A 93 -4.540 -1.562 8.764 1.00 0.00 N ATOM 1261 CA VAL A 93 -4.789 -1.270 10.150 1.00 0.00 C ATOM 1262 C VAL A 93 -3.534 -1.369 11.021 1.00 0.00 C ATOM 1263 O VAL A 93 -3.579 -1.942 12.104 1.00 0.00 O ATOM 1264 CB VAL A 93 -5.992 -2.047 10.767 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -6.667 -1.097 11.757 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -7.109 -2.442 9.792 1.00 0.00 C ATOM 0 H VAL A 93 -4.465 -0.699 8.226 1.00 0.00 H new ATOM 0 HA VAL A 93 -5.092 -0.223 10.149 1.00 0.00 H new ATOM 0 HB VAL A 93 -5.568 -2.965 11.175 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -7.519 -1.597 12.218 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -5.954 -0.810 12.530 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.010 -0.206 11.230 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -7.891 -2.976 10.332 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -7.530 -1.545 9.338 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -6.701 -3.086 9.013 1.00 0.00 H new ATOM 1276 N LEU A 94 -2.414 -0.839 10.503 1.00 0.00 N ATOM 1277 CA LEU A 94 -1.058 -1.039 11.049 1.00 0.00 C ATOM 1278 C LEU A 94 -0.546 -2.429 10.629 1.00 0.00 C ATOM 1279 O LEU A 94 -0.800 -3.463 11.245 1.00 0.00 O ATOM 1280 CB LEU A 94 -0.963 -0.790 12.577 1.00 0.00 C ATOM 1281 CG LEU A 94 0.449 -0.456 13.110 1.00 0.00 C ATOM 1282 CD1 LEU A 94 0.348 -0.140 14.610 1.00 0.00 C ATOM 1283 CD2 LEU A 94 1.483 -1.574 12.897 1.00 0.00 C ATOM 0 H LEU A 94 -2.425 -0.245 9.674 1.00 0.00 H new ATOM 0 HA LEU A 94 -0.402 -0.281 10.621 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -1.633 0.029 12.836 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.328 -1.677 13.095 1.00 0.00 H new ATOM 0 HG LEU A 94 0.805 0.400 12.537 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.338 0.098 14.999 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.315 0.713 14.758 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.051 -1.006 15.138 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.446 -1.260 13.299 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.153 -2.477 13.410 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.584 -1.778 11.831 1.00 0.00 H new ATOM 1295 N ALA A 95 0.212 -2.406 9.539 1.00 0.00 N ATOM 1296 CA ALA A 95 1.024 -3.477 8.981 1.00 0.00 C ATOM 1297 C ALA A 95 1.976 -4.208 9.970 1.00 0.00 C ATOM 1298 O ALA A 95 3.185 -4.032 9.859 1.00 0.00 O ATOM 1299 CB ALA A 95 1.800 -2.815 7.822 1.00 0.00 C ATOM 0 H ALA A 95 0.279 -1.560 8.973 1.00 0.00 H new ATOM 0 HA ALA A 95 0.371 -4.291 8.666 1.00 0.00 H new ATOM 0 HB1 ALA A 95 2.441 -3.556 7.343 1.00 0.00 H new ATOM 0 HB2 ALA A 95 1.095 -2.419 7.092 1.00 0.00 H new ATOM 0 HB3 ALA A 95 2.413 -2.003 8.212 1.00 0.00 H new ATOM 1305 N VAL A 96 1.460 -5.016 10.907 1.00 0.00 N ATOM 1306 CA VAL A 96 2.307 -5.977 11.656 1.00 0.00 C ATOM 1307 C VAL A 96 2.938 -6.884 10.613 1.00 0.00 C ATOM 1308 O VAL A 96 2.208 -7.410 9.765 1.00 0.00 O ATOM 1309 CB VAL A 96 1.554 -6.919 12.628 1.00 0.00 C ATOM 1310 CG1 VAL A 96 2.454 -7.972 13.311 1.00 0.00 C ATOM 1311 CG2 VAL A 96 0.860 -6.157 13.750 1.00 0.00 C ATOM 0 H VAL A 96 0.474 -5.030 11.168 1.00 0.00 H new ATOM 0 HA VAL A 96 2.993 -5.381 12.258 1.00 0.00 H new ATOM 0 HB VAL A 96 0.834 -7.420 11.981 1.00 0.00 H new ATOM 0 HG11 VAL A 96 1.850 -8.591 13.975 1.00 0.00 H new ATOM 0 HG12 VAL A 96 2.919 -8.601 12.552 1.00 0.00 H new ATOM 0 HG13 VAL A 96 3.229 -7.468 13.889 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.346 -6.861 14.405 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.601 -5.601 14.325 1.00 0.00 H new ATOM 0 HG23 VAL A 96 0.136 -5.463 13.324 1.00 0.00 H new ATOM 1321 N ASP A 97 4.257 -7.081 10.686 1.00 0.00 N ATOM 1322 CA ASP A 97 4.960 -7.927 9.723 1.00 0.00 C ATOM 1323 C ASP A 97 4.457 -9.375 9.745 1.00 0.00 C ATOM 1324 O ASP A 97 3.638 -9.766 8.907 1.00 0.00 O ATOM 1325 CB ASP A 97 6.482 -7.804 9.857 1.00 0.00 C ATOM 1326 CG ASP A 97 7.181 -8.679 8.808 1.00 0.00 C ATOM 1327 OD1 ASP A 97 6.839 -8.578 7.607 1.00 0.00 O ATOM 1328 OD2 ASP A 97 8.034 -9.500 9.207 1.00 0.00 O ATOM 0 H ASP A 97 4.856 -6.667 11.400 1.00 0.00 H new ATOM 0 HA ASP A 97 4.719 -7.553 8.728 1.00 0.00 H new ATOM 0 HB2 ASP A 97 6.782 -6.764 9.731 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.792 -8.106 10.857 1.00 0.00 H new ATOM 1333 N THR A 98 4.947 -10.139 10.729 1.00 0.00 N ATOM 1334 CA THR A 98 4.842 -11.599 10.904 1.00 0.00 C ATOM 1335 C THR A 98 5.626 -12.290 9.777 1.00 0.00 C ATOM 1336 O THR A 98 5.396 -11.968 8.612 1.00 0.00 O ATOM 1337 CB THR A 98 3.410 -12.156 10.969 1.00 0.00 C ATOM 1338 OG1 THR A 98 2.851 -12.290 9.697 1.00 0.00 O ATOM 1339 CG2 THR A 98 2.442 -11.315 11.795 1.00 0.00 C ATOM 0 H THR A 98 5.475 -9.717 11.493 1.00 0.00 H new ATOM 0 HA THR A 98 5.266 -11.815 11.885 1.00 0.00 H new ATOM 0 HB THR A 98 3.533 -13.123 11.456 1.00 0.00 H new ATOM 0 HG1 THR A 98 3.099 -11.518 9.147 1.00 0.00 H new ATOM 0 HG21 THR A 98 1.457 -11.781 11.787 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.803 -11.248 12.821 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.374 -10.314 11.368 1.00 0.00 H new ATOM 1347 N ASP A 99 6.479 -13.285 10.042 1.00 0.00 N ATOM 1348 CA ASP A 99 7.196 -13.944 8.946 1.00 0.00 C ATOM 1349 C ASP A 99 6.332 -15.046 8.346 1.00 0.00 C ATOM 1350 O ASP A 99 6.375 -16.218 8.722 1.00 0.00 O ATOM 1351 CB ASP A 99 8.631 -14.381 9.266 1.00 0.00 C ATOM 1352 CG ASP A 99 9.369 -14.653 7.939 1.00 0.00 C ATOM 1353 OD1 ASP A 99 9.414 -13.719 7.099 1.00 0.00 O ATOM 1354 OD2 ASP A 99 9.838 -15.793 7.740 1.00 0.00 O ATOM 0 H ASP A 99 6.686 -13.643 10.975 1.00 0.00 H new ATOM 0 HA ASP A 99 7.360 -13.184 8.182 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.145 -13.605 9.833 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.624 -15.277 9.886 1.00 0.00 H new ATOM 1359 N GLN A 100 5.462 -14.618 7.440 1.00 0.00 N ATOM 1360 CA GLN A 100 4.577 -15.490 6.693 1.00 0.00 C ATOM 1361 C GLN A 100 4.612 -15.108 5.190 1.00 0.00 C ATOM 1362 O GLN A 100 4.877 -13.946 4.861 1.00 0.00 O ATOM 1363 CB GLN A 100 3.153 -15.451 7.306 1.00 0.00 C ATOM 1364 CG GLN A 100 2.719 -16.764 8.000 1.00 0.00 C ATOM 1365 CD GLN A 100 2.783 -16.776 9.540 1.00 0.00 C ATOM 1366 OE1 GLN A 100 1.807 -17.088 10.221 1.00 0.00 O ATOM 1367 NE2 GLN A 100 3.912 -16.502 10.156 1.00 0.00 N ATOM 0 H GLN A 100 5.353 -13.632 7.202 1.00 0.00 H new ATOM 0 HA GLN A 100 4.915 -16.524 6.762 1.00 0.00 H new ATOM 0 HB2 GLN A 100 3.105 -14.638 8.031 1.00 0.00 H new ATOM 0 HB3 GLN A 100 2.438 -15.218 6.517 1.00 0.00 H new ATOM 0 HG2 GLN A 100 1.696 -16.988 7.698 1.00 0.00 H new ATOM 0 HG3 GLN A 100 3.346 -17.573 7.625 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.737 -16.241 9.616 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.963 -16.551 11.174 1.00 0.00 H new ATOM 1376 N PRO A 101 4.376 -16.062 4.268 1.00 0.00 N ATOM 1377 CA PRO A 101 4.264 -15.805 2.834 1.00 0.00 C ATOM 1378 C PRO A 101 2.807 -15.415 2.528 1.00 0.00 C ATOM 1379 O PRO A 101 2.404 -14.284 2.791 1.00 0.00 O ATOM 1380 CB PRO A 101 4.755 -17.110 2.190 1.00 0.00 C ATOM 1381 CG PRO A 101 4.289 -18.196 3.167 1.00 0.00 C ATOM 1382 CD PRO A 101 4.294 -17.496 4.528 1.00 0.00 C ATOM 0 HA PRO A 101 4.855 -14.976 2.444 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.326 -17.253 1.198 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.839 -17.115 2.073 1.00 0.00 H new ATOM 0 HG2 PRO A 101 3.295 -18.564 2.911 1.00 0.00 H new ATOM 0 HG3 PRO A 101 4.959 -19.056 3.158 1.00 0.00 H new ATOM 0 HD2 PRO A 101 3.390 -17.736 5.089 1.00 0.00 H new ATOM 0 HD3 PRO A 101 5.140 -17.828 5.130 1.00 0.00 H new ATOM 1390 N CYS A 102 2.016 -16.342 1.980 1.00 0.00 N ATOM 1391 CA CYS A 102 0.574 -16.238 1.919 1.00 0.00 C ATOM 1392 C CYS A 102 -0.010 -16.279 3.337 1.00 0.00 C ATOM 1393 O CYS A 102 0.457 -16.974 4.246 1.00 0.00 O ATOM 1394 CB CYS A 102 0.085 -17.379 1.015 1.00 0.00 C ATOM 1395 SG CYS A 102 -1.721 -17.583 0.915 1.00 0.00 S ATOM 0 H CYS A 102 2.377 -17.199 1.561 1.00 0.00 H new ATOM 0 HA CYS A 102 0.240 -15.292 1.494 1.00 0.00 H new ATOM 0 HB2 CYS A 102 0.470 -17.212 0.009 1.00 0.00 H new ATOM 0 HB3 CYS A 102 0.519 -18.313 1.372 1.00 0.00 H new ATOM 1400 N VAL A 103 -1.027 -15.446 3.494 1.00 0.00 N ATOM 1401 CA VAL A 103 -1.649 -15.143 4.772 1.00 0.00 C ATOM 1402 C VAL A 103 -3.009 -15.844 4.918 1.00 0.00 C ATOM 1403 O VAL A 103 -3.677 -15.680 5.936 1.00 0.00 O ATOM 1404 CB VAL A 103 -1.648 -13.625 5.036 1.00 0.00 C ATOM 1405 CG1 VAL A 103 -0.227 -13.037 4.968 1.00 0.00 C ATOM 1406 CG2 VAL A 103 -2.560 -12.793 4.133 1.00 0.00 C ATOM 0 H VAL A 103 -1.454 -14.948 2.713 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.049 -15.565 5.578 1.00 0.00 H new ATOM 0 HB VAL A 103 -2.056 -13.551 6.044 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.267 -11.965 5.159 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.401 -13.516 5.719 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.193 -13.213 3.978 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -2.481 -11.741 4.406 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.258 -12.922 3.094 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -3.592 -13.123 4.255 1.00 0.00 H new ATOM 1416 N ALA A 104 -3.362 -16.703 3.949 1.00 0.00 N ATOM 1417 CA ALA A 104 -4.481 -17.640 4.029 1.00 0.00 C ATOM 1418 C ALA A 104 -4.247 -18.702 5.111 1.00 0.00 C ATOM 1419 O ALA A 104 -5.170 -19.102 5.819 1.00 0.00 O ATOM 1420 CB ALA A 104 -4.619 -18.315 2.653 1.00 0.00 C ATOM 0 H ALA A 104 -2.858 -16.762 3.064 1.00 0.00 H new ATOM 0 HA ALA A 104 -5.391 -17.102 4.296 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.447 -19.023 2.677 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -4.811 -17.557 1.894 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.697 -18.844 2.413 1.00 0.00 H new ATOM 1426 N GLU A 105 -2.987 -19.120 5.226 1.00 0.00 N ATOM 1427 CA GLU A 105 -2.504 -20.180 6.106 1.00 0.00 C ATOM 1428 C GLU A 105 -1.772 -19.603 7.334 1.00 0.00 C ATOM 1429 O GLU A 105 -1.100 -20.341 8.055 1.00 0.00 O ATOM 1430 CB GLU A 105 -1.593 -21.118 5.286 1.00 0.00 C ATOM 1431 CG GLU A 105 -2.309 -21.724 4.059 1.00 0.00 C ATOM 1432 CD GLU A 105 -1.423 -22.672 3.246 1.00 0.00 C ATOM 1433 OE1 GLU A 105 -0.223 -22.358 3.096 1.00 0.00 O ATOM 1434 OE2 GLU A 105 -1.953 -23.701 2.774 1.00 0.00 O ATOM 0 H GLU A 105 -2.235 -18.704 4.676 1.00 0.00 H new ATOM 0 HA GLU A 105 -3.350 -20.747 6.495 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.715 -20.564 4.952 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -1.237 -21.924 5.928 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -3.195 -22.264 4.394 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -2.653 -20.917 3.413 1.00 0.00 H new ATOM 1441 N ARG A 106 -1.860 -18.282 7.591 1.00 0.00 N ATOM 1442 CA ARG A 106 -1.141 -17.678 8.720 1.00 0.00 C ATOM 1443 C ARG A 106 -1.599 -18.269 10.056 1.00 0.00 C ATOM 1444 O ARG A 106 -2.792 -18.392 10.332 1.00 0.00 O ATOM 1445 CB ARG A 106 -1.119 -16.135 8.671 1.00 0.00 C ATOM 1446 CG ARG A 106 -2.421 -15.358 8.943 1.00 0.00 C ATOM 1447 CD ARG A 106 -2.662 -14.972 10.414 1.00 0.00 C ATOM 1448 NE ARG A 106 -3.594 -15.900 11.070 1.00 0.00 N ATOM 1449 CZ ARG A 106 -4.317 -15.677 12.159 1.00 0.00 C ATOM 1450 NH1 ARG A 106 -4.062 -14.687 12.980 1.00 0.00 N ATOM 1451 NH2 ARG A 106 -5.338 -16.454 12.427 1.00 0.00 N ATOM 0 H ARG A 106 -2.413 -17.626 7.039 1.00 0.00 H new ATOM 0 HA ARG A 106 -0.091 -17.952 8.622 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -0.376 -15.794 9.392 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -0.762 -15.843 7.683 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -2.414 -14.448 8.342 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -3.262 -15.960 8.600 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.713 -14.969 10.950 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -3.060 -13.959 10.465 1.00 0.00 H new ATOM 0 HE ARG A 106 -3.696 -16.819 10.639 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -3.284 -14.055 12.791 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -4.642 -14.549 13.808 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -5.572 -17.224 11.800 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -5.899 -16.289 13.263 1.00 0.00 H new TER 1465 ARG A 106 ATOM 1466 N ALA B 10 -0.606 -10.360 10.155 1.00 0.00 N ATOM 1467 CA ALA B 10 0.186 -10.572 8.917 1.00 0.00 C ATOM 1468 C ALA B 10 -0.021 -9.477 7.846 1.00 0.00 C ATOM 1469 O ALA B 10 0.387 -9.611 6.689 1.00 0.00 O ATOM 1470 CB ALA B 10 0.040 -11.998 8.359 1.00 0.00 C ATOM 0 HA ALA B 10 1.228 -10.468 9.220 1.00 0.00 H new ATOM 0 HB1 ALA B 10 0.640 -12.098 7.454 1.00 0.00 H new ATOM 0 HB2 ALA B 10 0.383 -12.717 9.103 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -1.007 -12.191 8.124 1.00 0.00 H new ATOM 1476 N LEU B 11 -0.642 -8.360 8.235 1.00 0.00 N ATOM 1477 CA LEU B 11 -1.115 -7.318 7.327 1.00 0.00 C ATOM 1478 C LEU B 11 0.003 -6.449 6.715 1.00 0.00 C ATOM 1479 O LEU B 11 -0.328 -5.517 5.991 1.00 0.00 O ATOM 1480 CB LEU B 11 -2.248 -6.528 8.026 1.00 0.00 C ATOM 1481 CG LEU B 11 -3.668 -7.143 7.940 1.00 0.00 C ATOM 1482 CD1 LEU B 11 -4.295 -6.977 6.546 1.00 0.00 C ATOM 1483 CD2 LEU B 11 -3.716 -8.629 8.317 1.00 0.00 C ATOM 0 H LEU B 11 -0.833 -8.153 9.215 1.00 0.00 H new ATOM 0 HA LEU B 11 -1.531 -7.792 6.438 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -1.987 -6.415 9.078 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -2.282 -5.527 7.597 1.00 0.00 H new ATOM 0 HG LEU B 11 -4.246 -6.581 8.673 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -5.289 -7.424 6.538 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -4.373 -5.917 6.306 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -3.669 -7.472 5.804 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -4.740 -8.992 8.234 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -3.074 -9.196 7.643 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -3.368 -8.756 9.342 1.00 0.00 H new ATOM 1495 N ALA B 12 1.293 -6.715 6.955 1.00 0.00 N ATOM 1496 CA ALA B 12 2.375 -6.103 6.170 1.00 0.00 C ATOM 1497 C ALA B 12 2.599 -6.858 4.853 1.00 0.00 C ATOM 1498 O ALA B 12 2.756 -6.250 3.796 1.00 0.00 O ATOM 1499 CB ALA B 12 3.672 -6.093 6.983 1.00 0.00 C ATOM 0 H ALA B 12 1.614 -7.350 7.686 1.00 0.00 H new ATOM 0 HA ALA B 12 2.083 -5.079 5.935 1.00 0.00 H new ATOM 0 HB1 ALA B 12 4.468 -5.638 6.393 1.00 0.00 H new ATOM 0 HB2 ALA B 12 3.524 -5.518 7.897 1.00 0.00 H new ATOM 0 HB3 ALA B 12 3.949 -7.116 7.238 1.00 0.00 H new ATOM 1505 N ARG B 13 2.526 -8.195 4.889 1.00 0.00 N ATOM 1506 CA ARG B 13 2.636 -9.070 3.710 1.00 0.00 C ATOM 1507 C ARG B 13 1.536 -8.749 2.656 1.00 0.00 C ATOM 1508 O ARG B 13 1.738 -8.939 1.454 1.00 0.00 O ATOM 1509 CB ARG B 13 2.683 -10.541 4.188 1.00 0.00 C ATOM 1510 CG ARG B 13 3.768 -10.833 5.265 1.00 0.00 C ATOM 1511 CD ARG B 13 5.212 -10.712 4.741 1.00 0.00 C ATOM 1512 NE ARG B 13 6.230 -10.650 5.811 1.00 0.00 N ATOM 1513 CZ ARG B 13 7.242 -11.481 6.041 1.00 0.00 C ATOM 1514 NH1 ARG B 13 7.374 -12.642 5.443 1.00 0.00 N ATOM 1515 NH2 ARG B 13 8.173 -11.181 6.913 1.00 0.00 N ATOM 0 H ARG B 13 2.386 -8.712 5.757 1.00 0.00 H new ATOM 0 HA ARG B 13 3.567 -8.884 3.174 1.00 0.00 H new ATOM 0 HB2 ARG B 13 1.707 -10.811 4.591 1.00 0.00 H new ATOM 0 HB3 ARG B 13 2.861 -11.185 3.327 1.00 0.00 H new ATOM 0 HG2 ARG B 13 3.635 -10.143 6.098 1.00 0.00 H new ATOM 0 HG3 ARG B 13 3.617 -11.839 5.657 1.00 0.00 H new ATOM 0 HD2 ARG B 13 5.427 -11.564 4.096 1.00 0.00 H new ATOM 0 HD3 ARG B 13 5.291 -9.817 4.124 1.00 0.00 H new ATOM 0 HE ARG B 13 6.145 -9.866 6.458 1.00 0.00 H new ATOM 0 HH11 ARG B 13 6.678 -12.947 4.762 1.00 0.00 H new ATOM 0 HH12 ARG B 13 8.172 -13.239 5.659 1.00 0.00 H new ATOM 0 HH21 ARG B 13 8.127 -10.300 7.426 1.00 0.00 H new ATOM 0 HH22 ARG B 13 8.944 -11.828 7.079 1.00 0.00 H new ATOM 1529 N LEU B 14 0.439 -8.110 3.092 1.00 0.00 N ATOM 1530 CA LEU B 14 -0.599 -7.442 2.290 1.00 0.00 C ATOM 1531 C LEU B 14 0.013 -6.520 1.225 1.00 0.00 C ATOM 1532 O LEU B 14 -0.384 -6.577 0.063 1.00 0.00 O ATOM 1533 CB LEU B 14 -1.424 -6.604 3.291 1.00 0.00 C ATOM 1534 CG LEU B 14 -2.662 -5.797 2.849 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -2.370 -4.607 1.921 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -3.719 -6.709 2.237 1.00 0.00 C ATOM 0 H LEU B 14 0.239 -8.042 4.090 1.00 0.00 H new ATOM 0 HA LEU B 14 -1.205 -8.176 1.758 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -1.755 -7.285 4.075 1.00 0.00 H new ATOM 0 HB3 LEU B 14 -0.735 -5.897 3.753 1.00 0.00 H new ATOM 0 HG LEU B 14 -3.045 -5.353 3.768 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -3.304 -4.105 1.668 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -1.707 -3.905 2.427 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -1.892 -4.965 1.009 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -4.581 -6.115 1.934 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -3.303 -7.215 1.366 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -4.030 -7.450 2.973 1.00 0.00 H new ATOM 1548 N GLY B 15 0.990 -5.688 1.607 1.00 0.00 N ATOM 1549 CA GLY B 15 1.597 -4.695 0.719 1.00 0.00 C ATOM 1550 C GLY B 15 2.437 -5.332 -0.384 1.00 0.00 C ATOM 1551 O GLY B 15 2.744 -4.661 -1.364 1.00 0.00 O ATOM 0 H GLY B 15 1.383 -5.687 2.548 1.00 0.00 H new ATOM 0 HA2 GLY B 15 0.812 -4.088 0.268 1.00 0.00 H new ATOM 0 HA3 GLY B 15 2.223 -4.023 1.305 1.00 0.00 H new ATOM 1555 N ARG B 16 2.781 -6.623 -0.254 1.00 0.00 N ATOM 1556 CA ARG B 16 3.323 -7.416 -1.356 1.00 0.00 C ATOM 1557 C ARG B 16 2.142 -7.817 -2.244 1.00 0.00 C ATOM 1558 O ARG B 16 2.140 -7.477 -3.416 1.00 0.00 O ATOM 1559 CB ARG B 16 4.108 -8.627 -0.817 1.00 0.00 C ATOM 1560 CG ARG B 16 4.984 -9.374 -1.843 1.00 0.00 C ATOM 1561 CD ARG B 16 4.222 -10.239 -2.866 1.00 0.00 C ATOM 1562 NE ARG B 16 4.041 -9.563 -4.158 1.00 0.00 N ATOM 1563 CZ ARG B 16 4.926 -9.437 -5.135 1.00 0.00 C ATOM 1564 NH1 ARG B 16 6.146 -9.927 -5.043 1.00 0.00 N ATOM 1565 NH2 ARG B 16 4.598 -8.790 -6.224 1.00 0.00 N ATOM 0 H ARG B 16 2.689 -7.141 0.620 1.00 0.00 H new ATOM 0 HA ARG B 16 4.038 -6.845 -1.948 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.747 -8.287 -0.002 1.00 0.00 H new ATOM 0 HB3 ARG B 16 3.397 -9.335 -0.391 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.580 -8.641 -2.387 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.681 -10.013 -1.301 1.00 0.00 H new ATOM 0 HD2 ARG B 16 4.764 -11.172 -3.022 1.00 0.00 H new ATOM 0 HD3 ARG B 16 3.246 -10.501 -2.458 1.00 0.00 H new ATOM 0 HE ARG B 16 3.127 -9.141 -4.321 1.00 0.00 H new ATOM 0 HH11 ARG B 16 6.434 -10.422 -4.199 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.802 -9.811 -5.816 1.00 0.00 H new ATOM 0 HH21 ARG B 16 3.666 -8.387 -6.316 1.00 0.00 H new ATOM 0 HH22 ARG B 16 5.275 -8.689 -6.981 1.00 0.00 H new ATOM 1579 N ALA B 17 1.118 -8.481 -1.695 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.003 -9.048 -2.461 1.00 0.00 C ATOM 1581 C ALA B 17 -0.854 -8.027 -3.256 1.00 0.00 C ATOM 1582 O ALA B 17 -1.451 -8.406 -4.265 1.00 0.00 O ATOM 1583 CB ALA B 17 -0.873 -9.862 -1.491 1.00 0.00 C ATOM 0 H ALA B 17 1.042 -8.643 -0.691 1.00 0.00 H new ATOM 0 HA ALA B 17 0.429 -9.676 -3.240 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -1.714 -10.295 -2.033 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -0.276 -10.660 -1.049 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -1.247 -9.209 -0.702 1.00 0.00 H new ATOM 1589 N LEU B 18 -0.940 -6.763 -2.818 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.564 -5.684 -3.602 1.00 0.00 C ATOM 1591 C LEU B 18 -0.611 -5.039 -4.623 1.00 0.00 C ATOM 1592 O LEU B 18 -1.095 -4.468 -5.600 1.00 0.00 O ATOM 1593 CB LEU B 18 -2.227 -4.638 -2.675 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.733 -4.926 -2.490 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.961 -6.140 -1.578 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -4.501 -3.714 -1.942 1.00 0.00 C ATOM 0 H LEU B 18 -0.581 -6.459 -1.913 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.349 -6.147 -4.200 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.732 -4.644 -1.704 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -2.094 -3.641 -3.095 1.00 0.00 H new ATOM 0 HG LEU B 18 -4.123 -5.147 -3.483 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -5.031 -6.316 -1.468 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.492 -7.019 -2.019 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.522 -5.947 -0.599 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -5.555 -3.971 -1.831 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -4.092 -3.432 -0.972 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -4.402 -2.878 -2.634 1.00 0.00 H new ATOM 1608 N ALA B 19 0.704 -5.179 -4.454 1.00 0.00 N ATOM 1609 CA ALA B 19 1.721 -4.827 -5.444 1.00 0.00 C ATOM 1610 C ALA B 19 2.064 -6.040 -6.342 1.00 0.00 C ATOM 1611 O ALA B 19 3.224 -6.419 -6.483 1.00 0.00 O ATOM 1612 CB ALA B 19 2.926 -4.261 -4.687 1.00 0.00 C ATOM 0 H ALA B 19 1.104 -5.554 -3.594 1.00 0.00 H new ATOM 0 HA ALA B 19 1.357 -4.064 -6.132 1.00 0.00 H new ATOM 0 HB1 ALA B 19 3.706 -3.987 -5.397 1.00 0.00 H new ATOM 0 HB2 ALA B 19 2.621 -3.378 -4.125 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.310 -5.014 -3.999 1.00 0.00 H new ATOM 1618 N ASP B 20 1.042 -6.669 -6.923 1.00 0.00 N ATOM 1619 CA ASP B 20 1.103 -7.796 -7.860 1.00 0.00 C ATOM 1620 C ASP B 20 0.505 -7.324 -9.208 1.00 0.00 C ATOM 1621 O ASP B 20 -0.480 -6.580 -9.179 1.00 0.00 O ATOM 1622 CB ASP B 20 0.240 -8.958 -7.325 1.00 0.00 C ATOM 1623 CG ASP B 20 0.900 -9.974 -6.388 1.00 0.00 C ATOM 1624 OD1 ASP B 20 1.616 -9.585 -5.448 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.590 -11.180 -6.544 1.00 0.00 O ATOM 0 H ASP B 20 0.080 -6.385 -6.739 1.00 0.00 H new ATOM 0 HA ASP B 20 2.134 -8.130 -7.980 1.00 0.00 H new ATOM 0 HB2 ASP B 20 -0.613 -8.526 -6.801 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.155 -9.503 -8.183 1.00 0.00 H new ATOM 1630 N PRO B 21 0.993 -7.818 -10.364 1.00 0.00 N ATOM 1631 CA PRO B 21 0.701 -7.316 -11.718 1.00 0.00 C ATOM 1632 C PRO B 21 -0.796 -7.365 -12.087 1.00 0.00 C ATOM 1633 O PRO B 21 -1.561 -6.447 -11.777 1.00 0.00 O ATOM 1634 CB PRO B 21 1.591 -8.175 -12.640 1.00 0.00 C ATOM 1635 CG PRO B 21 1.661 -9.499 -11.873 1.00 0.00 C ATOM 1636 CD PRO B 21 1.866 -8.980 -10.456 1.00 0.00 C ATOM 0 HA PRO B 21 0.924 -6.253 -11.812 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.152 -8.300 -13.630 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.577 -7.733 -12.782 1.00 0.00 H new ATOM 0 HG2 PRO B 21 0.748 -10.086 -11.973 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.484 -10.130 -12.208 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.602 -9.734 -9.715 1.00 0.00 H new ATOM 0 HD3 PRO B 21 2.907 -8.710 -10.279 1.00 0.00 H new ATOM 1644 N THR B 22 -1.246 -8.437 -12.753 1.00 0.00 N ATOM 1645 CA THR B 22 -2.654 -8.669 -13.088 1.00 0.00 C ATOM 1646 C THR B 22 -3.522 -8.706 -11.832 1.00 0.00 C ATOM 1647 O THR B 22 -4.709 -8.402 -11.914 1.00 0.00 O ATOM 1648 CB THR B 22 -2.800 -9.978 -13.875 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.750 -10.107 -14.806 1.00 0.00 O ATOM 1650 CG2 THR B 22 -4.119 -10.054 -14.643 1.00 0.00 C ATOM 0 H THR B 22 -0.628 -9.180 -13.079 1.00 0.00 H new ATOM 0 HA THR B 22 -2.996 -7.840 -13.708 1.00 0.00 H new ATOM 0 HB THR B 22 -2.774 -10.783 -13.140 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.853 -10.947 -15.301 1.00 0.00 H new ATOM 0 HG21 THR B 22 -4.172 -11.000 -15.183 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.952 -9.989 -13.943 1.00 0.00 H new ATOM 0 HG23 THR B 22 -4.175 -9.228 -15.352 1.00 0.00 H new ATOM 1658 N ARG B 23 -2.960 -9.025 -10.655 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.729 -9.113 -9.411 1.00 0.00 C ATOM 1660 C ARG B 23 -4.207 -7.758 -8.877 1.00 0.00 C ATOM 1661 O ARG B 23 -5.364 -7.676 -8.466 1.00 0.00 O ATOM 1662 CB ARG B 23 -2.944 -9.824 -8.321 1.00 0.00 C ATOM 1663 CG ARG B 23 -3.892 -10.528 -7.339 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.246 -10.570 -5.946 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.061 -11.425 -5.885 1.00 0.00 N ATOM 1666 CZ ARG B 23 -2.022 -12.747 -5.853 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -3.082 -13.490 -6.109 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -0.881 -13.337 -5.588 1.00 0.00 N ATOM 0 H ARG B 23 -1.967 -9.227 -10.543 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.615 -9.691 -9.674 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.269 -10.554 -8.769 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.325 -9.105 -7.784 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.844 -10.000 -7.294 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -4.104 -11.540 -7.684 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -2.971 -9.558 -5.650 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -3.980 -10.926 -5.223 1.00 0.00 H new ATOM 0 HE ARG B 23 -1.160 -10.947 -5.865 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -3.971 -13.047 -6.342 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -3.012 -14.507 -6.074 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -0.046 -12.778 -5.412 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -0.828 -14.355 -5.558 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.389 -6.701 -8.917 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.846 -5.335 -8.629 1.00 0.00 C ATOM 1684 C CYS B 24 -5.017 -4.979 -9.562 1.00 0.00 C ATOM 1685 O CYS B 24 -6.068 -4.496 -9.119 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.644 -4.385 -8.778 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.082 -2.716 -8.214 1.00 0.00 S ATOM 0 H CYS B 24 -2.398 -6.766 -9.148 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.221 -5.243 -7.610 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -1.801 -4.762 -8.199 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.326 -4.352 -9.820 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.055 -1.930 -8.346 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.887 -5.352 -10.848 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.975 -5.189 -11.811 1.00 0.00 C ATOM 1695 C ARG B 25 -7.209 -6.048 -11.482 1.00 0.00 C ATOM 1696 O ARG B 25 -8.305 -5.552 -11.705 1.00 0.00 O ATOM 1697 CB ARG B 25 -5.497 -5.343 -13.265 1.00 0.00 C ATOM 1698 CG ARG B 25 -6.491 -4.744 -14.283 1.00 0.00 C ATOM 1699 CD ARG B 25 -6.714 -3.234 -14.133 1.00 0.00 C ATOM 1700 NE ARG B 25 -7.699 -2.723 -15.103 1.00 0.00 N ATOM 1701 CZ ARG B 25 -7.811 -1.456 -15.491 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -7.043 -0.501 -14.993 1.00 0.00 N ATOM 1703 NH2 ARG B 25 -8.711 -1.126 -16.392 1.00 0.00 N ATOM 0 H ARG B 25 -4.040 -5.766 -11.237 1.00 0.00 H new ATOM 0 HA ARG B 25 -6.314 -4.158 -11.713 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.528 -4.856 -13.379 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.350 -6.400 -13.485 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -6.128 -4.948 -15.290 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -7.449 -5.253 -14.180 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -7.055 -3.017 -13.121 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -5.767 -2.712 -14.269 1.00 0.00 H new ATOM 0 HE ARG B 25 -8.348 -3.396 -15.510 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -6.339 -0.727 -14.290 1.00 0.00 H new ATOM 0 HH12 ARG B 25 -7.154 0.461 -15.312 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -9.320 -1.841 -16.790 1.00 0.00 H new ATOM 0 HH22 ARG B 25 -8.800 -0.155 -16.692 1.00 0.00 H new ATOM 1717 N ILE B 26 -7.085 -7.263 -10.912 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.254 -7.992 -10.357 1.00 0.00 C ATOM 1719 C ILE B 26 -8.917 -7.113 -9.320 1.00 0.00 C ATOM 1720 O ILE B 26 -10.065 -6.744 -9.498 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.949 -9.373 -9.698 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -7.340 -10.335 -10.729 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -9.248 -9.931 -9.067 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -7.688 -11.822 -10.613 1.00 0.00 C ATOM 0 H ILE B 26 -6.199 -7.760 -10.822 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.890 -8.210 -11.215 1.00 0.00 H new ATOM 0 HB ILE B 26 -7.211 -9.255 -8.904 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -7.641 -9.997 -11.721 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.255 -10.240 -10.676 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -9.042 -10.896 -8.604 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.612 -9.236 -8.310 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -10.005 -10.054 -9.841 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.187 -12.376 -11.407 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -7.359 -12.198 -9.644 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -8.766 -11.952 -10.706 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.193 -6.796 -8.251 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.777 -6.128 -7.085 1.00 0.00 C ATOM 1738 C LEU B 27 -9.493 -4.830 -7.461 1.00 0.00 C ATOM 1739 O LEU B 27 -10.606 -4.625 -6.988 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.723 -5.904 -5.984 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.388 -7.167 -5.166 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -6.223 -6.878 -4.212 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.562 -7.645 -4.297 1.00 0.00 C ATOM 0 H LEU B 27 -7.195 -6.991 -8.165 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.538 -6.795 -6.680 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.808 -5.528 -6.443 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -8.081 -5.129 -5.306 1.00 0.00 H new ATOM 0 HG LEU B 27 -7.143 -7.940 -5.895 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.992 -7.775 -3.637 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.347 -6.580 -4.788 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.501 -6.073 -3.532 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.266 -8.537 -3.745 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.839 -6.859 -3.595 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.415 -7.879 -4.934 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.923 -3.992 -8.329 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.556 -2.708 -8.713 1.00 0.00 C ATOM 1757 C VAL B 28 -10.753 -2.883 -9.672 1.00 0.00 C ATOM 1758 O VAL B 28 -11.596 -1.997 -9.784 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.506 -1.709 -9.252 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -8.133 -1.965 -10.722 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.927 -0.244 -9.066 1.00 0.00 C ATOM 0 H VAL B 28 -8.027 -4.170 -8.783 1.00 0.00 H new ATOM 0 HA VAL B 28 -9.979 -2.281 -7.804 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.618 -1.886 -8.645 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -7.393 -1.232 -11.042 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.718 -2.968 -10.823 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -9.024 -1.877 -11.344 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.151 0.411 -9.463 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -9.861 -0.064 -9.598 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.068 -0.038 -8.005 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.843 -4.030 -10.349 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.978 -4.441 -11.178 1.00 0.00 C ATOM 1773 C ALA B 29 -13.051 -5.194 -10.379 1.00 0.00 C ATOM 1774 O ALA B 29 -14.226 -5.138 -10.719 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.403 -5.316 -12.293 1.00 0.00 C ATOM 0 H ALA B 29 -10.097 -4.726 -10.334 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.485 -3.564 -11.579 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -12.210 -5.652 -12.944 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -10.684 -4.739 -12.874 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.905 -6.182 -11.856 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.659 -5.865 -9.295 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.545 -6.470 -8.307 1.00 0.00 C ATOM 1783 C LEU B 30 -14.456 -5.401 -7.718 1.00 0.00 C ATOM 1784 O LEU B 30 -15.666 -5.610 -7.625 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.644 -7.076 -7.208 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.183 -8.267 -6.422 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.370 -7.927 -5.526 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.540 -9.395 -7.379 1.00 0.00 C ATOM 0 H LEU B 30 -11.673 -6.006 -9.075 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.174 -7.240 -8.754 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.706 -7.379 -7.673 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.406 -6.285 -6.496 1.00 0.00 H new ATOM 0 HG LEU B 30 -12.386 -8.584 -5.749 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -14.697 -8.824 -5.000 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -14.073 -7.169 -4.801 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -15.189 -7.545 -6.136 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -13.925 -10.244 -6.814 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -14.301 -9.051 -8.079 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.650 -9.699 -7.930 1.00 0.00 H new ATOM 1800 N LEU B 31 -13.811 -4.285 -7.354 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.328 -3.053 -6.773 1.00 0.00 C ATOM 1802 C LEU B 31 -15.596 -2.558 -7.490 1.00 0.00 C ATOM 1803 O LEU B 31 -16.663 -2.528 -6.886 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.172 -2.037 -6.856 1.00 0.00 C ATOM 1805 CG LEU B 31 -12.935 -1.172 -5.613 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -11.869 -0.170 -6.044 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -14.180 -0.448 -5.080 1.00 0.00 C ATOM 0 H LEU B 31 -12.800 -4.224 -7.476 1.00 0.00 H new ATOM 0 HA LEU B 31 -14.643 -3.205 -5.741 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.253 -2.582 -7.074 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.358 -1.376 -7.702 1.00 0.00 H new ATOM 0 HG LEU B 31 -12.637 -1.804 -4.777 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -11.636 0.494 -5.211 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -10.968 -0.704 -6.345 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -12.240 0.418 -6.884 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -13.912 0.138 -4.201 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.574 0.214 -5.851 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -14.940 -1.182 -4.810 1.00 0.00 H new ATOM 1819 N ASP B 32 -15.458 -2.262 -8.786 1.00 0.00 N ATOM 1820 CA ASP B 32 -16.507 -1.868 -9.741 1.00 0.00 C ATOM 1821 C ASP B 32 -17.007 -3.100 -10.531 1.00 0.00 C ATOM 1822 O ASP B 32 -17.254 -3.065 -11.737 1.00 0.00 O ATOM 1823 CB ASP B 32 -15.939 -0.747 -10.641 1.00 0.00 C ATOM 1824 CG ASP B 32 -17.005 0.044 -11.417 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -18.125 0.205 -10.881 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -16.666 0.547 -12.513 1.00 0.00 O ATOM 0 H ASP B 32 -14.541 -2.293 -9.232 1.00 0.00 H new ATOM 0 HA ASP B 32 -17.384 -1.475 -9.226 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -15.369 -0.054 -10.022 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -15.241 -1.188 -11.353 1.00 0.00 H new ATOM 1831 N GLY B 33 -17.038 -4.249 -9.848 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.336 -5.561 -10.417 1.00 0.00 C ATOM 1833 C GLY B 33 -18.411 -6.320 -9.660 1.00 0.00 C ATOM 1834 O GLY B 33 -19.539 -6.390 -10.130 1.00 0.00 O ATOM 0 H GLY B 33 -16.849 -4.289 -8.847 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.652 -5.436 -11.453 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.424 -6.157 -10.432 1.00 0.00 H new ATOM 1838 N VAL B 34 -18.034 -6.963 -8.548 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.836 -7.870 -7.670 1.00 0.00 C ATOM 1840 C VAL B 34 -20.017 -8.677 -8.274 1.00 0.00 C ATOM 1841 O VAL B 34 -20.920 -9.050 -7.533 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.299 -7.173 -6.365 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.101 -6.661 -5.565 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -20.265 -6.008 -6.633 1.00 0.00 C ATOM 0 H VAL B 34 -17.082 -6.864 -8.196 1.00 0.00 H new ATOM 0 HA VAL B 34 -18.087 -8.638 -7.478 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.832 -7.928 -5.787 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.452 -6.176 -4.654 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.453 -7.498 -5.304 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.542 -5.943 -6.166 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.559 -5.554 -5.687 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.771 -5.262 -7.255 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -21.151 -6.381 -7.147 1.00 0.00 H new ATOM 1854 N CYS B 35 -20.060 -8.977 -9.576 1.00 0.00 N ATOM 1855 CA CYS B 35 -21.189 -9.706 -10.170 1.00 0.00 C ATOM 1856 C CYS B 35 -21.049 -11.219 -10.004 1.00 0.00 C ATOM 1857 O CYS B 35 -21.816 -11.841 -9.278 1.00 0.00 O ATOM 1858 CB CYS B 35 -21.364 -9.282 -11.636 1.00 0.00 C ATOM 1859 SG CYS B 35 -22.009 -7.591 -11.729 1.00 0.00 S ATOM 0 H CYS B 35 -19.327 -8.727 -10.240 1.00 0.00 H new ATOM 0 HA CYS B 35 -22.099 -9.441 -9.632 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -20.408 -9.343 -12.156 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -22.045 -9.967 -12.141 1.00 0.00 H new ATOM 0 HG CYS B 35 -21.189 -6.780 -11.129 1.00 0.00 H new ATOM 1865 N TYR B 36 -20.058 -11.811 -10.672 1.00 0.00 N ATOM 1866 CA TYR B 36 -19.872 -13.263 -10.734 1.00 0.00 C ATOM 1867 C TYR B 36 -18.379 -13.631 -10.813 1.00 0.00 C ATOM 1868 O TYR B 36 -17.601 -12.793 -11.278 1.00 0.00 O ATOM 1869 CB TYR B 36 -20.594 -13.851 -11.978 1.00 0.00 C ATOM 1870 CG TYR B 36 -21.665 -13.010 -12.660 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -22.909 -12.807 -12.034 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -21.421 -12.433 -13.922 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -23.887 -12.009 -12.648 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -22.411 -11.653 -14.555 1.00 0.00 C ATOM 1875 CZ TYR B 36 -23.654 -11.443 -13.922 1.00 0.00 C ATOM 1876 OH TYR B 36 -24.617 -10.692 -14.528 1.00 0.00 O ATOM 0 H TYR B 36 -19.352 -11.290 -11.192 1.00 0.00 H new ATOM 0 HA TYR B 36 -20.298 -13.683 -9.823 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -19.833 -14.087 -12.722 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -21.052 -14.794 -11.681 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -23.112 -13.267 -11.078 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -20.469 -12.589 -14.408 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -24.824 -11.826 -12.143 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -22.218 -11.217 -15.524 1.00 0.00 H new ATOM 0 HH TYR B 36 -24.290 -10.380 -15.397 1.00 0.00 H new ATOM 1886 N PRO B 37 -17.970 -14.885 -10.528 1.00 0.00 N ATOM 1887 CA PRO B 37 -16.609 -15.356 -10.803 1.00 0.00 C ATOM 1888 C PRO B 37 -16.200 -15.183 -12.274 1.00 0.00 C ATOM 1889 O PRO B 37 -15.025 -14.980 -12.558 1.00 0.00 O ATOM 1890 CB PRO B 37 -16.587 -16.831 -10.381 1.00 0.00 C ATOM 1891 CG PRO B 37 -18.056 -17.251 -10.387 1.00 0.00 C ATOM 1892 CD PRO B 37 -18.773 -15.969 -9.977 1.00 0.00 C ATOM 0 HA PRO B 37 -15.882 -14.764 -10.248 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -15.999 -17.433 -11.073 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -16.142 -16.955 -9.394 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -18.374 -17.596 -11.371 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -18.248 -18.064 -9.687 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -19.789 -15.944 -10.370 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -18.848 -15.890 -8.892 1.00 0.00 H new ATOM 1900 N GLY B 38 -17.165 -15.193 -13.206 1.00 0.00 N ATOM 1901 CA GLY B 38 -16.921 -14.934 -14.624 1.00 0.00 C ATOM 1902 C GLY B 38 -16.881 -13.456 -15.028 1.00 0.00 C ATOM 1903 O GLY B 38 -16.636 -13.198 -16.199 1.00 0.00 O ATOM 0 H GLY B 38 -18.143 -15.383 -12.990 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -15.973 -15.394 -14.901 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -17.698 -15.430 -15.205 1.00 0.00 H new ATOM 1907 N GLN B 39 -17.138 -12.489 -14.134 1.00 0.00 N ATOM 1908 CA GLN B 39 -17.267 -11.077 -14.531 1.00 0.00 C ATOM 1909 C GLN B 39 -15.918 -10.412 -14.807 1.00 0.00 C ATOM 1910 O GLN B 39 -15.818 -9.623 -15.742 1.00 0.00 O ATOM 1911 CB GLN B 39 -18.097 -10.284 -13.505 1.00 0.00 C ATOM 1912 CG GLN B 39 -17.343 -9.802 -12.246 1.00 0.00 C ATOM 1913 CD GLN B 39 -16.590 -8.469 -12.342 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -15.568 -8.290 -11.708 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -17.052 -7.485 -13.079 1.00 0.00 N ATOM 0 H GLN B 39 -17.260 -12.657 -13.135 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.807 -11.066 -15.478 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -18.520 -9.413 -14.006 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -18.934 -10.906 -13.187 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -18.063 -9.724 -11.431 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -16.627 -10.574 -11.966 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -17.908 -7.611 -13.620 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -16.555 -6.595 -13.111 1.00 0.00 H new ATOM 1924 N LEU B 40 -14.880 -10.755 -14.033 1.00 0.00 N ATOM 1925 CA LEU B 40 -13.539 -10.186 -14.183 1.00 0.00 C ATOM 1926 C LEU B 40 -12.940 -10.518 -15.551 1.00 0.00 C ATOM 1927 O LEU B 40 -12.085 -9.793 -16.028 1.00 0.00 O ATOM 1928 CB LEU B 40 -12.623 -10.718 -13.073 1.00 0.00 C ATOM 1929 CG LEU B 40 -13.002 -10.269 -11.656 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -12.493 -11.323 -10.669 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -12.439 -8.876 -11.343 1.00 0.00 C ATOM 0 H LEU B 40 -14.950 -11.440 -13.281 1.00 0.00 H new ATOM 0 HA LEU B 40 -13.622 -9.102 -14.105 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.629 -11.807 -13.108 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -11.602 -10.398 -13.279 1.00 0.00 H new ATOM 0 HG LEU B 40 -14.085 -10.185 -11.570 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -12.751 -11.025 -9.653 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -12.955 -12.285 -10.893 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -11.410 -11.411 -10.757 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -12.725 -8.587 -10.332 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -11.352 -8.897 -11.421 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -12.840 -8.153 -12.054 1.00 0.00 H new ATOM 1943 N ALA B 41 -13.420 -11.575 -16.207 1.00 0.00 N ATOM 1944 CA ALA B 41 -12.989 -11.956 -17.555 1.00 0.00 C ATOM 1945 C ALA B 41 -13.125 -10.785 -18.557 1.00 0.00 C ATOM 1946 O ALA B 41 -12.247 -10.568 -19.388 1.00 0.00 O ATOM 1947 CB ALA B 41 -13.833 -13.163 -17.989 1.00 0.00 C ATOM 0 H ALA B 41 -14.126 -12.198 -15.815 1.00 0.00 H new ATOM 0 HA ALA B 41 -11.931 -12.218 -17.543 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -13.537 -13.473 -18.991 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -13.675 -13.987 -17.293 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -14.888 -12.888 -17.991 1.00 0.00 H new ATOM 1953 N ALA B 42 -14.198 -9.990 -18.430 1.00 0.00 N ATOM 1954 CA ALA B 42 -14.423 -8.799 -19.245 1.00 0.00 C ATOM 1955 C ALA B 42 -13.483 -7.657 -18.831 1.00 0.00 C ATOM 1956 O ALA B 42 -12.749 -7.133 -19.662 1.00 0.00 O ATOM 1957 CB ALA B 42 -15.903 -8.403 -19.129 1.00 0.00 C ATOM 0 H ALA B 42 -14.938 -10.163 -17.750 1.00 0.00 H new ATOM 0 HA ALA B 42 -14.195 -9.014 -20.289 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -16.090 -7.514 -19.732 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -16.528 -9.222 -19.486 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -16.142 -8.192 -18.087 1.00 0.00 H new ATOM 1963 N HIS B 43 -13.453 -7.313 -17.538 1.00 0.00 N ATOM 1964 CA HIS B 43 -12.588 -6.255 -16.993 1.00 0.00 C ATOM 1965 C HIS B 43 -11.073 -6.456 -17.253 1.00 0.00 C ATOM 1966 O HIS B 43 -10.297 -5.493 -17.195 1.00 0.00 O ATOM 1967 CB HIS B 43 -12.825 -6.178 -15.477 1.00 0.00 C ATOM 1968 CG HIS B 43 -14.022 -5.385 -15.013 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.631 -5.532 -13.798 1.00 0.00 N flip ATOM 1970 CD2 HIS B 43 -14.484 -4.214 -15.610 1.00 0.00 C flip ATOM 1971 CE1 HIS B 43 -15.462 -4.441 -13.637 1.00 0.00 C flip ATOM 1972 NE2 HIS B 43 -15.360 -3.681 -14.740 1.00 0.00 N flip ATOM 0 H HIS B 43 -14.034 -7.765 -16.832 1.00 0.00 H new ATOM 0 HA HIS B 43 -12.859 -5.334 -17.510 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -12.924 -7.195 -15.097 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -11.935 -5.750 -15.016 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -14.198 -3.816 -16.573 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -16.083 -4.235 -12.778 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -15.877 -2.816 -14.897 1.00 0.00 H new ATOM 1980 N LEU B 44 -10.641 -7.706 -17.466 1.00 0.00 N ATOM 1981 CA LEU B 44 -9.238 -8.106 -17.663 1.00 0.00 C ATOM 1982 C LEU B 44 -8.922 -8.518 -19.110 1.00 0.00 C ATOM 1983 O LEU B 44 -7.750 -8.703 -19.427 1.00 0.00 O ATOM 1984 CB LEU B 44 -8.888 -9.236 -16.671 1.00 0.00 C ATOM 1985 CG LEU B 44 -9.177 -8.858 -15.207 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -8.818 -9.945 -14.217 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -8.508 -7.561 -14.741 1.00 0.00 C ATOM 0 H LEU B 44 -11.282 -8.498 -17.508 1.00 0.00 H new ATOM 0 HA LEU B 44 -8.614 -7.234 -17.466 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.457 -10.129 -16.930 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -7.833 -9.489 -16.774 1.00 0.00 H new ATOM 0 HG LEU B 44 -10.257 -8.711 -15.216 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -9.049 -9.608 -13.207 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -9.393 -10.844 -14.440 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.753 -10.167 -14.291 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -8.766 -7.373 -13.699 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -7.426 -7.655 -14.836 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -8.855 -6.731 -15.356 1.00 0.00 H new ATOM 1999 N GLY B 45 -9.933 -8.701 -19.971 1.00 0.00 N ATOM 2000 CA GLY B 45 -9.782 -9.276 -21.316 1.00 0.00 C ATOM 2001 C GLY B 45 -9.362 -10.751 -21.315 1.00 0.00 C ATOM 2002 O GLY B 45 -9.007 -11.289 -22.363 1.00 0.00 O ATOM 0 H GLY B 45 -10.896 -8.449 -19.749 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -10.726 -9.177 -21.851 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -9.041 -8.697 -21.867 1.00 0.00 H new ATOM 2006 N LEU B 46 -9.341 -11.392 -20.137 1.00 0.00 N ATOM 2007 CA LEU B 46 -8.794 -12.734 -19.926 1.00 0.00 C ATOM 2008 C LEU B 46 -9.896 -13.790 -19.790 1.00 0.00 C ATOM 2009 O LEU B 46 -11.060 -13.492 -19.539 1.00 0.00 O ATOM 2010 CB LEU B 46 -7.884 -12.714 -18.679 1.00 0.00 C ATOM 2011 CG LEU B 46 -6.505 -12.055 -18.877 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -5.788 -11.998 -17.519 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -5.630 -12.827 -19.879 1.00 0.00 C ATOM 0 H LEU B 46 -9.715 -10.977 -19.284 1.00 0.00 H new ATOM 0 HA LEU B 46 -8.208 -13.014 -20.802 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -8.406 -12.191 -17.878 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -7.733 -13.740 -18.344 1.00 0.00 H new ATOM 0 HG LEU B 46 -6.663 -11.055 -19.281 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -4.810 -11.534 -17.643 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -6.382 -11.411 -16.818 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -5.663 -13.009 -17.131 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -4.669 -12.324 -19.985 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -5.470 -13.842 -19.516 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -6.130 -12.862 -20.847 1.00 0.00 H new ATOM 2025 N THR B 47 -9.518 -15.064 -19.914 1.00 0.00 N ATOM 2026 CA THR B 47 -10.425 -16.194 -19.698 1.00 0.00 C ATOM 2027 C THR B 47 -10.760 -16.319 -18.210 1.00 0.00 C ATOM 2028 O THR B 47 -9.908 -16.116 -17.339 1.00 0.00 O ATOM 2029 CB THR B 47 -9.823 -17.495 -20.235 1.00 0.00 C ATOM 2030 OG1 THR B 47 -8.689 -17.755 -19.476 1.00 0.00 O ATOM 2031 CG2 THR B 47 -9.338 -17.425 -21.678 1.00 0.00 C ATOM 0 H THR B 47 -8.570 -15.342 -20.168 1.00 0.00 H new ATOM 0 HA THR B 47 -11.347 -16.008 -20.249 1.00 0.00 H new ATOM 0 HB THR B 47 -10.610 -18.247 -20.182 1.00 0.00 H new ATOM 0 HG1 THR B 47 -8.670 -18.704 -19.231 1.00 0.00 H new ATOM 0 HG21 THR B 47 -8.928 -18.391 -21.971 1.00 0.00 H new ATOM 0 HG22 THR B 47 -10.173 -17.172 -22.331 1.00 0.00 H new ATOM 0 HG23 THR B 47 -8.565 -16.661 -21.765 1.00 0.00 H new ATOM 2039 N ARG B 48 -11.990 -16.756 -17.910 1.00 0.00 N ATOM 2040 CA ARG B 48 -12.408 -17.078 -16.535 1.00 0.00 C ATOM 2041 C ARG B 48 -11.574 -18.207 -15.896 1.00 0.00 C ATOM 2042 O ARG B 48 -11.564 -18.344 -14.675 1.00 0.00 O ATOM 2043 CB ARG B 48 -13.931 -17.292 -16.437 1.00 0.00 C ATOM 2044 CG ARG B 48 -14.510 -18.442 -17.282 1.00 0.00 C ATOM 2045 CD ARG B 48 -16.038 -18.511 -17.117 1.00 0.00 C ATOM 2046 NE ARG B 48 -16.631 -19.560 -17.971 1.00 0.00 N ATOM 2047 CZ ARG B 48 -17.919 -19.901 -18.034 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -18.843 -19.330 -17.283 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -18.310 -20.845 -18.865 1.00 0.00 N ATOM 0 H ARG B 48 -12.721 -16.896 -18.607 1.00 0.00 H new ATOM 0 HA ARG B 48 -12.188 -16.203 -15.924 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -14.186 -17.472 -15.393 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -14.427 -16.367 -16.731 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -14.257 -18.293 -18.332 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -14.062 -19.388 -16.977 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -16.283 -18.709 -16.074 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -16.476 -17.545 -17.369 1.00 0.00 H new ATOM 0 HE ARG B 48 -15.990 -20.076 -18.574 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -18.583 -18.598 -16.623 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -19.817 -19.621 -17.363 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -17.628 -21.315 -19.460 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -19.295 -21.106 -18.913 1.00 0.00 H new ATOM 2063 N SER B 49 -10.842 -18.996 -16.693 1.00 0.00 N ATOM 2064 CA SER B 49 -9.803 -19.886 -16.168 1.00 0.00 C ATOM 2065 C SER B 49 -8.596 -19.040 -15.753 1.00 0.00 C ATOM 2066 O SER B 49 -8.305 -18.966 -14.571 1.00 0.00 O ATOM 2067 CB SER B 49 -9.417 -20.975 -17.187 1.00 0.00 C ATOM 2068 OG SER B 49 -9.035 -20.447 -18.451 1.00 0.00 O ATOM 0 H SER B 49 -10.952 -19.035 -17.706 1.00 0.00 H new ATOM 0 HA SER B 49 -10.187 -20.414 -15.295 1.00 0.00 H new ATOM 0 HB2 SER B 49 -8.595 -21.566 -16.784 1.00 0.00 H new ATOM 0 HB3 SER B 49 -10.260 -21.652 -17.323 1.00 0.00 H new ATOM 0 HG SER B 49 -8.081 -20.221 -18.437 1.00 0.00 H new ATOM 2074 N ASN B 50 -7.960 -18.307 -16.673 1.00 0.00 N ATOM 2075 CA ASN B 50 -6.681 -17.631 -16.437 1.00 0.00 C ATOM 2076 C ASN B 50 -6.781 -16.488 -15.405 1.00 0.00 C ATOM 2077 O ASN B 50 -5.785 -16.160 -14.765 1.00 0.00 O ATOM 2078 CB ASN B 50 -6.066 -17.146 -17.762 1.00 0.00 C ATOM 2079 CG ASN B 50 -5.710 -18.283 -18.729 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -6.443 -19.252 -18.912 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -4.593 -18.182 -19.424 1.00 0.00 N ATOM 0 H ASN B 50 -8.325 -18.165 -17.615 1.00 0.00 H new ATOM 0 HA ASN B 50 -6.012 -18.371 -15.998 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -6.767 -16.470 -18.252 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -5.166 -16.570 -17.545 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -4.348 -18.903 -20.103 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -3.975 -17.383 -19.283 1.00 0.00 H new ATOM 2088 N VAL B 51 -7.965 -15.884 -15.226 1.00 0.00 N ATOM 2089 CA VAL B 51 -8.240 -14.950 -14.118 1.00 0.00 C ATOM 2090 C VAL B 51 -8.273 -15.671 -12.751 1.00 0.00 C ATOM 2091 O VAL B 51 -7.883 -15.081 -11.739 1.00 0.00 O ATOM 2092 CB VAL B 51 -9.561 -14.178 -14.365 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -9.974 -13.346 -13.149 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -9.439 -13.218 -15.567 1.00 0.00 C ATOM 0 H VAL B 51 -8.762 -16.028 -15.846 1.00 0.00 H new ATOM 0 HA VAL B 51 -7.420 -14.232 -14.087 1.00 0.00 H new ATOM 0 HB VAL B 51 -10.315 -14.939 -14.565 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -10.905 -12.822 -13.366 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -10.119 -14.003 -12.291 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -9.193 -12.620 -12.923 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -10.384 -12.693 -15.711 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -8.647 -12.494 -15.375 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -9.200 -13.788 -16.465 1.00 0.00 H new ATOM 2104 N SER B 52 -8.687 -16.944 -12.691 1.00 0.00 N ATOM 2105 CA SER B 52 -8.749 -17.691 -11.423 1.00 0.00 C ATOM 2106 C SER B 52 -7.368 -17.828 -10.756 1.00 0.00 C ATOM 2107 O SER B 52 -7.286 -17.743 -9.530 1.00 0.00 O ATOM 2108 CB SER B 52 -9.427 -19.057 -11.600 1.00 0.00 C ATOM 2109 OG SER B 52 -10.801 -18.918 -11.953 1.00 0.00 O ATOM 0 H SER B 52 -8.985 -17.480 -13.506 1.00 0.00 H new ATOM 0 HA SER B 52 -9.369 -17.103 -10.746 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.908 -19.624 -12.372 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.344 -19.628 -10.675 1.00 0.00 H new ATOM 0 HG SER B 52 -10.876 -18.740 -12.914 1.00 0.00 H new ATOM 2115 N ASN B 53 -6.298 -17.870 -11.562 1.00 0.00 N ATOM 2116 CA ASN B 53 -4.874 -17.874 -11.182 1.00 0.00 C ATOM 2117 C ASN B 53 -4.433 -16.673 -10.321 1.00 0.00 C ATOM 2118 O ASN B 53 -3.348 -16.670 -9.744 1.00 0.00 O ATOM 2119 CB ASN B 53 -4.006 -17.929 -12.456 1.00 0.00 C ATOM 2120 CG ASN B 53 -4.316 -19.082 -13.415 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -5.453 -19.369 -13.757 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -3.305 -19.757 -13.917 1.00 0.00 N ATOM 0 H ASN B 53 -6.412 -17.905 -12.575 1.00 0.00 H new ATOM 0 HA ASN B 53 -4.735 -18.758 -10.559 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -4.123 -16.989 -12.995 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -2.959 -17.998 -12.159 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -3.475 -20.510 -14.584 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -2.351 -19.527 -13.640 1.00 0.00 H new ATOM 2129 N HIS B 54 -5.251 -15.621 -10.225 1.00 0.00 N ATOM 2130 CA HIS B 54 -5.010 -14.531 -9.277 1.00 0.00 C ATOM 2131 C HIS B 54 -6.133 -14.330 -8.237 1.00 0.00 C ATOM 2132 O HIS B 54 -5.918 -13.589 -7.270 1.00 0.00 O ATOM 2133 CB HIS B 54 -4.632 -13.270 -10.065 1.00 0.00 C ATOM 2134 CG HIS B 54 -3.144 -13.132 -10.300 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -2.151 -13.070 -9.344 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -2.526 -12.988 -11.512 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -0.982 -12.843 -9.966 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -1.170 -12.763 -11.290 1.00 0.00 N ATOM 0 H HIS B 54 -6.089 -15.502 -10.795 1.00 0.00 H new ATOM 0 HA HIS B 54 -4.167 -14.802 -8.641 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -5.144 -13.284 -11.027 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -4.990 -12.393 -9.526 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -3.008 -13.040 -12.477 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -0.028 -12.740 -9.470 1.00 0.00 H new ATOM 0 HE2 HIS B 54 -0.459 -12.574 -11.997 1.00 0.00 H new ATOM 2146 N LEU B 55 -7.274 -15.024 -8.374 1.00 0.00 N ATOM 2147 CA LEU B 55 -8.311 -15.114 -7.339 1.00 0.00 C ATOM 2148 C LEU B 55 -7.959 -16.158 -6.282 1.00 0.00 C ATOM 2149 O LEU B 55 -8.446 -16.049 -5.163 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.681 -15.488 -7.937 1.00 0.00 C ATOM 2151 CG LEU B 55 -10.309 -14.405 -8.826 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -11.463 -15.014 -9.631 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.829 -13.262 -7.946 1.00 0.00 C ATOM 0 H LEU B 55 -7.503 -15.545 -9.220 1.00 0.00 H new ATOM 0 HA LEU B 55 -8.366 -14.126 -6.881 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -9.570 -16.401 -8.523 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -10.369 -15.714 -7.122 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.560 -14.013 -9.514 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -11.910 -14.247 -10.263 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -11.084 -15.823 -10.256 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -12.216 -15.406 -8.948 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -11.275 -12.492 -8.576 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.580 -13.647 -7.256 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -10.002 -12.833 -7.380 1.00 0.00 H new ATOM 2165 N SER B 56 -7.148 -17.158 -6.609 1.00 0.00 N ATOM 2166 CA SER B 56 -6.756 -18.211 -5.673 1.00 0.00 C ATOM 2167 C SER B 56 -6.116 -17.694 -4.380 1.00 0.00 C ATOM 2168 O SER B 56 -6.594 -18.044 -3.302 1.00 0.00 O ATOM 2169 CB SER B 56 -5.828 -19.197 -6.406 1.00 0.00 C ATOM 2170 OG SER B 56 -4.892 -18.518 -7.227 1.00 0.00 O ATOM 0 H SER B 56 -6.740 -17.264 -7.538 1.00 0.00 H new ATOM 0 HA SER B 56 -7.665 -18.715 -5.344 1.00 0.00 H new ATOM 0 HB2 SER B 56 -5.297 -19.809 -5.677 1.00 0.00 H new ATOM 0 HB3 SER B 56 -6.425 -19.874 -7.017 1.00 0.00 H new ATOM 0 HG SER B 56 -4.317 -19.172 -7.677 1.00 0.00 H new ATOM 2176 N CYS B 57 -5.121 -16.803 -4.442 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.537 -16.225 -3.242 1.00 0.00 C ATOM 2178 C CYS B 57 -5.487 -15.206 -2.572 1.00 0.00 C ATOM 2179 O CYS B 57 -5.536 -15.107 -1.348 1.00 0.00 O ATOM 2180 CB CYS B 57 -3.215 -15.590 -3.664 1.00 0.00 C ATOM 2181 SG CYS B 57 -2.135 -15.329 -2.238 1.00 0.00 S ATOM 0 H CYS B 57 -4.708 -16.471 -5.313 1.00 0.00 H new ATOM 0 HA CYS B 57 -4.368 -16.992 -2.486 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.715 -16.231 -4.390 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -3.407 -14.638 -4.158 1.00 0.00 H new ATOM 2186 N LEU B 58 -6.239 -14.466 -3.399 1.00 0.00 N ATOM 2187 CA LEU B 58 -7.160 -13.382 -3.033 1.00 0.00 C ATOM 2188 C LEU B 58 -8.222 -13.853 -2.045 1.00 0.00 C ATOM 2189 O LEU B 58 -8.400 -13.244 -0.991 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.821 -12.854 -4.331 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.774 -11.332 -4.522 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.339 -10.894 -4.766 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.614 -10.956 -5.748 1.00 0.00 C ATOM 0 H LEU B 58 -6.218 -14.619 -4.407 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.602 -12.587 -2.539 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -7.334 -13.325 -5.184 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.863 -13.173 -4.343 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.164 -10.843 -3.630 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.307 -9.813 -4.902 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.724 -11.171 -3.910 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.956 -11.384 -5.662 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.586 -9.876 -5.891 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -8.209 -11.450 -6.632 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.645 -11.275 -5.594 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.898 -14.942 -2.418 1.00 0.00 N ATOM 2206 CA ARG B 59 -9.935 -15.612 -1.637 1.00 0.00 C ATOM 2207 C ARG B 59 -9.338 -16.602 -0.622 1.00 0.00 C ATOM 2208 O ARG B 59 -10.041 -17.505 -0.195 1.00 0.00 O ATOM 2209 CB ARG B 59 -10.888 -16.370 -2.582 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.483 -15.595 -3.774 1.00 0.00 C ATOM 2211 CD ARG B 59 -12.427 -16.469 -4.607 1.00 0.00 C ATOM 2212 NE ARG B 59 -11.732 -17.585 -5.273 1.00 0.00 N ATOM 2213 CZ ARG B 59 -11.571 -18.813 -4.790 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -12.152 -19.255 -3.702 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -10.754 -19.658 -5.370 1.00 0.00 N ATOM 0 H ARG B 59 -8.728 -15.400 -3.314 1.00 0.00 H new ATOM 0 HA ARG B 59 -10.478 -14.846 -1.084 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -10.352 -17.233 -2.977 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -11.715 -16.755 -1.986 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -12.024 -14.723 -3.407 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -10.676 -15.226 -4.407 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -13.210 -16.868 -3.962 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -12.918 -15.851 -5.359 1.00 0.00 H new ATOM 0 HE ARG B 59 -11.336 -17.397 -6.194 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -12.772 -18.644 -3.170 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -11.985 -20.210 -3.387 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -10.234 -19.376 -6.201 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -10.638 -20.598 -4.991 1.00 0.00 H new ATOM 2229 N GLY B 60 -8.029 -16.536 -0.349 1.00 0.00 N ATOM 2230 CA GLY B 60 -7.368 -17.250 0.747 1.00 0.00 C ATOM 2231 C GLY B 60 -6.909 -16.284 1.840 1.00 0.00 C ATOM 2232 O GLY B 60 -7.208 -16.467 3.012 1.00 0.00 O ATOM 0 H GLY B 60 -7.384 -15.969 -0.900 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -8.053 -17.984 1.171 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -6.510 -17.800 0.361 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.198 -15.225 1.449 1.00 0.00 N ATOM 2237 CA CYS B 61 -5.644 -14.195 2.321 1.00 0.00 C ATOM 2238 C CYS B 61 -6.711 -13.217 2.892 1.00 0.00 C ATOM 2239 O CYS B 61 -6.370 -12.178 3.465 1.00 0.00 O ATOM 2240 CB CYS B 61 -4.562 -13.508 1.462 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.078 -14.516 1.149 1.00 0.00 S ATOM 0 H CYS B 61 -5.984 -15.057 0.466 1.00 0.00 H new ATOM 0 HA CYS B 61 -5.223 -14.620 3.232 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -5.002 -13.228 0.505 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -4.259 -12.585 1.956 1.00 0.00 H new ATOM 2246 N GLY B 62 -7.994 -13.466 2.599 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.102 -12.605 3.003 1.00 0.00 C ATOM 2248 C GLY B 62 -9.073 -11.223 2.348 1.00 0.00 C ATOM 2249 O GLY B 62 -9.636 -10.292 2.911 1.00 0.00 O ATOM 0 H GLY B 62 -8.291 -14.284 2.067 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.043 -13.096 2.754 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.082 -12.485 4.086 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.431 -11.057 1.179 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.484 -9.840 0.350 1.00 0.00 C ATOM 2255 C LEU B 63 -9.825 -9.680 -0.372 1.00 0.00 C ATOM 2256 O LEU B 63 -10.207 -8.566 -0.736 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.350 -9.903 -0.659 1.00 0.00 C ATOM 2258 CG LEU B 63 -5.986 -10.108 0.018 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -4.978 -10.090 -1.104 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -5.630 -9.063 1.079 1.00 0.00 C ATOM 0 H LEU B 63 -7.844 -11.786 0.773 1.00 0.00 H new ATOM 0 HA LEU B 63 -8.378 -8.973 1.001 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.533 -10.718 -1.359 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.331 -8.981 -1.241 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.001 -11.045 0.574 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -3.977 -10.231 -0.696 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.200 -10.894 -1.806 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.027 -9.132 -1.622 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -4.651 -9.291 1.500 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -5.607 -8.074 0.622 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -6.378 -9.079 1.871 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.545 -10.790 -0.533 1.00 0.00 N ATOM 2273 CA VAL B 64 -11.893 -10.892 -1.098 1.00 0.00 C ATOM 2274 C VAL B 64 -12.677 -11.998 -0.391 1.00 0.00 C ATOM 2275 O VAL B 64 -12.087 -12.941 0.132 1.00 0.00 O ATOM 2276 CB VAL B 64 -11.881 -11.188 -2.617 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.624 -9.933 -3.456 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.862 -12.247 -2.983 1.00 0.00 C ATOM 0 H VAL B 64 -10.180 -11.701 -0.255 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.369 -9.923 -0.945 1.00 0.00 H new ATOM 0 HB VAL B 64 -12.879 -11.561 -2.847 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.626 -10.196 -4.514 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.407 -9.200 -3.263 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.656 -9.509 -3.189 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.889 -12.422 -4.059 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.866 -11.909 -2.695 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -11.096 -13.174 -2.459 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.001 -11.864 -0.407 1.00 0.00 N ATOM 2289 CA VAL B 65 -14.990 -12.741 0.239 1.00 0.00 C ATOM 2290 C VAL B 65 -16.142 -13.020 -0.743 1.00 0.00 C ATOM 2291 O VAL B 65 -16.536 -12.133 -1.500 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.517 -12.057 1.528 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.642 -12.841 2.220 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.379 -11.819 2.540 1.00 0.00 C ATOM 0 H VAL B 65 -14.446 -11.091 -0.902 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.529 -13.690 0.512 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.930 -11.104 1.198 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -16.962 -12.305 3.114 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.486 -12.946 1.538 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -16.278 -13.829 2.500 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.780 -11.338 3.432 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.929 -12.774 2.813 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.622 -11.176 2.091 1.00 0.00 H new ATOM 2304 N ALA B 66 -16.676 -14.244 -0.756 1.00 0.00 N ATOM 2305 CA ALA B 66 -17.854 -14.642 -1.547 1.00 0.00 C ATOM 2306 C ALA B 66 -19.197 -14.325 -0.871 1.00 0.00 C ATOM 2307 O ALA B 66 -19.323 -14.197 0.347 1.00 0.00 O ATOM 2308 CB ALA B 66 -17.731 -16.137 -1.878 1.00 0.00 C ATOM 0 H ALA B 66 -16.293 -15.011 -0.202 1.00 0.00 H new ATOM 0 HA ALA B 66 -17.860 -14.046 -2.460 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -18.594 -16.452 -2.464 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -16.820 -16.309 -2.452 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -17.691 -16.712 -0.953 1.00 0.00 H new ATOM 2314 N THR B 67 -20.233 -14.177 -1.700 1.00 0.00 N ATOM 2315 CA THR B 67 -21.614 -13.826 -1.329 1.00 0.00 C ATOM 2316 C THR B 67 -22.513 -14.252 -2.490 1.00 0.00 C ATOM 2317 O THR B 67 -21.993 -14.615 -3.537 1.00 0.00 O ATOM 2318 CB THR B 67 -21.720 -12.313 -1.063 1.00 0.00 C ATOM 2319 OG1 THR B 67 -20.756 -11.882 -0.136 1.00 0.00 O ATOM 2320 CG2 THR B 67 -23.065 -11.868 -0.488 1.00 0.00 C ATOM 0 H THR B 67 -20.129 -14.305 -2.707 1.00 0.00 H new ATOM 0 HA THR B 67 -21.921 -14.334 -0.414 1.00 0.00 H new ATOM 0 HB THR B 67 -21.577 -11.873 -2.050 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.850 -10.917 0.009 1.00 0.00 H new ATOM 0 HG21 THR B 67 -23.055 -10.789 -0.331 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.862 -12.125 -1.186 1.00 0.00 H new ATOM 0 HG23 THR B 67 -23.239 -12.372 0.463 1.00 0.00 H new ATOM 2328 N TYR B 68 -23.834 -14.194 -2.362 1.00 0.00 N ATOM 2329 CA TYR B 68 -24.747 -14.350 -3.506 1.00 0.00 C ATOM 2330 C TYR B 68 -25.111 -12.986 -4.138 1.00 0.00 C ATOM 2331 O TYR B 68 -25.077 -11.959 -3.449 1.00 0.00 O ATOM 2332 CB TYR B 68 -25.987 -15.151 -3.057 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.334 -16.305 -3.981 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -25.383 -17.317 -4.218 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.588 -16.364 -4.619 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -25.656 -18.348 -5.135 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.865 -17.388 -5.545 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.889 -18.372 -5.824 1.00 0.00 C ATOM 2339 OH TYR B 68 -27.121 -19.324 -6.770 1.00 0.00 O ATOM 0 H TYR B 68 -24.307 -14.039 -1.472 1.00 0.00 H new ATOM 0 HA TYR B 68 -24.246 -14.911 -4.295 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -25.814 -15.540 -2.053 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -26.841 -14.477 -2.995 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -24.439 -17.301 -3.693 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -28.340 -15.621 -4.397 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -24.923 -19.121 -5.312 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -28.823 -17.422 -6.042 1.00 0.00 H new ATOM 0 HH TYR B 68 -27.448 -18.898 -7.590 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.431 -12.955 -5.437 1.00 0.00 N ATOM 2350 CA GLU B 69 -26.049 -11.794 -6.112 1.00 0.00 C ATOM 2351 C GLU B 69 -27.587 -11.929 -6.207 1.00 0.00 C ATOM 2352 O GLU B 69 -28.261 -10.976 -6.584 1.00 0.00 O ATOM 2353 CB GLU B 69 -25.325 -11.404 -7.433 1.00 0.00 C ATOM 2354 CG GLU B 69 -25.110 -12.379 -8.602 1.00 0.00 C ATOM 2355 CD GLU B 69 -26.377 -12.790 -9.337 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -27.230 -13.388 -8.671 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -26.484 -12.681 -10.580 1.00 0.00 O ATOM 0 H GLU B 69 -25.268 -13.744 -6.063 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.893 -10.922 -5.476 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -25.868 -10.551 -7.840 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.336 -11.045 -7.147 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -24.426 -11.921 -9.316 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -24.621 -13.276 -8.222 1.00 0.00 H new ATOM 2364 N GLY B 70 -28.138 -13.078 -5.775 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.573 -13.407 -5.709 1.00 0.00 C ATOM 2366 C GLY B 70 -29.938 -14.644 -6.539 1.00 0.00 C ATOM 2367 O GLY B 70 -30.777 -15.444 -6.139 1.00 0.00 O ATOM 0 H GLY B 70 -27.558 -13.848 -5.443 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -29.855 -13.576 -4.670 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -30.153 -12.554 -6.062 1.00 0.00 H new ATOM 2371 N ARG B 71 -29.256 -14.814 -7.668 1.00 0.00 N ATOM 2372 CA ARG B 71 -29.388 -15.835 -8.716 1.00 0.00 C ATOM 2373 C ARG B 71 -28.082 -16.646 -8.897 1.00 0.00 C ATOM 2374 O ARG B 71 -28.137 -17.818 -9.274 1.00 0.00 O ATOM 2375 CB ARG B 71 -29.759 -15.036 -9.984 1.00 0.00 C ATOM 2376 CG ARG B 71 -29.640 -15.743 -11.346 1.00 0.00 C ATOM 2377 CD ARG B 71 -29.687 -14.730 -12.504 1.00 0.00 C ATOM 2378 NE ARG B 71 -28.566 -13.763 -12.462 1.00 0.00 N ATOM 2379 CZ ARG B 71 -28.149 -12.964 -13.435 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -28.678 -12.967 -14.644 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -27.173 -12.134 -13.168 1.00 0.00 N ATOM 0 H ARG B 71 -28.506 -14.163 -7.903 1.00 0.00 H new ATOM 0 HA ARG B 71 -30.142 -16.584 -8.472 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -30.788 -14.695 -9.874 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -29.130 -14.146 -10.014 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -28.706 -16.304 -11.387 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -30.450 -16.464 -11.457 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -29.663 -15.267 -13.452 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -30.632 -14.187 -12.469 1.00 0.00 H new ATOM 0 HE ARG B 71 -28.055 -13.705 -11.581 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -29.444 -13.604 -14.864 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -28.321 -12.332 -15.358 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -26.759 -12.117 -12.236 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -26.826 -11.505 -13.892 1.00 0.00 H new ATOM 2395 N GLN B 72 -26.914 -16.059 -8.641 1.00 0.00 N ATOM 2396 CA GLN B 72 -25.563 -16.626 -8.753 1.00 0.00 C ATOM 2397 C GLN B 72 -24.712 -16.263 -7.524 1.00 0.00 C ATOM 2398 O GLN B 72 -25.095 -15.417 -6.721 1.00 0.00 O ATOM 2399 CB GLN B 72 -24.841 -16.046 -9.991 1.00 0.00 C ATOM 2400 CG GLN B 72 -25.510 -16.275 -11.347 1.00 0.00 C ATOM 2401 CD GLN B 72 -25.444 -17.732 -11.795 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -24.556 -18.125 -12.533 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -26.333 -18.595 -11.351 1.00 0.00 N ATOM 0 H GLN B 72 -26.882 -15.091 -8.322 1.00 0.00 H new ATOM 0 HA GLN B 72 -25.672 -17.707 -8.834 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -24.726 -14.972 -9.846 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -23.838 -16.471 -10.030 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -26.553 -15.963 -11.291 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -25.029 -15.646 -12.096 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -27.082 -18.283 -10.733 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -26.273 -19.576 -11.625 1.00 0.00 H new ATOM 2412 N VAL B 73 -23.518 -16.854 -7.423 1.00 0.00 N ATOM 2413 CA VAL B 73 -22.476 -16.481 -6.454 1.00 0.00 C ATOM 2414 C VAL B 73 -21.593 -15.365 -7.026 1.00 0.00 C ATOM 2415 O VAL B 73 -21.388 -15.286 -8.241 1.00 0.00 O ATOM 2416 CB VAL B 73 -21.652 -17.724 -6.026 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -20.777 -18.278 -7.166 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -20.786 -17.483 -4.780 1.00 0.00 C ATOM 0 H VAL B 73 -23.239 -17.626 -8.028 1.00 0.00 H new ATOM 0 HA VAL B 73 -22.951 -16.091 -5.554 1.00 0.00 H new ATOM 0 HB VAL B 73 -22.403 -18.472 -5.770 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -20.223 -19.147 -6.810 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -21.412 -18.570 -8.003 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -20.076 -17.510 -7.493 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -20.237 -18.393 -4.537 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -20.081 -16.676 -4.978 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -21.425 -17.209 -3.940 1.00 0.00 H new ATOM 2428 N ARG B 74 -21.053 -14.526 -6.139 1.00 0.00 N ATOM 2429 CA ARG B 74 -20.278 -13.330 -6.437 1.00 0.00 C ATOM 2430 C ARG B 74 -19.072 -13.252 -5.510 1.00 0.00 C ATOM 2431 O ARG B 74 -18.962 -13.994 -4.533 1.00 0.00 O ATOM 2432 CB ARG B 74 -21.165 -12.080 -6.299 1.00 0.00 C ATOM 2433 CG ARG B 74 -21.336 -11.460 -4.896 1.00 0.00 C ATOM 2434 CD ARG B 74 -22.407 -10.362 -4.924 1.00 0.00 C ATOM 2435 NE ARG B 74 -22.787 -9.903 -3.579 1.00 0.00 N ATOM 2436 CZ ARG B 74 -22.196 -8.923 -2.905 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.157 -8.272 -3.392 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -22.644 -8.577 -1.718 1.00 0.00 N ATOM 0 H ARG B 74 -21.154 -14.677 -5.135 1.00 0.00 H new ATOM 0 HA ARG B 74 -19.917 -13.378 -7.465 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -20.761 -11.310 -6.956 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -22.157 -12.332 -6.675 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.618 -12.233 -4.181 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -20.387 -11.043 -4.557 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -22.037 -9.515 -5.501 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -23.292 -10.737 -5.439 1.00 0.00 H new ATOM 0 HE ARG B 74 -23.569 -10.377 -3.127 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -20.786 -8.517 -4.310 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -20.724 -7.524 -2.850 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -23.446 -9.061 -1.314 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -22.190 -7.824 -1.201 1.00 0.00 H new ATOM 2452 N TYR B 75 -18.197 -12.294 -5.783 1.00 0.00 N ATOM 2453 CA TYR B 75 -17.124 -11.898 -4.874 1.00 0.00 C ATOM 2454 C TYR B 75 -17.345 -10.457 -4.388 1.00 0.00 C ATOM 2455 O TYR B 75 -18.248 -9.765 -4.856 1.00 0.00 O ATOM 2456 CB TYR B 75 -15.768 -12.116 -5.565 1.00 0.00 C ATOM 2457 CG TYR B 75 -15.505 -13.556 -5.984 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -15.764 -14.619 -5.091 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -15.019 -13.842 -7.275 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -15.580 -15.954 -5.489 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -14.791 -15.178 -7.664 1.00 0.00 C ATOM 2462 CZ TYR B 75 -15.082 -16.239 -6.779 1.00 0.00 C ATOM 2463 OH TYR B 75 -14.859 -17.529 -7.155 1.00 0.00 O ATOM 0 H TYR B 75 -18.210 -11.761 -6.653 1.00 0.00 H new ATOM 0 HA TYR B 75 -17.128 -12.520 -3.979 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -15.716 -11.478 -6.447 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -14.974 -11.795 -4.891 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -16.108 -14.403 -4.090 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.821 -13.037 -7.967 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -15.819 -16.759 -4.810 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -14.391 -15.391 -8.645 1.00 0.00 H new ATOM 0 HH TYR B 75 -14.518 -17.548 -8.073 1.00 0.00 H new ATOM 2473 N ALA B 76 -16.536 -10.025 -3.430 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.531 -8.701 -2.815 1.00 0.00 C ATOM 2475 C ALA B 76 -15.175 -8.502 -2.138 1.00 0.00 C ATOM 2476 O ALA B 76 -14.571 -9.487 -1.725 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.678 -8.606 -1.799 1.00 0.00 C ATOM 0 H ALA B 76 -15.817 -10.630 -3.034 1.00 0.00 H new ATOM 0 HA ALA B 76 -16.680 -7.921 -3.561 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.676 -7.618 -1.339 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.629 -8.767 -2.307 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.545 -9.365 -1.028 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.698 -7.265 -2.030 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.498 -6.900 -1.278 1.00 0.00 C ATOM 2485 C LEU B 77 -13.594 -7.240 0.216 1.00 0.00 C ATOM 2486 O LEU B 77 -14.684 -7.328 0.773 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.268 -5.400 -1.500 1.00 0.00 C ATOM 2488 CG LEU B 77 -11.792 -5.081 -1.706 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.264 -5.591 -3.047 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -11.711 -3.569 -1.677 1.00 0.00 C ATOM 0 H LEU B 77 -15.148 -6.465 -2.475 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.652 -7.485 -1.640 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -13.837 -5.069 -2.369 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.644 -4.843 -0.642 1.00 0.00 H new ATOM 0 HG LEU B 77 -11.187 -5.564 -0.939 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.208 -5.337 -3.143 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -11.383 -6.673 -3.097 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -11.824 -5.126 -3.859 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.676 -3.257 -1.819 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -12.327 -3.156 -2.476 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -12.071 -3.204 -0.715 1.00 0.00 H new ATOM 2502 N ALA B 78 -12.431 -7.372 0.861 1.00 0.00 N ATOM 2503 CA ALA B 78 -12.280 -7.748 2.268 1.00 0.00 C ATOM 2504 C ALA B 78 -13.038 -6.886 3.290 1.00 0.00 C ATOM 2505 O ALA B 78 -13.350 -7.370 4.374 1.00 0.00 O ATOM 2506 CB ALA B 78 -10.791 -7.587 2.578 1.00 0.00 C ATOM 0 H ALA B 78 -11.536 -7.214 0.399 1.00 0.00 H new ATOM 0 HA ALA B 78 -12.691 -8.753 2.370 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -10.605 -7.853 3.619 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -10.211 -8.241 1.927 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -10.494 -6.552 2.409 1.00 0.00 H new ATOM 2512 N ASP B 79 -13.215 -5.598 2.972 1.00 0.00 N ATOM 2513 CA ASP B 79 -13.657 -4.515 3.858 1.00 0.00 C ATOM 2514 C ASP B 79 -13.560 -3.178 3.105 1.00 0.00 C ATOM 2515 O ASP B 79 -12.717 -2.990 2.222 1.00 0.00 O ATOM 2516 CB ASP B 79 -12.772 -4.533 5.134 1.00 0.00 C ATOM 2517 CG ASP B 79 -12.885 -3.431 6.192 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -13.731 -2.509 6.094 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -12.025 -3.527 7.098 1.00 0.00 O ATOM 0 H ASP B 79 -13.041 -5.262 2.025 1.00 0.00 H new ATOM 0 HA ASP B 79 -14.696 -4.648 4.160 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -12.961 -5.480 5.639 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -11.734 -4.550 4.802 1.00 0.00 H new ATOM 2524 N SER B 80 -14.398 -2.230 3.514 1.00 0.00 N ATOM 2525 CA SER B 80 -14.335 -0.808 3.162 1.00 0.00 C ATOM 2526 C SER B 80 -12.906 -0.233 3.239 1.00 0.00 C ATOM 2527 O SER B 80 -12.525 0.632 2.452 1.00 0.00 O ATOM 2528 CB SER B 80 -15.240 -0.056 4.152 1.00 0.00 C ATOM 2529 OG SER B 80 -14.736 -0.085 5.486 1.00 0.00 O ATOM 0 H SER B 80 -15.182 -2.440 4.132 1.00 0.00 H new ATOM 0 HA SER B 80 -14.661 -0.689 2.129 1.00 0.00 H new ATOM 0 HB2 SER B 80 -15.344 0.980 3.829 1.00 0.00 H new ATOM 0 HB3 SER B 80 -16.237 -0.497 4.134 1.00 0.00 H new ATOM 0 HG SER B 80 -14.556 -1.012 5.748 1.00 0.00 H new ATOM 2535 N HIS B 81 -12.089 -0.780 4.148 1.00 0.00 N ATOM 2536 CA HIS B 81 -10.664 -0.525 4.287 1.00 0.00 C ATOM 2537 C HIS B 81 -9.875 -0.735 3.002 1.00 0.00 C ATOM 2538 O HIS B 81 -9.232 0.214 2.552 1.00 0.00 O ATOM 2539 CB HIS B 81 -10.125 -1.424 5.405 1.00 0.00 C ATOM 2540 CG HIS B 81 -10.299 -0.846 6.779 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -10.716 0.432 7.088 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -9.631 -1.328 7.858 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -10.203 0.756 8.286 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -9.616 -0.334 8.820 1.00 0.00 N ATOM 0 H HIS B 81 -12.430 -1.447 4.840 1.00 0.00 H new ATOM 0 HA HIS B 81 -10.535 0.529 4.533 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -10.631 -2.389 5.359 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -9.065 -1.611 5.230 1.00 0.00 H new ATOM 0 HD1 HIS B 81 -11.309 1.026 6.509 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -9.191 -2.310 7.949 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -10.253 1.731 8.747 1.00 0.00 H new ATOM 2553 N LEU B 82 -9.892 -1.936 2.406 1.00 0.00 N ATOM 2554 CA LEU B 82 -9.203 -2.117 1.124 1.00 0.00 C ATOM 2555 C LEU B 82 -9.841 -1.174 0.101 1.00 0.00 C ATOM 2556 O LEU B 82 -9.105 -0.451 -0.559 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.161 -3.584 0.635 1.00 0.00 C ATOM 2558 CG LEU B 82 -8.486 -4.624 1.542 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.269 -5.920 0.749 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -7.147 -4.174 2.139 1.00 0.00 C ATOM 0 H LEU B 82 -10.356 -2.766 2.774 1.00 0.00 H new ATOM 0 HA LEU B 82 -8.152 -1.862 1.259 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.187 -3.908 0.460 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -8.653 -3.601 -0.329 1.00 0.00 H new ATOM 0 HG LEU B 82 -9.161 -4.772 2.385 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -7.790 -6.662 1.388 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.231 -6.303 0.407 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -7.632 -5.717 -0.112 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -6.742 -4.969 2.765 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -6.446 -3.953 1.334 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -7.300 -3.279 2.743 1.00 0.00 H new ATOM 2572 N ALA B 83 -11.178 -1.101 0.053 1.00 0.00 N ATOM 2573 CA ALA B 83 -11.940 -0.364 -0.962 1.00 0.00 C ATOM 2574 C ALA B 83 -11.527 1.117 -1.040 1.00 0.00 C ATOM 2575 O ALA B 83 -11.511 1.669 -2.133 1.00 0.00 O ATOM 2576 CB ALA B 83 -13.441 -0.503 -0.667 1.00 0.00 C ATOM 0 H ALA B 83 -11.775 -1.566 0.738 1.00 0.00 H new ATOM 0 HA ALA B 83 -11.718 -0.797 -1.938 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.012 0.043 -1.418 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -13.721 -1.556 -0.693 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -13.657 -0.095 0.320 1.00 0.00 H new ATOM 2582 N ARG B 84 -11.150 1.735 0.089 1.00 0.00 N ATOM 2583 CA ARG B 84 -10.640 3.111 0.150 1.00 0.00 C ATOM 2584 C ARG B 84 -9.232 3.267 -0.453 1.00 0.00 C ATOM 2585 O ARG B 84 -9.067 4.046 -1.387 1.00 0.00 O ATOM 2586 CB ARG B 84 -10.635 3.599 1.606 1.00 0.00 C ATOM 2587 CG ARG B 84 -12.018 3.998 2.144 1.00 0.00 C ATOM 2588 CD ARG B 84 -11.984 4.194 3.672 1.00 0.00 C ATOM 2589 NE ARG B 84 -12.742 5.389 4.100 1.00 0.00 N ATOM 2590 CZ ARG B 84 -12.230 6.605 4.289 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -10.951 6.860 4.150 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -13.014 7.609 4.617 1.00 0.00 N ATOM 0 H ARG B 84 -11.192 1.283 1.002 1.00 0.00 H new ATOM 0 HA ARG B 84 -11.311 3.720 -0.456 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -10.225 2.812 2.239 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -9.965 4.455 1.688 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -12.346 4.920 1.663 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -12.747 3.228 1.889 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -12.397 3.311 4.159 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -10.949 4.285 4.002 1.00 0.00 H new ATOM 0 HE ARG B 84 -13.742 5.273 4.265 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -10.308 6.113 3.888 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -10.600 7.805 4.304 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -14.017 7.458 4.727 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -12.619 8.538 4.761 1.00 0.00 H new ATOM 2606 N ALA B 85 -8.217 2.531 0.017 1.00 0.00 N ATOM 2607 CA ALA B 85 -6.838 2.662 -0.498 1.00 0.00 C ATOM 2608 C ALA B 85 -6.702 2.193 -1.963 1.00 0.00 C ATOM 2609 O ALA B 85 -6.005 2.799 -2.777 1.00 0.00 O ATOM 2610 CB ALA B 85 -5.905 1.872 0.426 1.00 0.00 C ATOM 0 H ALA B 85 -8.320 1.835 0.755 1.00 0.00 H new ATOM 0 HA ALA B 85 -6.564 3.717 -0.501 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -4.880 1.954 0.065 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -5.967 2.275 1.437 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -6.203 0.824 0.435 1.00 0.00 H new ATOM 2616 N LEU B 86 -7.435 1.133 -2.303 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.651 0.626 -3.655 1.00 0.00 C ATOM 2618 C LEU B 86 -8.401 1.644 -4.534 1.00 0.00 C ATOM 2619 O LEU B 86 -8.111 1.744 -5.725 1.00 0.00 O ATOM 2620 CB LEU B 86 -8.462 -0.663 -3.457 1.00 0.00 C ATOM 2621 CG LEU B 86 -8.839 -1.447 -4.709 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.698 -2.157 -5.409 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -9.864 -2.504 -4.303 1.00 0.00 C ATOM 0 H LEU B 86 -7.921 0.575 -1.601 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.713 0.443 -4.179 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -7.893 -1.324 -2.803 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -9.381 -0.407 -2.929 1.00 0.00 H new ATOM 0 HG LEU B 86 -9.214 -0.711 -5.421 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -8.079 -2.682 -6.285 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -6.951 -1.427 -5.720 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -7.242 -2.874 -4.726 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -10.155 -3.084 -5.179 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -9.426 -3.168 -3.557 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -10.743 -2.016 -3.882 1.00 0.00 H new ATOM 2635 N GLY B 87 -9.327 2.405 -3.933 1.00 0.00 N ATOM 2636 CA GLY B 87 -10.241 3.356 -4.580 1.00 0.00 C ATOM 2637 C GLY B 87 -9.653 4.747 -4.813 1.00 0.00 C ATOM 2638 O GLY B 87 -10.028 5.389 -5.789 1.00 0.00 O ATOM 0 H GLY B 87 -9.466 2.371 -2.923 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -10.554 2.943 -5.539 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -11.137 3.453 -3.967 1.00 0.00 H new ATOM 2642 N GLU B 88 -8.716 5.207 -3.975 1.00 0.00 N ATOM 2643 CA GLU B 88 -7.919 6.408 -4.280 1.00 0.00 C ATOM 2644 C GLU B 88 -6.856 6.124 -5.367 1.00 0.00 C ATOM 2645 O GLU B 88 -6.235 7.053 -5.888 1.00 0.00 O ATOM 2646 CB GLU B 88 -7.329 7.019 -2.990 1.00 0.00 C ATOM 2647 CG GLU B 88 -6.005 6.420 -2.443 1.00 0.00 C ATOM 2648 CD GLU B 88 -4.825 7.406 -2.333 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -4.930 8.560 -2.814 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -3.781 7.033 -1.751 1.00 0.00 O ATOM 0 H GLU B 88 -8.489 4.769 -3.082 1.00 0.00 H new ATOM 0 HA GLU B 88 -8.580 7.163 -4.705 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -7.167 8.082 -3.167 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -8.082 6.937 -2.206 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -6.197 6.000 -1.456 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -5.706 5.594 -3.089 1.00 0.00 H new ATOM 2657 N LEU B 89 -6.677 4.823 -5.667 1.00 0.00 N ATOM 2658 CA LEU B 89 -5.646 4.157 -6.460 1.00 0.00 C ATOM 2659 C LEU B 89 -4.375 4.162 -5.613 1.00 0.00 C ATOM 2660 O LEU B 89 -3.973 5.213 -5.138 1.00 0.00 O ATOM 2661 CB LEU B 89 -5.464 4.791 -7.857 1.00 0.00 C ATOM 2662 CG LEU B 89 -4.443 4.070 -8.761 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -4.828 2.612 -9.056 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -4.296 4.839 -10.082 1.00 0.00 C ATOM 0 H LEU B 89 -7.340 4.135 -5.310 1.00 0.00 H new ATOM 0 HA LEU B 89 -5.934 3.131 -6.688 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -6.429 4.807 -8.363 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -5.151 5.828 -7.733 1.00 0.00 H new ATOM 0 HG LEU B 89 -3.497 4.048 -8.221 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -4.071 2.158 -9.696 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -4.892 2.056 -8.121 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -5.794 2.586 -9.561 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -3.575 4.330 -10.721 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -5.261 4.882 -10.587 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -3.948 5.851 -9.877 1.00 0.00 H new ATOM 2676 N VAL B 90 -3.665 3.035 -5.512 1.00 0.00 N ATOM 2677 CA VAL B 90 -2.580 2.834 -4.515 1.00 0.00 C ATOM 2678 C VAL B 90 -1.338 3.703 -4.746 1.00 0.00 C ATOM 2679 O VAL B 90 -0.362 3.631 -4.002 1.00 0.00 O ATOM 2680 CB VAL B 90 -2.281 1.326 -4.331 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -1.097 0.918 -3.435 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -3.543 0.715 -3.709 1.00 0.00 C ATOM 0 H VAL B 90 -3.818 2.227 -6.115 1.00 0.00 H new ATOM 0 HA VAL B 90 -2.952 3.204 -3.560 1.00 0.00 H new ATOM 0 HB VAL B 90 -1.999 0.971 -5.322 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -1.019 -0.169 -3.408 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -0.175 1.338 -3.837 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -1.258 1.296 -2.425 1.00 0.00 H new ATOM 0 HG21 VAL B 90 -3.392 -0.353 -3.555 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -3.746 1.195 -2.752 1.00 0.00 H new ATOM 0 HG23 VAL B 90 -4.390 0.869 -4.378 1.00 0.00 H new ATOM 2692 N GLN B 91 -1.394 4.615 -5.725 1.00 0.00 N ATOM 2693 CA GLN B 91 -0.855 5.974 -5.579 1.00 0.00 C ATOM 2694 C GLN B 91 0.639 6.033 -5.941 1.00 0.00 C ATOM 2695 O GLN B 91 1.124 7.031 -6.457 1.00 0.00 O ATOM 2696 CB GLN B 91 -1.211 6.469 -4.164 1.00 0.00 C ATOM 2697 CG GLN B 91 -1.492 7.954 -4.006 1.00 0.00 C ATOM 2698 CD GLN B 91 -2.575 8.624 -4.856 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -2.569 9.841 -4.995 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -3.433 7.934 -5.568 1.00 0.00 N ATOM 0 H GLN B 91 -1.812 4.433 -6.637 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.310 6.663 -6.290 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -2.088 5.919 -3.823 1.00 0.00 H new ATOM 0 HB3 GLN B 91 -0.391 6.206 -3.496 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -1.748 8.126 -2.961 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -0.558 8.482 -4.196 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -3.468 6.918 -5.480 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -4.065 8.413 -6.210 1.00 0.00 H new ATOM 2709 N VAL B 92 1.308 4.891 -5.808 1.00 0.00 N ATOM 2710 CA VAL B 92 2.631 4.406 -6.246 1.00 0.00 C ATOM 2711 C VAL B 92 2.922 4.559 -7.750 1.00 0.00 C ATOM 2712 O VAL B 92 3.724 3.840 -8.328 1.00 0.00 O ATOM 2713 CB VAL B 92 2.709 2.940 -5.742 1.00 0.00 C ATOM 2714 CG1 VAL B 92 1.562 2.058 -6.293 1.00 0.00 C ATOM 2715 CG2 VAL B 92 3.981 2.140 -6.027 1.00 0.00 C ATOM 0 H VAL B 92 0.849 4.140 -5.293 1.00 0.00 H new ATOM 0 HA VAL B 92 3.420 5.026 -5.820 1.00 0.00 H new ATOM 0 HB VAL B 92 2.659 3.124 -4.669 1.00 0.00 H new ATOM 0 HG11 VAL B 92 1.666 1.043 -5.908 1.00 0.00 H new ATOM 0 HG12 VAL B 92 0.603 2.469 -5.977 1.00 0.00 H new ATOM 0 HG13 VAL B 92 1.608 2.040 -7.382 1.00 0.00 H new ATOM 0 HG21 VAL B 92 3.881 1.137 -5.612 1.00 0.00 H new ATOM 0 HG22 VAL B 92 4.135 2.073 -7.104 1.00 0.00 H new ATOM 0 HG23 VAL B 92 4.835 2.639 -5.568 1.00 0.00 H new ATOM 2725 N VAL B 93 2.275 5.521 -8.399 1.00 0.00 N ATOM 2726 CA VAL B 93 2.517 5.952 -9.785 1.00 0.00 C ATOM 2727 C VAL B 93 2.256 4.844 -10.836 1.00 0.00 C ATOM 2728 O VAL B 93 2.667 5.004 -11.979 1.00 0.00 O ATOM 2729 CB VAL B 93 3.936 6.582 -9.979 1.00 0.00 C ATOM 2730 CG1 VAL B 93 3.825 7.772 -10.942 1.00 0.00 C ATOM 2731 CG2 VAL B 93 4.603 7.146 -8.704 1.00 0.00 C ATOM 0 H VAL B 93 1.527 6.054 -7.955 1.00 0.00 H new ATOM 0 HA VAL B 93 1.777 6.732 -9.965 1.00 0.00 H new ATOM 0 HB VAL B 93 4.549 5.756 -10.339 1.00 0.00 H new ATOM 0 HG11 VAL B 93 4.809 8.218 -11.084 1.00 0.00 H new ATOM 0 HG12 VAL B 93 3.441 7.428 -11.902 1.00 0.00 H new ATOM 0 HG13 VAL B 93 3.146 8.516 -10.525 1.00 0.00 H new ATOM 0 HG21 VAL B 93 5.581 7.557 -8.956 1.00 0.00 H new ATOM 0 HG22 VAL B 93 3.977 7.932 -8.283 1.00 0.00 H new ATOM 0 HG23 VAL B 93 4.723 6.347 -7.972 1.00 0.00 H new ATOM 2741 N LEU B 94 1.577 3.747 -10.438 1.00 0.00 N ATOM 2742 CA LEU B 94 1.401 2.464 -11.157 1.00 0.00 C ATOM 2743 C LEU B 94 2.527 1.502 -10.735 1.00 0.00 C ATOM 2744 O LEU B 94 3.672 1.605 -11.168 1.00 0.00 O ATOM 2745 CB LEU B 94 1.296 2.617 -12.697 1.00 0.00 C ATOM 2746 CG LEU B 94 0.684 1.422 -13.463 1.00 0.00 C ATOM 2747 CD1 LEU B 94 0.494 1.824 -14.934 1.00 0.00 C ATOM 2748 CD2 LEU B 94 1.521 0.135 -13.405 1.00 0.00 C ATOM 0 H LEU B 94 1.100 3.733 -9.536 1.00 0.00 H new ATOM 0 HA LEU B 94 0.437 2.045 -10.869 1.00 0.00 H new ATOM 0 HB2 LEU B 94 0.700 3.504 -12.913 1.00 0.00 H new ATOM 0 HB3 LEU B 94 2.295 2.801 -13.092 1.00 0.00 H new ATOM 0 HG LEU B 94 -0.262 1.194 -12.972 1.00 0.00 H new ATOM 0 HD11 LEU B 94 0.063 0.989 -15.486 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -0.175 2.683 -14.993 1.00 0.00 H new ATOM 0 HD13 LEU B 94 1.459 2.086 -15.367 1.00 0.00 H new ATOM 0 HD21 LEU B 94 1.018 -0.652 -13.968 1.00 0.00 H new ATOM 0 HD22 LEU B 94 2.504 0.320 -13.839 1.00 0.00 H new ATOM 0 HD23 LEU B 94 1.635 -0.178 -12.367 1.00 0.00 H new ATOM 2760 N ALA B 95 2.170 0.537 -9.885 1.00 0.00 N ATOM 2761 CA ALA B 95 3.032 -0.534 -9.386 1.00 0.00 C ATOM 2762 C ALA B 95 3.575 -1.521 -10.456 1.00 0.00 C ATOM 2763 O ALA B 95 3.233 -2.695 -10.393 1.00 0.00 O ATOM 2764 CB ALA B 95 2.259 -1.254 -8.265 1.00 0.00 C ATOM 0 H ALA B 95 1.224 0.479 -9.508 1.00 0.00 H new ATOM 0 HA ALA B 95 3.948 -0.076 -9.013 1.00 0.00 H new ATOM 0 HB1 ALA B 95 2.869 -2.063 -7.864 1.00 0.00 H new ATOM 0 HB2 ALA B 95 2.028 -0.546 -7.470 1.00 0.00 H new ATOM 0 HB3 ALA B 95 1.332 -1.663 -8.667 1.00 0.00 H new ATOM 2770 N VAL B 96 4.421 -1.074 -11.396 1.00 0.00 N ATOM 2771 CA VAL B 96 5.204 -1.982 -12.275 1.00 0.00 C ATOM 2772 C VAL B 96 6.010 -2.942 -11.392 1.00 0.00 C ATOM 2773 O VAL B 96 6.710 -2.459 -10.499 1.00 0.00 O ATOM 2774 CB VAL B 96 6.248 -1.261 -13.165 1.00 0.00 C ATOM 2775 CG1 VAL B 96 6.875 -2.160 -14.245 1.00 0.00 C ATOM 2776 CG2 VAL B 96 5.720 -0.034 -13.899 1.00 0.00 C ATOM 0 H VAL B 96 4.587 -0.084 -11.575 1.00 0.00 H new ATOM 0 HA VAL B 96 4.473 -2.471 -12.919 1.00 0.00 H new ATOM 0 HB VAL B 96 6.992 -0.964 -12.425 1.00 0.00 H new ATOM 0 HG11 VAL B 96 7.595 -1.583 -14.826 1.00 0.00 H new ATOM 0 HG12 VAL B 96 7.382 -3.000 -13.770 1.00 0.00 H new ATOM 0 HG13 VAL B 96 6.093 -2.535 -14.905 1.00 0.00 H new ATOM 0 HG21 VAL B 96 6.519 0.405 -14.496 1.00 0.00 H new ATOM 0 HG22 VAL B 96 4.898 -0.327 -14.552 1.00 0.00 H new ATOM 0 HG23 VAL B 96 5.365 0.699 -13.174 1.00 0.00 H new ATOM 2786 N ASP B 97 5.950 -4.248 -11.663 1.00 0.00 N ATOM 2787 CA ASP B 97 6.655 -5.309 -10.924 1.00 0.00 C ATOM 2788 C ASP B 97 8.192 -5.102 -10.944 1.00 0.00 C ATOM 2789 O ASP B 97 8.742 -4.399 -10.087 1.00 0.00 O ATOM 2790 CB ASP B 97 6.168 -6.660 -11.480 1.00 0.00 C ATOM 2791 CG ASP B 97 6.871 -7.874 -10.859 1.00 0.00 C ATOM 2792 OD1 ASP B 97 6.654 -8.145 -9.649 1.00 0.00 O ATOM 2793 OD2 ASP B 97 7.633 -8.504 -11.624 1.00 0.00 O ATOM 0 H ASP B 97 5.389 -4.614 -12.432 1.00 0.00 H new ATOM 0 HA ASP B 97 6.417 -5.281 -9.861 1.00 0.00 H new ATOM 0 HB2 ASP B 97 5.095 -6.747 -11.310 1.00 0.00 H new ATOM 0 HB3 ASP B 97 6.322 -6.675 -12.559 1.00 0.00 H new ATOM 2798 N THR B 98 8.859 -5.663 -11.963 1.00 0.00 N ATOM 2799 CA THR B 98 10.268 -5.486 -12.381 1.00 0.00 C ATOM 2800 C THR B 98 11.234 -6.352 -11.567 1.00 0.00 C ATOM 2801 O THR B 98 11.007 -6.620 -10.393 1.00 0.00 O ATOM 2802 CB THR B 98 10.797 -4.044 -12.401 1.00 0.00 C ATOM 2803 OG1 THR B 98 11.073 -3.591 -11.108 1.00 0.00 O ATOM 2804 CG2 THR B 98 9.876 -3.041 -13.080 1.00 0.00 C ATOM 0 H THR B 98 8.382 -6.319 -12.581 1.00 0.00 H new ATOM 0 HA THR B 98 10.238 -5.815 -13.420 1.00 0.00 H new ATOM 0 HB THR B 98 11.708 -4.098 -12.997 1.00 0.00 H new ATOM 0 HG1 THR B 98 10.364 -3.887 -10.499 1.00 0.00 H new ATOM 0 HG21 THR B 98 10.330 -2.050 -13.047 1.00 0.00 H new ATOM 0 HG22 THR B 98 9.720 -3.335 -14.118 1.00 0.00 H new ATOM 0 HG23 THR B 98 8.917 -3.018 -12.562 1.00 0.00 H new ATOM 2812 N ASP B 99 12.416 -6.634 -12.120 1.00 0.00 N ATOM 2813 CA ASP B 99 13.514 -7.320 -11.425 1.00 0.00 C ATOM 2814 C ASP B 99 14.346 -6.342 -10.568 1.00 0.00 C ATOM 2815 O ASP B 99 15.576 -6.411 -10.504 1.00 0.00 O ATOM 2816 CB ASP B 99 14.354 -8.083 -12.463 1.00 0.00 C ATOM 2817 CG ASP B 99 15.386 -9.041 -11.845 1.00 0.00 C ATOM 2818 OD1 ASP B 99 15.158 -9.512 -10.707 1.00 0.00 O ATOM 2819 OD2 ASP B 99 16.387 -9.309 -12.546 1.00 0.00 O ATOM 0 H ASP B 99 12.644 -6.388 -13.083 1.00 0.00 H new ATOM 0 HA ASP B 99 13.110 -8.043 -10.716 1.00 0.00 H new ATOM 0 HB2 ASP B 99 13.686 -8.652 -13.110 1.00 0.00 H new ATOM 0 HB3 ASP B 99 14.874 -7.363 -13.096 1.00 0.00 H new ATOM 2824 N GLN B 100 13.690 -5.355 -9.945 1.00 0.00 N ATOM 2825 CA GLN B 100 14.349 -4.447 -9.010 1.00 0.00 C ATOM 2826 C GLN B 100 13.525 -4.278 -7.712 1.00 0.00 C ATOM 2827 O GLN B 100 12.736 -3.331 -7.605 1.00 0.00 O ATOM 2828 CB GLN B 100 14.727 -3.100 -9.663 1.00 0.00 C ATOM 2829 CG GLN B 100 16.194 -3.056 -10.144 1.00 0.00 C ATOM 2830 CD GLN B 100 16.325 -3.136 -11.659 1.00 0.00 C ATOM 2831 OE1 GLN B 100 16.506 -2.128 -12.336 1.00 0.00 O ATOM 2832 NE2 GLN B 100 16.237 -4.314 -12.232 1.00 0.00 N ATOM 0 H GLN B 100 12.696 -5.168 -10.076 1.00 0.00 H new ATOM 0 HA GLN B 100 15.294 -4.908 -8.724 1.00 0.00 H new ATOM 0 HB2 GLN B 100 14.067 -2.915 -10.510 1.00 0.00 H new ATOM 0 HB3 GLN B 100 14.560 -2.295 -8.947 1.00 0.00 H new ATOM 0 HG2 GLN B 100 16.658 -2.135 -9.793 1.00 0.00 H new ATOM 0 HG3 GLN B 100 16.744 -3.882 -9.693 1.00 0.00 H new ATOM 0 HE21 GLN B 100 16.087 -5.148 -11.664 1.00 0.00 H new ATOM 0 HE22 GLN B 100 16.319 -4.396 -13.245 1.00 0.00 H new ATOM 2841 N PRO B 101 13.720 -5.167 -6.710 1.00 0.00 N ATOM 2842 CA PRO B 101 13.009 -5.142 -5.426 1.00 0.00 C ATOM 2843 C PRO B 101 13.492 -4.042 -4.458 1.00 0.00 C ATOM 2844 O PRO B 101 12.988 -3.964 -3.337 1.00 0.00 O ATOM 2845 CB PRO B 101 13.199 -6.547 -4.841 1.00 0.00 C ATOM 2846 CG PRO B 101 14.568 -6.957 -5.371 1.00 0.00 C ATOM 2847 CD PRO B 101 14.586 -6.343 -6.768 1.00 0.00 C ATOM 0 HA PRO B 101 11.959 -4.891 -5.579 1.00 0.00 H new ATOM 0 HB2 PRO B 101 13.175 -6.537 -3.751 1.00 0.00 H new ATOM 0 HB3 PRO B 101 12.417 -7.231 -5.171 1.00 0.00 H new ATOM 0 HG2 PRO B 101 15.375 -6.571 -4.749 1.00 0.00 H new ATOM 0 HG3 PRO B 101 14.681 -8.041 -5.404 1.00 0.00 H new ATOM 0 HD2 PRO B 101 15.599 -6.066 -7.058 1.00 0.00 H new ATOM 0 HD3 PRO B 101 14.226 -7.055 -7.510 1.00 0.00 H new ATOM 2855 N CYS B 102 14.415 -3.190 -4.916 1.00 0.00 N ATOM 2856 CA CYS B 102 14.912 -1.957 -4.320 1.00 0.00 C ATOM 2857 C CYS B 102 15.522 -1.092 -5.438 1.00 0.00 C ATOM 2858 O CYS B 102 15.950 -1.609 -6.475 1.00 0.00 O ATOM 2859 CB CYS B 102 15.872 -2.313 -3.170 1.00 0.00 C ATOM 2860 SG CYS B 102 15.260 -1.955 -1.490 1.00 0.00 S ATOM 0 H CYS B 102 14.877 -3.371 -5.807 1.00 0.00 H new ATOM 0 HA CYS B 102 14.122 -1.357 -3.868 1.00 0.00 H new ATOM 0 HB2 CYS B 102 16.106 -3.376 -3.233 1.00 0.00 H new ATOM 0 HB3 CYS B 102 16.806 -1.771 -3.320 1.00 0.00 H new ATOM 2865 N VAL B 103 15.522 0.228 -5.221 1.00 0.00 N ATOM 2866 CA VAL B 103 15.755 1.196 -6.308 1.00 0.00 C ATOM 2867 C VAL B 103 16.783 2.299 -6.063 1.00 0.00 C ATOM 2868 O VAL B 103 16.920 3.178 -6.911 1.00 0.00 O ATOM 2869 CB VAL B 103 14.423 1.767 -6.842 1.00 0.00 C ATOM 2870 CG1 VAL B 103 13.417 0.667 -7.209 1.00 0.00 C ATOM 2871 CG2 VAL B 103 13.765 2.781 -5.905 1.00 0.00 C ATOM 0 H VAL B 103 15.364 0.653 -4.307 1.00 0.00 H new ATOM 0 HA VAL B 103 16.238 0.591 -7.075 1.00 0.00 H new ATOM 0 HB VAL B 103 14.704 2.301 -7.750 1.00 0.00 H new ATOM 0 HG11 VAL B 103 12.498 1.123 -7.579 1.00 0.00 H new ATOM 0 HG12 VAL B 103 13.842 0.028 -7.983 1.00 0.00 H new ATOM 0 HG13 VAL B 103 13.195 0.068 -6.326 1.00 0.00 H new ATOM 0 HG21 VAL B 103 12.835 3.136 -6.349 1.00 0.00 H new ATOM 0 HG22 VAL B 103 13.552 2.306 -4.947 1.00 0.00 H new ATOM 0 HG23 VAL B 103 14.439 3.624 -5.750 1.00 0.00 H new ATOM 2881 N ALA B 104 17.580 2.214 -4.989 1.00 0.00 N ATOM 2882 CA ALA B 104 18.746 3.091 -4.811 1.00 0.00 C ATOM 2883 C ALA B 104 19.766 2.961 -5.963 1.00 0.00 C ATOM 2884 O ALA B 104 20.561 3.867 -6.187 1.00 0.00 O ATOM 2885 CB ALA B 104 19.380 2.762 -3.451 1.00 0.00 C ATOM 0 H ALA B 104 17.439 1.547 -4.230 1.00 0.00 H new ATOM 0 HA ALA B 104 18.421 4.131 -4.832 1.00 0.00 H new ATOM 0 HB1 ALA B 104 20.250 3.399 -3.291 1.00 0.00 H new ATOM 0 HB2 ALA B 104 18.652 2.936 -2.659 1.00 0.00 H new ATOM 0 HB3 ALA B 104 19.688 1.717 -3.437 1.00 0.00 H new ATOM 2891 N GLU B 105 19.712 1.830 -6.680 1.00 0.00 N ATOM 2892 CA GLU B 105 20.669 1.360 -7.687 1.00 0.00 C ATOM 2893 C GLU B 105 19.969 0.849 -8.977 1.00 0.00 C ATOM 2894 O GLU B 105 20.582 0.118 -9.756 1.00 0.00 O ATOM 2895 CB GLU B 105 21.508 0.233 -7.034 1.00 0.00 C ATOM 2896 CG GLU B 105 22.269 0.688 -5.769 1.00 0.00 C ATOM 2897 CD GLU B 105 22.815 -0.468 -4.934 1.00 0.00 C ATOM 2898 OE1 GLU B 105 22.027 -1.397 -4.646 1.00 0.00 O ATOM 2899 OE2 GLU B 105 23.996 -0.381 -4.532 1.00 0.00 O ATOM 0 H GLU B 105 18.941 1.173 -6.561 1.00 0.00 H new ATOM 0 HA GLU B 105 21.302 2.190 -8.001 1.00 0.00 H new ATOM 0 HB2 GLU B 105 20.849 -0.596 -6.774 1.00 0.00 H new ATOM 0 HB3 GLU B 105 22.224 -0.145 -7.763 1.00 0.00 H new ATOM 0 HG2 GLU B 105 23.096 1.333 -6.065 1.00 0.00 H new ATOM 0 HG3 GLU B 105 21.602 1.288 -5.150 1.00 0.00 H new ATOM 2906 N ARG B 106 18.677 1.163 -9.223 1.00 0.00 N ATOM 2907 CA ARG B 106 17.933 0.559 -10.353 1.00 0.00 C ATOM 2908 C ARG B 106 18.430 1.032 -11.723 1.00 0.00 C ATOM 2909 O ARG B 106 18.699 2.216 -11.931 1.00 0.00 O ATOM 2910 CB ARG B 106 16.397 0.651 -10.201 1.00 0.00 C ATOM 2911 CG ARG B 106 15.667 1.966 -10.531 1.00 0.00 C ATOM 2912 CD ARG B 106 15.255 2.131 -12.008 1.00 0.00 C ATOM 2913 NE ARG B 106 16.166 3.030 -12.728 1.00 0.00 N ATOM 2914 CZ ARG B 106 15.861 3.843 -13.729 1.00 0.00 C ATOM 2915 NH1 ARG B 106 14.735 3.760 -14.401 1.00 0.00 N ATOM 2916 NH2 ARG B 106 16.701 4.799 -14.047 1.00 0.00 N ATOM 0 H ARG B 106 18.134 1.821 -8.664 1.00 0.00 H new ATOM 0 HA ARG B 106 18.162 -0.506 -10.307 1.00 0.00 H new ATOM 0 HB2 ARG B 106 15.962 -0.127 -10.828 1.00 0.00 H new ATOM 0 HB3 ARG B 106 16.158 0.398 -9.168 1.00 0.00 H new ATOM 0 HG2 ARG B 106 14.773 2.033 -9.911 1.00 0.00 H new ATOM 0 HG3 ARG B 106 16.311 2.801 -10.254 1.00 0.00 H new ATOM 0 HD2 ARG B 106 15.246 1.156 -12.495 1.00 0.00 H new ATOM 0 HD3 ARG B 106 14.239 2.523 -12.061 1.00 0.00 H new ATOM 0 HE ARG B 106 17.140 3.028 -12.424 1.00 0.00 H new ATOM 0 HH11 ARG B 106 14.049 3.045 -14.160 1.00 0.00 H new ATOM 0 HH12 ARG B 106 14.547 4.410 -15.164 1.00 0.00 H new ATOM 0 HH21 ARG B 106 17.572 4.907 -13.527 1.00 0.00 H new ATOM 0 HH22 ARG B 106 16.483 5.435 -14.815 1.00 0.00 H new TER 2930 ARG B 106 HETATM 2931 CD CD A 107 15.421 0.197 -0.665 1.00 0.00 CD HETATM 2932 CD CD B 107 -3.190 -16.284 -0.353 1.00 0.00 CD