USER MOD reduce.3.24.130724 H: found=0, std=0, add=762, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 764 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 52 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: B 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 CYS SG : rot 180:sc= -0.036 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 49 SER OG : rot -155:sc= -0.671 USER MOD Single : A 53 SER OG : rot 180:sc= 0.0426 USER MOD Single : A 56 SER OG : rot -41:sc= 1.11 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN :FLIP amide:sc= 0.764 F(o=-0.2,f=0.76) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00188) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 142 CYS SG : rot 180:sc= -0.0505 USER MOD Single : B 146 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : B 149 SER OG : rot -160:sc= -0.958! USER MOD Single : B 153 SER OG : rot 180:sc= 0.0112 USER MOD Single : B 156 SER OG : rot -43:sc= 1.05 USER MOD Single : B 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 179 GLN :FLIP amide:sc= 0.888 F(o=-0.19,f=0.89) USER MOD Single : B 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 181 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00523) USER MOD Single : B 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 41 24.706 19.573 -2.217 1.00 24.23 N ATOM 2 CA GLY A 41 24.240 19.158 -0.907 1.00 2.12 C ATOM 3 C GLY A 41 24.092 20.323 0.052 1.00 60.31 C ATOM 4 O GLY A 41 24.137 20.143 1.270 1.00 33.31 O ATOM 0 HA2 GLY A 41 23.280 18.652 -1.010 1.00 2.12 H new ATOM 0 HA3 GLY A 41 24.939 18.434 -0.489 1.00 2.12 H new ATOM 8 N CYS A 42 23.918 21.520 -0.497 1.00 23.03 N ATOM 9 CA CYS A 42 23.766 22.720 0.318 1.00 14.00 C ATOM 10 C CYS A 42 22.510 22.637 1.180 1.00 71.02 C ATOM 11 O CYS A 42 21.594 21.859 0.912 1.00 73.51 O ATOM 12 CB CYS A 42 23.707 23.962 -0.573 1.00 51.31 C ATOM 13 SG CYS A 42 25.285 24.827 -0.740 1.00 23.33 S ATOM 0 H CYS A 42 23.879 21.685 -1.503 1.00 23.03 H new ATOM 0 HA CYS A 42 24.632 22.795 0.976 1.00 14.00 H new ATOM 0 HB2 CYS A 42 23.359 23.669 -1.564 1.00 51.31 H new ATOM 0 HB3 CYS A 42 22.968 24.652 -0.167 1.00 51.31 H new ATOM 0 HG CYS A 42 25.133 25.861 -1.513 1.00 23.33 H new ATOM 19 N PRO A 43 22.465 23.455 2.241 1.00 74.35 N ATOM 20 CA PRO A 43 21.328 23.492 3.165 1.00 43.14 C ATOM 21 C PRO A 43 20.081 24.094 2.526 1.00 21.11 C ATOM 22 O PRO A 43 19.899 25.311 2.523 1.00 4.21 O ATOM 23 CB PRO A 43 21.826 24.384 4.306 1.00 23.44 C ATOM 24 CG PRO A 43 22.869 25.247 3.684 1.00 12.12 C ATOM 25 CD PRO A 43 23.522 24.409 2.621 1.00 10.11 C ATOM 0 HA PRO A 43 21.031 22.493 3.484 1.00 43.14 H new ATOM 0 HB2 PRO A 43 21.016 24.981 4.724 1.00 23.44 H new ATOM 0 HB3 PRO A 43 22.238 23.790 5.122 1.00 23.44 H new ATOM 0 HG2 PRO A 43 22.426 26.146 3.255 1.00 12.12 H new ATOM 0 HG3 PRO A 43 23.598 25.574 4.426 1.00 12.12 H new ATOM 0 HD2 PRO A 43 23.841 25.014 1.772 1.00 10.11 H new ATOM 0 HD3 PRO A 43 24.407 23.898 3.000 1.00 10.11 H new ATOM 33 N ALA A 44 19.225 23.232 1.985 1.00 43.24 N ATOM 34 CA ALA A 44 17.994 23.679 1.345 1.00 70.11 C ATOM 35 C ALA A 44 16.787 22.925 1.892 1.00 50.23 C ATOM 36 O ALA A 44 16.702 21.703 1.776 1.00 60.35 O ATOM 37 CB ALA A 44 18.089 23.503 -0.163 1.00 71.32 C ATOM 0 H ALA A 44 19.362 22.221 1.977 1.00 43.24 H new ATOM 0 HA ALA A 44 17.861 24.738 1.568 1.00 70.11 H new ATOM 0 HB1 ALA A 44 17.163 23.841 -0.628 1.00 71.32 H new ATOM 0 HB2 ALA A 44 18.923 24.091 -0.546 1.00 71.32 H new ATOM 0 HB3 ALA A 44 18.250 22.451 -0.397 1.00 71.32 H new ATOM 43 N GLU A 45 15.855 23.663 2.489 1.00 12.21 N ATOM 44 CA GLU A 45 14.653 23.062 3.054 1.00 43.21 C ATOM 45 C GLU A 45 13.441 23.964 2.840 1.00 41.33 C ATOM 46 O GLU A 45 12.974 24.624 3.769 1.00 21.22 O ATOM 47 CB GLU A 45 14.845 22.793 4.549 1.00 73.32 C ATOM 48 CG GLU A 45 13.624 22.187 5.220 1.00 35.41 C ATOM 49 CD GLU A 45 13.948 21.562 6.563 1.00 54.41 C ATOM 50 OE1 GLU A 45 15.081 21.065 6.729 1.00 52.15 O ATOM 51 OE2 GLU A 45 13.066 21.570 7.448 1.00 53.55 O ATOM 0 H GLU A 45 15.910 24.676 2.593 1.00 12.21 H new ATOM 0 HA GLU A 45 14.475 22.117 2.542 1.00 43.21 H new ATOM 0 HB2 GLU A 45 15.693 22.122 4.683 1.00 73.32 H new ATOM 0 HB3 GLU A 45 15.097 23.728 5.049 1.00 73.32 H new ATOM 0 HG2 GLU A 45 12.867 22.960 5.356 1.00 35.41 H new ATOM 0 HG3 GLU A 45 13.192 21.430 4.565 1.00 35.41 H new ATOM 58 N GLN A 46 12.938 23.989 1.610 1.00 64.42 N ATOM 59 CA GLN A 46 11.783 24.811 1.274 1.00 13.13 C ATOM 60 C GLN A 46 10.924 24.135 0.210 1.00 22.14 C ATOM 61 O GLN A 46 11.443 23.552 -0.742 1.00 63.33 O ATOM 62 CB GLN A 46 12.235 26.187 0.782 1.00 72.13 C ATOM 63 CG GLN A 46 13.055 26.137 -0.497 1.00 10.04 C ATOM 64 CD GLN A 46 13.552 27.503 -0.925 1.00 71.45 C ATOM 65 OE1 GLN A 46 12.882 28.515 -0.715 1.00 3.24 O ATOM 66 NE2 GLN A 46 14.734 27.541 -1.530 1.00 65.21 N ATOM 0 H GLN A 46 13.313 23.449 0.830 1.00 64.42 H new ATOM 0 HA GLN A 46 11.183 24.934 2.175 1.00 13.13 H new ATOM 0 HB2 GLN A 46 11.357 26.811 0.616 1.00 72.13 H new ATOM 0 HB3 GLN A 46 12.824 26.667 1.563 1.00 72.13 H new ATOM 0 HG2 GLN A 46 13.908 25.474 -0.352 1.00 10.04 H new ATOM 0 HG3 GLN A 46 12.450 25.708 -1.296 1.00 10.04 H new ATOM 0 HE21 GLN A 46 15.256 26.678 -1.684 1.00 65.21 H new ATOM 0 HE22 GLN A 46 15.120 28.433 -1.840 1.00 65.21 H new ATOM 75 N ARG A 47 9.609 24.216 0.378 1.00 43.53 N ATOM 76 CA ARG A 47 8.679 23.610 -0.566 1.00 55.42 C ATOM 77 C ARG A 47 7.237 23.969 -0.216 1.00 1.33 C ATOM 78 O ARG A 47 6.889 24.106 0.956 1.00 33.22 O ATOM 79 CB ARG A 47 8.849 22.089 -0.579 1.00 54.35 C ATOM 80 CG ARG A 47 8.443 21.421 0.723 1.00 45.51 C ATOM 81 CD ARG A 47 7.003 20.935 0.676 1.00 51.44 C ATOM 82 NE ARG A 47 6.190 21.528 1.734 1.00 53.50 N ATOM 83 CZ ARG A 47 6.220 21.124 2.999 1.00 23.44 C ATOM 84 NH1 ARG A 47 7.021 20.130 3.361 1.00 11.35 N ATOM 85 NH2 ARG A 47 5.451 21.714 3.904 1.00 63.10 N ATOM 0 H ARG A 47 9.163 24.696 1.160 1.00 43.53 H new ATOM 0 HA ARG A 47 8.902 24.002 -1.558 1.00 55.42 H new ATOM 0 HB2 ARG A 47 8.255 21.672 -1.392 1.00 54.35 H new ATOM 0 HB3 ARG A 47 9.891 21.850 -0.791 1.00 54.35 H new ATOM 0 HG2 ARG A 47 9.106 20.579 0.923 1.00 45.51 H new ATOM 0 HG3 ARG A 47 8.564 22.124 1.547 1.00 45.51 H new ATOM 0 HD2 ARG A 47 6.570 21.179 -0.294 1.00 51.44 H new ATOM 0 HD3 ARG A 47 6.984 19.849 0.770 1.00 51.44 H new ATOM 0 HE ARG A 47 5.564 22.295 1.488 1.00 53.50 H new ATOM 0 HH11 ARG A 47 7.615 19.675 2.668 1.00 11.35 H new ATOM 0 HH12 ARG A 47 7.043 19.821 4.333 1.00 11.35 H new ATOM 0 HH21 ARG A 47 4.835 22.479 3.629 1.00 63.10 H new ATOM 0 HH22 ARG A 47 5.475 21.403 4.875 1.00 63.10 H new ATOM 99 N ALA A 48 6.404 24.118 -1.242 1.00 44.53 N ATOM 100 CA ALA A 48 5.001 24.459 -1.042 1.00 12.31 C ATOM 101 C ALA A 48 4.231 24.405 -2.357 1.00 63.13 C ATOM 102 O ALA A 48 3.276 25.154 -2.559 1.00 42.54 O ATOM 103 CB ALA A 48 4.877 25.838 -0.412 1.00 63.23 C ATOM 0 H ALA A 48 6.677 24.008 -2.219 1.00 44.53 H new ATOM 0 HA ALA A 48 4.567 23.723 -0.366 1.00 12.31 H new ATOM 0 HB1 ALA A 48 3.824 26.079 -0.269 1.00 63.23 H new ATOM 0 HB2 ALA A 48 5.385 25.845 0.552 1.00 63.23 H new ATOM 0 HB3 ALA A 48 5.333 26.580 -1.068 1.00 63.23 H new ATOM 109 N SER A 49 4.652 23.514 -3.248 1.00 32.41 N ATOM 110 CA SER A 49 4.005 23.366 -4.547 1.00 42.03 C ATOM 111 C SER A 49 3.231 22.053 -4.621 1.00 63.43 C ATOM 112 O SER A 49 3.468 21.120 -3.854 1.00 64.30 O ATOM 113 CB SER A 49 5.044 23.424 -5.668 1.00 2.10 C ATOM 114 OG SER A 49 6.323 23.035 -5.199 1.00 44.24 O ATOM 0 H SER A 49 5.439 22.883 -3.095 1.00 32.41 H new ATOM 0 HA SER A 49 3.302 24.190 -4.672 1.00 42.03 H new ATOM 0 HB2 SER A 49 4.739 22.770 -6.485 1.00 2.10 H new ATOM 0 HB3 SER A 49 5.093 24.436 -6.070 1.00 2.10 H new ATOM 0 HG SER A 49 7.015 23.438 -5.764 1.00 44.24 H new ATOM 120 N PRO A 50 2.285 21.977 -5.568 1.00 73.23 N ATOM 121 CA PRO A 50 1.458 20.784 -5.767 1.00 44.43 C ATOM 122 C PRO A 50 2.254 19.613 -6.333 1.00 65.44 C ATOM 123 O PRO A 50 1.822 18.463 -6.262 1.00 20.34 O ATOM 124 CB PRO A 50 0.401 21.248 -6.774 1.00 63.24 C ATOM 125 CG PRO A 50 1.048 22.371 -7.509 1.00 30.33 C ATOM 126 CD PRO A 50 1.950 23.051 -6.518 1.00 42.41 C ATOM 0 HA PRO A 50 1.041 20.417 -4.829 1.00 44.43 H new ATOM 0 HB2 PRO A 50 0.118 20.442 -7.451 1.00 63.24 H new ATOM 0 HB3 PRO A 50 -0.509 21.576 -6.271 1.00 63.24 H new ATOM 0 HG2 PRO A 50 1.615 22.002 -8.364 1.00 30.33 H new ATOM 0 HG3 PRO A 50 0.302 23.064 -7.897 1.00 30.33 H new ATOM 0 HD2 PRO A 50 2.841 23.456 -6.998 1.00 42.41 H new ATOM 0 HD3 PRO A 50 1.449 23.883 -6.023 1.00 42.41 H new ATOM 134 N LEU A 51 3.421 19.914 -6.893 1.00 20.55 N ATOM 135 CA LEU A 51 4.280 18.886 -7.471 1.00 14.41 C ATOM 136 C LEU A 51 4.529 17.760 -6.472 1.00 74.12 C ATOM 137 O LEU A 51 4.567 16.585 -6.840 1.00 13.20 O ATOM 138 CB LEU A 51 5.611 19.495 -7.913 1.00 71.33 C ATOM 139 CG LEU A 51 5.520 20.769 -8.753 1.00 60.41 C ATOM 140 CD1 LEU A 51 6.469 21.831 -8.217 1.00 3.51 C ATOM 141 CD2 LEU A 51 5.826 20.467 -10.213 1.00 75.02 C ATOM 0 H LEU A 51 3.794 20.861 -6.959 1.00 20.55 H new ATOM 0 HA LEU A 51 3.772 18.469 -8.341 1.00 14.41 H new ATOM 0 HB2 LEU A 51 6.202 19.712 -7.023 1.00 71.33 H new ATOM 0 HB3 LEU A 51 6.159 18.745 -8.484 1.00 71.33 H new ATOM 0 HG LEU A 51 4.502 21.153 -8.687 1.00 60.41 H new ATOM 0 HD11 LEU A 51 6.390 22.731 -8.827 1.00 3.51 H new ATOM 0 HD12 LEU A 51 6.205 22.068 -7.186 1.00 3.51 H new ATOM 0 HD13 LEU A 51 7.492 21.456 -8.253 1.00 3.51 H new ATOM 0 HD21 LEU A 51 5.757 21.385 -10.797 1.00 75.02 H new ATOM 0 HD22 LEU A 51 6.833 20.059 -10.297 1.00 75.02 H new ATOM 0 HD23 LEU A 51 5.107 19.741 -10.593 1.00 75.02 H new ATOM 153 N THR A 52 4.697 18.126 -5.206 1.00 65.10 N ATOM 154 CA THR A 52 4.941 17.148 -4.153 1.00 3.33 C ATOM 155 C THR A 52 3.762 16.193 -4.006 1.00 11.11 C ATOM 156 O THR A 52 3.937 15.022 -3.666 1.00 53.23 O ATOM 157 CB THR A 52 5.205 17.833 -2.799 1.00 21.34 C ATOM 158 OG1 THR A 52 6.203 18.847 -2.950 1.00 55.54 O ATOM 159 CG2 THR A 52 5.658 16.819 -1.759 1.00 43.13 C ATOM 0 H THR A 52 4.669 19.094 -4.884 1.00 65.10 H new ATOM 0 HA THR A 52 5.827 16.585 -4.445 1.00 3.33 H new ATOM 0 HB THR A 52 4.275 18.288 -2.459 1.00 21.34 H new ATOM 0 HG1 THR A 52 6.364 19.279 -2.085 1.00 55.54 H new ATOM 0 HG21 THR A 52 5.838 17.326 -0.811 1.00 43.13 H new ATOM 0 HG22 THR A 52 4.883 16.064 -1.625 1.00 43.13 H new ATOM 0 HG23 THR A 52 6.577 16.339 -2.095 1.00 43.13 H new ATOM 167 N SER A 53 2.560 16.700 -4.264 1.00 25.23 N ATOM 168 CA SER A 53 1.350 15.891 -4.157 1.00 63.54 C ATOM 169 C SER A 53 1.310 14.827 -5.250 1.00 52.20 C ATOM 170 O SER A 53 1.219 13.633 -4.965 1.00 44.12 O ATOM 171 CB SER A 53 0.109 16.780 -4.248 1.00 72.15 C ATOM 172 OG SER A 53 0.414 18.119 -3.900 1.00 44.52 O ATOM 0 H SER A 53 2.398 17.666 -4.548 1.00 25.23 H new ATOM 0 HA SER A 53 1.360 15.391 -3.188 1.00 63.54 H new ATOM 0 HB2 SER A 53 -0.292 16.747 -5.261 1.00 72.15 H new ATOM 0 HB3 SER A 53 -0.666 16.396 -3.585 1.00 72.15 H new ATOM 0 HG SER A 53 -0.396 18.667 -3.968 1.00 44.52 H new ATOM 178 N ILE A 54 1.377 15.271 -6.500 1.00 31.14 N ATOM 179 CA ILE A 54 1.348 14.358 -7.636 1.00 34.53 C ATOM 180 C ILE A 54 2.385 13.250 -7.478 1.00 41.13 C ATOM 181 O ILE A 54 2.098 12.079 -7.724 1.00 25.41 O ATOM 182 CB ILE A 54 1.605 15.099 -8.961 1.00 54.31 C ATOM 183 CG1 ILE A 54 0.563 16.201 -9.164 1.00 75.30 C ATOM 184 CG2 ILE A 54 1.585 14.122 -10.128 1.00 44.00 C ATOM 185 CD1 ILE A 54 0.811 17.047 -10.394 1.00 43.31 C ATOM 0 H ILE A 54 1.452 16.257 -6.752 1.00 31.14 H new ATOM 0 HA ILE A 54 0.351 13.919 -7.662 1.00 34.53 H new ATOM 0 HB ILE A 54 2.591 15.561 -8.917 1.00 54.31 H new ATOM 0 HG12 ILE A 54 -0.425 15.747 -9.238 1.00 75.30 H new ATOM 0 HG13 ILE A 54 0.552 16.846 -8.285 1.00 75.30 H new ATOM 0 HG21 ILE A 54 1.768 14.661 -11.057 1.00 44.00 H new ATOM 0 HG22 ILE A 54 2.361 13.370 -9.986 1.00 44.00 H new ATOM 0 HG23 ILE A 54 0.611 13.634 -10.178 1.00 44.00 H new ATOM 0 HD11 ILE A 54 0.034 17.807 -10.475 1.00 43.31 H new ATOM 0 HD12 ILE A 54 1.785 17.530 -10.313 1.00 43.31 H new ATOM 0 HD13 ILE A 54 0.793 16.414 -11.281 1.00 43.31 H new ATOM 197 N ILE A 55 3.589 13.629 -7.064 1.00 41.11 N ATOM 198 CA ILE A 55 4.667 12.668 -6.869 1.00 42.14 C ATOM 199 C ILE A 55 4.368 11.735 -5.701 1.00 0.15 C ATOM 200 O ILE A 55 4.553 10.522 -5.799 1.00 41.41 O ATOM 201 CB ILE A 55 6.013 13.374 -6.616 1.00 42.42 C ATOM 202 CG1 ILE A 55 6.356 14.299 -7.785 1.00 71.34 C ATOM 203 CG2 ILE A 55 7.116 12.349 -6.401 1.00 41.14 C ATOM 204 CD1 ILE A 55 7.456 15.288 -7.469 1.00 31.11 C ATOM 0 H ILE A 55 3.843 14.595 -6.857 1.00 41.11 H new ATOM 0 HA ILE A 55 4.739 12.085 -7.787 1.00 42.14 H new ATOM 0 HB ILE A 55 5.926 13.979 -5.713 1.00 42.42 H new ATOM 0 HG12 ILE A 55 6.657 13.694 -8.640 1.00 71.34 H new ATOM 0 HG13 ILE A 55 5.460 14.846 -8.080 1.00 71.34 H new ATOM 0 HG21 ILE A 55 8.061 12.863 -6.224 1.00 41.14 H new ATOM 0 HG22 ILE A 55 6.873 11.728 -5.539 1.00 41.14 H new ATOM 0 HG23 ILE A 55 7.206 11.720 -7.287 1.00 41.14 H new ATOM 0 HD11 ILE A 55 7.647 15.911 -8.343 1.00 31.11 H new ATOM 0 HD12 ILE A 55 7.150 15.918 -6.634 1.00 31.11 H new ATOM 0 HD13 ILE A 55 8.365 14.748 -7.203 1.00 31.11 H new ATOM 216 N SER A 56 3.901 12.309 -4.597 1.00 44.45 N ATOM 217 CA SER A 56 3.577 11.529 -3.408 1.00 51.11 C ATOM 218 C SER A 56 2.478 10.513 -3.707 1.00 73.32 C ATOM 219 O SER A 56 2.534 9.371 -3.255 1.00 23.51 O ATOM 220 CB SER A 56 3.137 12.452 -2.270 1.00 34.33 C ATOM 221 OG SER A 56 1.855 13.000 -2.525 1.00 62.43 O ATOM 0 H SER A 56 3.738 13.311 -4.501 1.00 44.45 H new ATOM 0 HA SER A 56 4.474 10.990 -3.103 1.00 51.11 H new ATOM 0 HB2 SER A 56 3.118 11.896 -1.333 1.00 34.33 H new ATOM 0 HB3 SER A 56 3.862 13.256 -2.149 1.00 34.33 H new ATOM 0 HG SER A 56 1.787 13.246 -3.471 1.00 62.43 H new ATOM 227 N ALA A 57 1.480 10.940 -4.473 1.00 55.11 N ATOM 228 CA ALA A 57 0.368 10.069 -4.836 1.00 30.30 C ATOM 229 C ALA A 57 0.843 8.904 -5.698 1.00 72.01 C ATOM 230 O ALA A 57 0.506 7.749 -5.438 1.00 13.32 O ATOM 231 CB ALA A 57 -0.708 10.862 -5.563 1.00 24.11 C ATOM 0 H ALA A 57 1.418 11.884 -4.855 1.00 55.11 H new ATOM 0 HA ALA A 57 -0.056 9.660 -3.919 1.00 30.30 H new ATOM 0 HB1 ALA A 57 -1.532 10.199 -5.828 1.00 24.11 H new ATOM 0 HB2 ALA A 57 -1.076 11.656 -4.914 1.00 24.11 H new ATOM 0 HB3 ALA A 57 -0.288 11.299 -6.469 1.00 24.11 H new ATOM 237 N VAL A 58 1.625 9.216 -6.726 1.00 61.43 N ATOM 238 CA VAL A 58 2.147 8.194 -7.627 1.00 53.10 C ATOM 239 C VAL A 58 2.882 7.105 -6.856 1.00 62.41 C ATOM 240 O VAL A 58 2.705 5.915 -7.118 1.00 61.51 O ATOM 241 CB VAL A 58 3.101 8.801 -8.672 1.00 71.15 C ATOM 242 CG1 VAL A 58 3.703 7.710 -9.544 1.00 62.24 C ATOM 243 CG2 VAL A 58 2.374 9.833 -9.521 1.00 60.34 C ATOM 0 H VAL A 58 1.911 10.168 -6.956 1.00 61.43 H new ATOM 0 HA VAL A 58 1.290 7.757 -8.139 1.00 53.10 H new ATOM 0 HB VAL A 58 3.914 9.303 -8.147 1.00 71.15 H new ATOM 0 HG11 VAL A 58 4.374 8.159 -10.276 1.00 62.24 H new ATOM 0 HG12 VAL A 58 4.261 7.012 -8.920 1.00 62.24 H new ATOM 0 HG13 VAL A 58 2.906 7.177 -10.062 1.00 62.24 H new ATOM 0 HG21 VAL A 58 3.063 10.252 -10.254 1.00 60.34 H new ATOM 0 HG22 VAL A 58 1.540 9.357 -10.037 1.00 60.34 H new ATOM 0 HG23 VAL A 58 1.997 10.630 -8.881 1.00 60.34 H new ATOM 253 N VAL A 59 3.709 7.519 -5.901 1.00 70.14 N ATOM 254 CA VAL A 59 4.472 6.578 -5.088 1.00 61.10 C ATOM 255 C VAL A 59 3.547 5.653 -4.306 1.00 25.13 C ATOM 256 O VAL A 59 3.728 4.435 -4.302 1.00 21.11 O ATOM 257 CB VAL A 59 5.400 7.312 -4.102 1.00 71.11 C ATOM 258 CG1 VAL A 59 6.133 6.316 -3.216 1.00 13.04 C ATOM 259 CG2 VAL A 59 6.385 8.195 -4.854 1.00 4.00 C ATOM 0 H VAL A 59 3.868 8.500 -5.671 1.00 70.14 H new ATOM 0 HA VAL A 59 5.079 5.986 -5.774 1.00 61.10 H new ATOM 0 HB VAL A 59 4.790 7.950 -3.463 1.00 71.11 H new ATOM 0 HG11 VAL A 59 6.784 6.853 -2.526 1.00 13.04 H new ATOM 0 HG12 VAL A 59 5.408 5.730 -2.650 1.00 13.04 H new ATOM 0 HG13 VAL A 59 6.733 5.650 -3.836 1.00 13.04 H new ATOM 0 HG21 VAL A 59 7.033 8.706 -4.142 1.00 4.00 H new ATOM 0 HG22 VAL A 59 6.991 7.580 -5.519 1.00 4.00 H new ATOM 0 HG23 VAL A 59 5.838 8.933 -5.441 1.00 4.00 H new ATOM 269 N GLY A 60 2.554 6.238 -3.644 1.00 32.21 N ATOM 270 CA GLY A 60 1.615 5.450 -2.868 1.00 43.51 C ATOM 271 C GLY A 60 0.837 4.467 -3.720 1.00 71.32 C ATOM 272 O GLY A 60 0.709 3.295 -3.366 1.00 33.04 O ATOM 0 H GLY A 60 2.383 7.243 -3.631 1.00 32.21 H new ATOM 0 HA2 GLY A 60 2.156 4.906 -2.094 1.00 43.51 H new ATOM 0 HA3 GLY A 60 0.918 6.117 -2.361 1.00 43.51 H new ATOM 276 N ILE A 61 0.317 4.945 -4.846 1.00 23.30 N ATOM 277 CA ILE A 61 -0.452 4.099 -5.750 1.00 51.23 C ATOM 278 C ILE A 61 0.423 3.011 -6.363 1.00 70.24 C ATOM 279 O ILE A 61 -0.049 1.912 -6.658 1.00 52.34 O ATOM 280 CB ILE A 61 -1.093 4.924 -6.883 1.00 42.42 C ATOM 281 CG1 ILE A 61 -2.008 6.005 -6.301 1.00 64.53 C ATOM 282 CG2 ILE A 61 -1.870 4.016 -7.824 1.00 54.13 C ATOM 283 CD1 ILE A 61 -2.519 6.984 -7.335 1.00 24.34 C ATOM 0 H ILE A 61 0.414 5.913 -5.153 1.00 23.30 H new ATOM 0 HA ILE A 61 -1.240 3.637 -5.156 1.00 51.23 H new ATOM 0 HB ILE A 61 -0.301 5.412 -7.451 1.00 42.42 H new ATOM 0 HG12 ILE A 61 -2.858 5.527 -5.814 1.00 64.53 H new ATOM 0 HG13 ILE A 61 -1.466 6.553 -5.530 1.00 64.53 H new ATOM 0 HG21 ILE A 61 -2.317 4.613 -8.619 1.00 54.13 H new ATOM 0 HG22 ILE A 61 -1.195 3.280 -8.259 1.00 54.13 H new ATOM 0 HG23 ILE A 61 -2.656 3.504 -7.269 1.00 54.13 H new ATOM 0 HD11 ILE A 61 -3.161 7.721 -6.852 1.00 24.34 H new ATOM 0 HD12 ILE A 61 -1.676 7.489 -7.806 1.00 24.34 H new ATOM 0 HD13 ILE A 61 -3.090 6.448 -8.093 1.00 24.34 H new ATOM 295 N LEU A 62 1.701 3.323 -6.548 1.00 33.25 N ATOM 296 CA LEU A 62 2.645 2.370 -7.124 1.00 11.42 C ATOM 297 C LEU A 62 2.920 1.224 -6.155 1.00 73.41 C ATOM 298 O LEU A 62 2.910 0.055 -6.542 1.00 0.05 O ATOM 299 CB LEU A 62 3.954 3.074 -7.485 1.00 4.22 C ATOM 300 CG LEU A 62 4.993 2.225 -8.218 1.00 24.14 C ATOM 301 CD1 LEU A 62 4.712 2.211 -9.713 1.00 71.02 C ATOM 302 CD2 LEU A 62 6.396 2.742 -7.941 1.00 70.24 C ATOM 0 H LEU A 62 2.108 4.227 -6.308 1.00 33.25 H new ATOM 0 HA LEU A 62 2.201 1.957 -8.030 1.00 11.42 H new ATOM 0 HB2 LEU A 62 3.719 3.939 -8.105 1.00 4.22 H new ATOM 0 HB3 LEU A 62 4.405 3.452 -6.567 1.00 4.22 H new ATOM 0 HG LEU A 62 4.926 1.202 -7.847 1.00 24.14 H new ATOM 0 HD11 LEU A 62 5.461 1.602 -10.218 1.00 71.02 H new ATOM 0 HD12 LEU A 62 3.722 1.792 -9.893 1.00 71.02 H new ATOM 0 HD13 LEU A 62 4.751 3.229 -10.100 1.00 71.02 H new ATOM 0 HD21 LEU A 62 7.122 2.126 -8.471 1.00 70.24 H new ATOM 0 HD22 LEU A 62 6.478 3.774 -8.283 1.00 70.24 H new ATOM 0 HD23 LEU A 62 6.595 2.698 -6.870 1.00 70.24 H new ATOM 314 N LEU A 63 3.165 1.567 -4.896 1.00 3.31 N ATOM 315 CA LEU A 63 3.440 0.567 -3.870 1.00 31.32 C ATOM 316 C LEU A 63 2.239 -0.351 -3.667 1.00 62.41 C ATOM 317 O LEU A 63 2.392 -1.553 -3.450 1.00 32.44 O ATOM 318 CB LEU A 63 3.805 1.248 -2.550 1.00 62.02 C ATOM 319 CG LEU A 63 4.840 0.527 -1.687 1.00 61.33 C ATOM 320 CD1 LEU A 63 5.497 1.498 -0.719 1.00 61.53 C ATOM 321 CD2 LEU A 63 4.196 -0.626 -0.932 1.00 32.03 C ATOM 0 H LEU A 63 3.179 2.530 -4.560 1.00 3.31 H new ATOM 0 HA LEU A 63 4.283 -0.038 -4.205 1.00 31.32 H new ATOM 0 HB2 LEU A 63 4.179 2.248 -2.771 1.00 62.02 H new ATOM 0 HB3 LEU A 63 2.894 1.371 -1.964 1.00 62.02 H new ATOM 0 HG LEU A 63 5.611 0.121 -2.342 1.00 61.33 H new ATOM 0 HD11 LEU A 63 6.231 0.967 -0.113 1.00 61.53 H new ATOM 0 HD12 LEU A 63 5.994 2.290 -1.279 1.00 61.53 H new ATOM 0 HD13 LEU A 63 4.738 1.934 -0.070 1.00 61.53 H new ATOM 0 HD21 LEU A 63 4.948 -1.127 -0.323 1.00 32.03 H new ATOM 0 HD22 LEU A 63 3.405 -0.242 -0.288 1.00 32.03 H new ATOM 0 HD23 LEU A 63 3.773 -1.336 -1.643 1.00 32.03 H new ATOM 333 N VAL A 64 1.042 0.225 -3.740 1.00 24.41 N ATOM 334 CA VAL A 64 -0.186 -0.542 -3.568 1.00 1.02 C ATOM 335 C VAL A 64 -0.329 -1.602 -4.653 1.00 33.21 C ATOM 336 O VAL A 64 -0.452 -2.792 -4.362 1.00 34.41 O ATOM 337 CB VAL A 64 -1.425 0.372 -3.591 1.00 11.31 C ATOM 338 CG1 VAL A 64 -2.697 -0.449 -3.443 1.00 61.33 C ATOM 339 CG2 VAL A 64 -1.331 1.425 -2.498 1.00 44.04 C ATOM 0 H VAL A 64 0.897 1.219 -3.917 1.00 24.41 H new ATOM 0 HA VAL A 64 -0.121 -1.030 -2.595 1.00 1.02 H new ATOM 0 HB VAL A 64 -1.460 0.883 -4.553 1.00 11.31 H new ATOM 0 HG11 VAL A 64 -3.562 0.214 -3.461 1.00 61.33 H new ATOM 0 HG12 VAL A 64 -2.768 -1.161 -4.265 1.00 61.33 H new ATOM 0 HG13 VAL A 64 -2.674 -0.989 -2.496 1.00 61.33 H new ATOM 0 HG21 VAL A 64 -2.215 2.062 -2.529 1.00 44.04 H new ATOM 0 HG22 VAL A 64 -1.270 0.936 -1.526 1.00 44.04 H new ATOM 0 HG23 VAL A 64 -0.440 2.033 -2.654 1.00 44.04 H new ATOM 349 N VAL A 65 -0.313 -1.163 -5.908 1.00 30.12 N ATOM 350 CA VAL A 65 -0.439 -2.074 -7.039 1.00 31.15 C ATOM 351 C VAL A 65 0.562 -3.219 -6.936 1.00 12.14 C ATOM 352 O VAL A 65 0.198 -4.389 -7.060 1.00 74.32 O ATOM 353 CB VAL A 65 -0.229 -1.341 -8.377 1.00 73.00 C ATOM 354 CG1 VAL A 65 -0.343 -2.312 -9.542 1.00 33.34 C ATOM 355 CG2 VAL A 65 -1.226 -0.202 -8.522 1.00 51.24 C ATOM 0 H VAL A 65 -0.214 -0.181 -6.167 1.00 30.12 H new ATOM 0 HA VAL A 65 -1.451 -2.477 -7.010 1.00 31.15 H new ATOM 0 HB VAL A 65 0.775 -0.918 -8.386 1.00 73.00 H new ATOM 0 HG11 VAL A 65 -0.192 -1.776 -10.479 1.00 33.34 H new ATOM 0 HG12 VAL A 65 0.414 -3.090 -9.443 1.00 33.34 H new ATOM 0 HG13 VAL A 65 -1.333 -2.767 -9.541 1.00 33.34 H new ATOM 0 HG21 VAL A 65 -1.063 0.305 -9.473 1.00 51.24 H new ATOM 0 HG22 VAL A 65 -2.240 -0.600 -8.492 1.00 51.24 H new ATOM 0 HG23 VAL A 65 -1.090 0.507 -7.705 1.00 51.24 H new ATOM 365 N VAL A 66 1.826 -2.875 -6.710 1.00 45.11 N ATOM 366 CA VAL A 66 2.880 -3.874 -6.589 1.00 43.14 C ATOM 367 C VAL A 66 2.543 -4.902 -5.515 1.00 14.02 C ATOM 368 O VAL A 66 2.800 -6.096 -5.680 1.00 51.40 O ATOM 369 CB VAL A 66 4.235 -3.222 -6.253 1.00 1.24 C ATOM 370 CG1 VAL A 66 5.315 -4.283 -6.102 1.00 13.30 C ATOM 371 CG2 VAL A 66 4.618 -2.208 -7.320 1.00 12.44 C ATOM 0 H VAL A 66 2.145 -1.911 -6.607 1.00 45.11 H new ATOM 0 HA VAL A 66 2.955 -4.374 -7.555 1.00 43.14 H new ATOM 0 HB VAL A 66 4.140 -2.696 -5.303 1.00 1.24 H new ATOM 0 HG11 VAL A 66 6.265 -3.804 -5.865 1.00 13.30 H new ATOM 0 HG12 VAL A 66 5.043 -4.967 -5.298 1.00 13.30 H new ATOM 0 HG13 VAL A 66 5.412 -4.839 -7.035 1.00 13.30 H new ATOM 0 HG21 VAL A 66 5.578 -1.758 -7.066 1.00 12.44 H new ATOM 0 HG22 VAL A 66 4.696 -2.708 -8.286 1.00 12.44 H new ATOM 0 HG23 VAL A 66 3.855 -1.431 -7.374 1.00 12.44 H new ATOM 381 N LEU A 67 1.966 -4.433 -4.415 1.00 51.34 N ATOM 382 CA LEU A 67 1.592 -5.312 -3.312 1.00 74.15 C ATOM 383 C LEU A 67 0.522 -6.307 -3.748 1.00 14.40 C ATOM 384 O LEU A 67 0.648 -7.509 -3.522 1.00 64.31 O ATOM 385 CB LEU A 67 1.086 -4.487 -2.126 1.00 21.23 C ATOM 386 CG LEU A 67 1.335 -5.083 -0.740 1.00 22.10 C ATOM 387 CD1 LEU A 67 2.029 -4.073 0.159 1.00 53.54 C ATOM 388 CD2 LEU A 67 0.026 -5.546 -0.116 1.00 71.02 C ATOM 0 H LEU A 67 1.747 -3.449 -4.262 1.00 51.34 H new ATOM 0 HA LEU A 67 2.477 -5.870 -3.007 1.00 74.15 H new ATOM 0 HB2 LEU A 67 1.555 -3.504 -2.166 1.00 21.23 H new ATOM 0 HB3 LEU A 67 0.014 -4.334 -2.247 1.00 21.23 H new ATOM 0 HG LEU A 67 1.988 -5.949 -0.850 1.00 22.10 H new ATOM 0 HD11 LEU A 67 2.198 -4.515 1.141 1.00 53.54 H new ATOM 0 HD12 LEU A 67 2.985 -3.791 -0.281 1.00 53.54 H new ATOM 0 HD13 LEU A 67 1.402 -3.187 0.263 1.00 53.54 H new ATOM 0 HD21 LEU A 67 0.222 -5.967 0.870 1.00 71.02 H new ATOM 0 HD22 LEU A 67 -0.651 -4.697 -0.020 1.00 71.02 H new ATOM 0 HD23 LEU A 67 -0.431 -6.305 -0.751 1.00 71.02 H new ATOM 400 N GLY A 68 -0.533 -5.797 -4.377 1.00 71.24 N ATOM 401 CA GLY A 68 -1.609 -6.655 -4.837 1.00 52.33 C ATOM 402 C GLY A 68 -1.119 -7.762 -5.749 1.00 64.03 C ATOM 403 O GLY A 68 -1.514 -8.919 -5.601 1.00 41.34 O ATOM 0 H GLY A 68 -0.661 -4.805 -4.576 1.00 71.24 H new ATOM 0 HA2 GLY A 68 -2.113 -7.094 -3.976 1.00 52.33 H new ATOM 0 HA3 GLY A 68 -2.348 -6.053 -5.366 1.00 52.33 H new ATOM 407 N VAL A 69 -0.255 -7.408 -6.695 1.00 54.24 N ATOM 408 CA VAL A 69 0.289 -8.379 -7.635 1.00 22.55 C ATOM 409 C VAL A 69 1.031 -9.494 -6.906 1.00 62.23 C ATOM 410 O VAL A 69 0.809 -10.677 -7.164 1.00 52.34 O ATOM 411 CB VAL A 69 1.247 -7.714 -8.641 1.00 51.53 C ATOM 412 CG1 VAL A 69 1.849 -8.752 -9.575 1.00 40.43 C ATOM 413 CG2 VAL A 69 0.523 -6.632 -9.428 1.00 30.23 C ATOM 0 H VAL A 69 0.083 -6.455 -6.830 1.00 54.24 H new ATOM 0 HA VAL A 69 -0.557 -8.802 -8.176 1.00 22.55 H new ATOM 0 HB VAL A 69 2.061 -7.247 -8.086 1.00 51.53 H new ATOM 0 HG11 VAL A 69 2.523 -8.262 -10.278 1.00 40.43 H new ATOM 0 HG12 VAL A 69 2.404 -9.487 -8.992 1.00 40.43 H new ATOM 0 HG13 VAL A 69 1.052 -9.252 -10.125 1.00 40.43 H new ATOM 0 HG21 VAL A 69 1.214 -6.172 -10.134 1.00 30.23 H new ATOM 0 HG22 VAL A 69 -0.311 -7.075 -9.972 1.00 30.23 H new ATOM 0 HG23 VAL A 69 0.147 -5.873 -8.742 1.00 30.23 H new ATOM 423 N VAL A 70 1.915 -9.108 -5.991 1.00 23.51 N ATOM 424 CA VAL A 70 2.690 -10.075 -5.221 1.00 51.13 C ATOM 425 C VAL A 70 1.779 -10.991 -4.413 1.00 0.15 C ATOM 426 O VAL A 70 1.870 -12.216 -4.510 1.00 3.31 O ATOM 427 CB VAL A 70 3.671 -9.372 -4.263 1.00 32.21 C ATOM 428 CG1 VAL A 70 4.527 -10.394 -3.530 1.00 34.43 C ATOM 429 CG2 VAL A 70 4.542 -8.383 -5.024 1.00 34.44 C ATOM 0 H VAL A 70 2.112 -8.133 -5.765 1.00 23.51 H new ATOM 0 HA VAL A 70 3.256 -10.670 -5.938 1.00 51.13 H new ATOM 0 HB VAL A 70 3.094 -8.819 -3.522 1.00 32.21 H new ATOM 0 HG11 VAL A 70 5.213 -9.879 -2.858 1.00 34.43 H new ATOM 0 HG12 VAL A 70 3.885 -11.059 -2.953 1.00 34.43 H new ATOM 0 HG13 VAL A 70 5.097 -10.977 -4.253 1.00 34.43 H new ATOM 0 HG21 VAL A 70 5.229 -7.896 -4.332 1.00 34.44 H new ATOM 0 HG22 VAL A 70 5.111 -8.912 -5.788 1.00 34.44 H new ATOM 0 HG23 VAL A 70 3.910 -7.632 -5.498 1.00 34.44 H new ATOM 439 N PHE A 71 0.900 -10.392 -3.618 1.00 51.34 N ATOM 440 CA PHE A 71 -0.029 -11.155 -2.793 1.00 43.45 C ATOM 441 C PHE A 71 -0.787 -12.179 -3.632 1.00 23.13 C ATOM 442 O PHE A 71 -0.801 -13.369 -3.316 1.00 41.14 O ATOM 443 CB PHE A 71 -1.018 -10.216 -2.098 1.00 13.03 C ATOM 444 CG PHE A 71 -1.679 -10.824 -0.894 1.00 71.34 C ATOM 445 CD1 PHE A 71 -0.921 -11.431 0.094 1.00 42.44 C ATOM 446 CD2 PHE A 71 -3.056 -10.787 -0.751 1.00 4.01 C ATOM 447 CE1 PHE A 71 -1.526 -11.992 1.203 1.00 12.30 C ATOM 448 CE2 PHE A 71 -3.666 -11.347 0.356 1.00 42.41 C ATOM 449 CZ PHE A 71 -2.900 -11.949 1.334 1.00 44.20 C ATOM 0 H PHE A 71 0.811 -9.380 -3.527 1.00 51.34 H new ATOM 0 HA PHE A 71 0.549 -11.687 -2.037 1.00 43.45 H new ATOM 0 HB2 PHE A 71 -0.494 -9.309 -1.796 1.00 13.03 H new ATOM 0 HB3 PHE A 71 -1.786 -9.917 -2.812 1.00 13.03 H new ATOM 0 HD1 PHE A 71 0.154 -11.466 -0.003 1.00 42.44 H new ATOM 0 HD2 PHE A 71 -3.660 -10.316 -1.512 1.00 4.01 H new ATOM 0 HE1 PHE A 71 -0.925 -12.463 1.966 1.00 12.30 H new ATOM 0 HE2 PHE A 71 -4.741 -11.314 0.456 1.00 42.41 H new ATOM 0 HZ PHE A 71 -3.375 -12.386 2.200 1.00 44.20 H new ATOM 459 N GLY A 72 -1.418 -11.708 -4.703 1.00 71.21 N ATOM 460 CA GLY A 72 -2.170 -12.595 -5.571 1.00 72.40 C ATOM 461 C GLY A 72 -1.356 -13.793 -6.022 1.00 51.42 C ATOM 462 O GLY A 72 -1.736 -14.938 -5.774 1.00 53.55 O ATOM 0 H GLY A 72 -1.422 -10.728 -4.985 1.00 71.21 H new ATOM 0 HA2 GLY A 72 -3.061 -12.941 -5.047 1.00 72.40 H new ATOM 0 HA3 GLY A 72 -2.510 -12.040 -6.446 1.00 72.40 H new ATOM 466 N ILE A 73 -0.236 -13.529 -6.685 1.00 14.03 N ATOM 467 CA ILE A 73 0.631 -14.595 -7.171 1.00 72.54 C ATOM 468 C ILE A 73 1.088 -15.497 -6.029 1.00 51.21 C ATOM 469 O ILE A 73 1.159 -16.717 -6.177 1.00 52.01 O ATOM 470 CB ILE A 73 1.871 -14.029 -7.889 1.00 54.01 C ATOM 471 CG1 ILE A 73 1.447 -13.152 -9.070 1.00 62.50 C ATOM 472 CG2 ILE A 73 2.774 -15.159 -8.359 1.00 3.23 C ATOM 473 CD1 ILE A 73 0.723 -13.913 -10.158 1.00 62.52 C ATOM 0 H ILE A 73 0.092 -12.587 -6.898 1.00 14.03 H new ATOM 0 HA ILE A 73 0.044 -15.179 -7.880 1.00 72.54 H new ATOM 0 HB ILE A 73 2.430 -13.413 -7.185 1.00 54.01 H new ATOM 0 HG12 ILE A 73 0.801 -12.353 -8.705 1.00 62.50 H new ATOM 0 HG13 ILE A 73 2.331 -12.678 -9.496 1.00 62.50 H new ATOM 0 HG21 ILE A 73 3.645 -14.742 -8.864 1.00 3.23 H new ATOM 0 HG22 ILE A 73 3.099 -15.746 -7.500 1.00 3.23 H new ATOM 0 HG23 ILE A 73 2.226 -15.799 -9.050 1.00 3.23 H new ATOM 0 HD11 ILE A 73 0.453 -13.229 -10.962 1.00 62.52 H new ATOM 0 HD12 ILE A 73 1.374 -14.695 -10.550 1.00 62.52 H new ATOM 0 HD13 ILE A 73 -0.180 -14.365 -9.747 1.00 62.52 H new ATOM 485 N LEU A 74 1.394 -14.887 -4.888 1.00 22.25 N ATOM 486 CA LEU A 74 1.842 -15.635 -3.719 1.00 3.33 C ATOM 487 C LEU A 74 0.784 -16.644 -3.280 1.00 62.34 C ATOM 488 O LEU A 74 1.038 -17.848 -3.243 1.00 70.13 O ATOM 489 CB LEU A 74 2.159 -14.679 -2.568 1.00 53.15 C ATOM 490 CG LEU A 74 3.520 -13.984 -2.629 1.00 5.12 C ATOM 491 CD1 LEU A 74 3.687 -13.035 -1.452 1.00 13.10 C ATOM 492 CD2 LEU A 74 4.642 -15.012 -2.650 1.00 60.42 C ATOM 0 H LEU A 74 1.340 -13.878 -4.748 1.00 22.25 H new ATOM 0 HA LEU A 74 2.746 -16.179 -3.991 1.00 3.33 H new ATOM 0 HB2 LEU A 74 1.384 -13.914 -2.534 1.00 53.15 H new ATOM 0 HB3 LEU A 74 2.099 -15.236 -1.633 1.00 53.15 H new ATOM 0 HG LEU A 74 3.569 -13.402 -3.549 1.00 5.12 H new ATOM 0 HD11 LEU A 74 4.661 -12.549 -1.512 1.00 13.10 H new ATOM 0 HD12 LEU A 74 2.902 -12.279 -1.480 1.00 13.10 H new ATOM 0 HD13 LEU A 74 3.618 -13.596 -0.520 1.00 13.10 H new ATOM 0 HD21 LEU A 74 5.603 -14.500 -2.693 1.00 60.42 H new ATOM 0 HD22 LEU A 74 4.595 -15.620 -1.747 1.00 60.42 H new ATOM 0 HD23 LEU A 74 4.532 -15.653 -3.525 1.00 60.42 H new ATOM 504 N ILE A 75 -0.402 -16.144 -2.950 1.00 2.21 N ATOM 505 CA ILE A 75 -1.498 -17.001 -2.516 1.00 74.43 C ATOM 506 C ILE A 75 -1.733 -18.136 -3.508 1.00 54.13 C ATOM 507 O ILE A 75 -2.086 -19.250 -3.121 1.00 14.43 O ATOM 508 CB ILE A 75 -2.805 -16.203 -2.348 1.00 23.34 C ATOM 509 CG1 ILE A 75 -2.613 -15.078 -1.329 1.00 75.14 C ATOM 510 CG2 ILE A 75 -3.936 -17.125 -1.921 1.00 44.54 C ATOM 511 CD1 ILE A 75 -3.742 -14.072 -1.320 1.00 3.11 C ATOM 0 H ILE A 75 -0.628 -15.150 -2.975 1.00 2.21 H new ATOM 0 HA ILE A 75 -1.210 -17.418 -1.551 1.00 74.43 H new ATOM 0 HB ILE A 75 -3.068 -15.757 -3.307 1.00 23.34 H new ATOM 0 HG12 ILE A 75 -2.516 -15.513 -0.334 1.00 75.14 H new ATOM 0 HG13 ILE A 75 -1.678 -14.561 -1.543 1.00 75.14 H new ATOM 0 HG21 ILE A 75 -4.853 -16.547 -1.806 1.00 44.54 H new ATOM 0 HG22 ILE A 75 -4.084 -17.894 -2.679 1.00 44.54 H new ATOM 0 HG23 ILE A 75 -3.683 -17.596 -0.971 1.00 44.54 H new ATOM 0 HD11 ILE A 75 -3.539 -13.304 -0.574 1.00 3.11 H new ATOM 0 HD12 ILE A 75 -3.825 -13.610 -2.304 1.00 3.11 H new ATOM 0 HD13 ILE A 75 -4.677 -14.576 -1.076 1.00 3.11 H new ATOM 523 N LYS A 76 -1.532 -17.846 -4.789 1.00 70.12 N ATOM 524 CA LYS A 76 -1.718 -18.842 -5.838 1.00 52.42 C ATOM 525 C LYS A 76 -0.669 -19.945 -5.734 1.00 43.33 C ATOM 526 O LYS A 76 -1.003 -21.117 -5.559 1.00 73.12 O ATOM 527 CB LYS A 76 -1.643 -18.181 -7.216 1.00 3.15 C ATOM 528 CG LYS A 76 -2.988 -17.699 -7.733 1.00 11.11 C ATOM 529 CD LYS A 76 -2.825 -16.745 -8.904 1.00 12.32 C ATOM 530 CE LYS A 76 -4.158 -16.465 -9.584 1.00 63.24 C ATOM 531 NZ LYS A 76 -4.011 -16.341 -11.060 1.00 71.31 N ATOM 0 H LYS A 76 -1.240 -16.929 -5.126 1.00 70.12 H new ATOM 0 HA LYS A 76 -2.704 -19.289 -5.709 1.00 52.42 H new ATOM 0 HB2 LYS A 76 -0.957 -17.335 -7.167 1.00 3.15 H new ATOM 0 HB3 LYS A 76 -1.223 -18.891 -7.928 1.00 3.15 H new ATOM 0 HG2 LYS A 76 -3.589 -18.555 -8.041 1.00 11.11 H new ATOM 0 HG3 LYS A 76 -3.531 -17.201 -6.929 1.00 11.11 H new ATOM 0 HD2 LYS A 76 -2.390 -15.809 -8.554 1.00 12.32 H new ATOM 0 HD3 LYS A 76 -2.129 -17.170 -9.627 1.00 12.32 H new ATOM 0 HE2 LYS A 76 -4.859 -17.268 -9.355 1.00 63.24 H new ATOM 0 HE3 LYS A 76 -4.585 -15.546 -9.183 1.00 63.24 H new ATOM 0 HZ1 LYS A 76 -4.940 -16.151 -11.487 1.00 71.31 H new ATOM 0 HZ2 LYS A 76 -3.362 -15.558 -11.280 1.00 71.31 H new ATOM 0 HZ3 LYS A 76 -3.628 -17.227 -11.446 1.00 71.31 H new ATOM 545 N ARG A 77 0.599 -19.560 -5.840 1.00 2.32 N ATOM 546 CA ARG A 77 1.696 -20.517 -5.757 1.00 11.30 C ATOM 547 C ARG A 77 1.626 -21.314 -4.457 1.00 41.14 C ATOM 548 O ARG A 77 2.122 -22.437 -4.379 1.00 24.41 O ATOM 549 CB ARG A 77 3.040 -19.793 -5.852 1.00 23.11 C ATOM 550 CG ARG A 77 3.297 -19.163 -7.212 1.00 43.45 C ATOM 551 CD ARG A 77 3.767 -20.195 -8.224 1.00 13.04 C ATOM 552 NE ARG A 77 3.025 -20.106 -9.479 1.00 31.01 N ATOM 553 CZ ARG A 77 3.439 -20.652 -10.618 1.00 22.30 C ATOM 554 NH1 ARG A 77 4.583 -21.321 -10.658 1.00 64.32 N ATOM 555 NH2 ARG A 77 2.709 -20.528 -11.719 1.00 60.44 N ATOM 0 H ARG A 77 0.892 -18.593 -5.983 1.00 2.32 H new ATOM 0 HA ARG A 77 1.604 -21.210 -6.593 1.00 11.30 H new ATOM 0 HB2 ARG A 77 3.080 -19.017 -5.088 1.00 23.11 H new ATOM 0 HB3 ARG A 77 3.840 -20.499 -5.631 1.00 23.11 H new ATOM 0 HG2 ARG A 77 2.385 -18.688 -7.572 1.00 43.45 H new ATOM 0 HG3 ARG A 77 4.048 -18.379 -7.115 1.00 43.45 H new ATOM 0 HD2 ARG A 77 4.830 -20.053 -8.420 1.00 13.04 H new ATOM 0 HD3 ARG A 77 3.651 -21.194 -7.804 1.00 13.04 H new ATOM 0 HE ARG A 77 2.141 -19.597 -9.481 1.00 31.01 H new ATOM 0 HH11 ARG A 77 5.147 -21.417 -9.814 1.00 64.32 H new ATOM 0 HH12 ARG A 77 4.899 -21.739 -11.533 1.00 64.32 H new ATOM 0 HH21 ARG A 77 1.829 -20.013 -11.692 1.00 60.44 H new ATOM 0 HH22 ARG A 77 3.028 -20.947 -12.592 1.00 60.44 H new ATOM 569 N ARG A 78 1.008 -20.722 -3.440 1.00 5.42 N ATOM 570 CA ARG A 78 0.875 -21.376 -2.143 1.00 71.31 C ATOM 571 C ARG A 78 -0.035 -22.597 -2.240 1.00 72.34 C ATOM 572 O ARG A 78 0.042 -23.506 -1.415 1.00 2.13 O ATOM 573 CB ARG A 78 0.321 -20.395 -1.108 1.00 24.01 C ATOM 574 CG ARG A 78 1.377 -19.478 -0.513 1.00 40.51 C ATOM 575 CD ARG A 78 2.086 -20.133 0.662 1.00 23.51 C ATOM 576 NE ARG A 78 3.253 -20.902 0.236 1.00 34.12 N ATOM 577 CZ ARG A 78 4.399 -20.348 -0.144 1.00 34.13 C ATOM 578 NH1 ARG A 78 4.531 -19.029 -0.151 1.00 21.42 N ATOM 579 NH2 ARG A 78 5.415 -21.114 -0.518 1.00 22.14 N ATOM 0 H ARG A 78 0.592 -19.792 -3.489 1.00 5.42 H new ATOM 0 HA ARG A 78 1.865 -21.706 -1.828 1.00 71.31 H new ATOM 0 HB2 ARG A 78 -0.455 -19.788 -1.574 1.00 24.01 H new ATOM 0 HB3 ARG A 78 -0.154 -20.958 -0.304 1.00 24.01 H new ATOM 0 HG2 ARG A 78 2.107 -19.216 -1.279 1.00 40.51 H new ATOM 0 HG3 ARG A 78 0.911 -18.549 -0.186 1.00 40.51 H new ATOM 0 HD2 ARG A 78 2.396 -19.366 1.372 1.00 23.51 H new ATOM 0 HD3 ARG A 78 1.391 -20.789 1.185 1.00 23.51 H new ATOM 0 HE ARG A 78 3.184 -21.920 0.230 1.00 34.12 H new ATOM 0 HH11 ARG A 78 3.752 -18.437 0.136 1.00 21.42 H new ATOM 0 HH12 ARG A 78 5.412 -18.606 -0.443 1.00 21.42 H new ATOM 0 HH21 ARG A 78 5.317 -22.129 -0.514 1.00 22.14 H new ATOM 0 HH22 ARG A 78 6.295 -20.688 -0.810 1.00 22.14 H new ATOM 593 N GLN A 79 -0.895 -22.609 -3.253 1.00 54.11 N ATOM 594 CA GLN A 79 -1.819 -23.717 -3.456 1.00 15.45 C ATOM 595 C GLN A 79 -1.084 -25.052 -3.428 1.00 34.23 C ATOM 596 O GLN A 79 0.066 -25.147 -3.858 1.00 55.50 O ATOM 597 CB GLN A 79 -2.557 -23.556 -4.788 1.00 41.34 C ATOM 598 CG GLN A 79 -1.704 -23.893 -6.000 1.00 13.41 C ATOM 599 CD GLN A 79 -2.320 -23.409 -7.299 1.00 61.20 C ATOM 600 OE1 GLN A 79 -2.795 -24.344 -8.113 1.00 41.41 O flip ATOM 601 NE2 GLN A 79 -2.367 -22.208 -7.567 1.00 51.32 N flip ATOM 0 H GLN A 79 -0.971 -21.864 -3.945 1.00 54.11 H new ATOM 0 HA GLN A 79 -2.544 -23.705 -2.642 1.00 15.45 H new ATOM 0 HB2 GLN A 79 -3.439 -24.197 -4.785 1.00 41.34 H new ATOM 0 HB3 GLN A 79 -2.910 -22.528 -4.877 1.00 41.34 H new ATOM 0 HG2 GLN A 79 -0.717 -23.445 -5.881 1.00 13.41 H new ATOM 0 HG3 GLN A 79 -1.561 -24.972 -6.050 1.00 13.41 H new ATOM 0 HE21 GLN A 79 -1.989 -21.524 -6.911 1.00 51.32 H new ATOM 0 HE22 GLN A 79 -2.784 -21.897 -8.445 1.00 51.32 H new ATOM 610 N GLN A 80 -1.754 -26.081 -2.919 1.00 21.41 N ATOM 611 CA GLN A 80 -1.161 -27.411 -2.834 1.00 40.42 C ATOM 612 C GLN A 80 0.052 -27.408 -1.910 1.00 21.55 C ATOM 613 O GLN A 80 1.094 -27.978 -2.235 1.00 64.31 O ATOM 614 CB GLN A 80 -0.757 -27.903 -4.225 1.00 54.22 C ATOM 615 CG GLN A 80 -0.781 -29.416 -4.366 1.00 55.01 C ATOM 616 CD GLN A 80 -2.006 -29.914 -5.108 1.00 24.11 C ATOM 617 OE1 GLN A 80 -3.112 -29.920 -4.568 1.00 11.32 O ATOM 618 NE2 GLN A 80 -1.813 -30.336 -6.352 1.00 52.41 N ATOM 0 H GLN A 80 -2.707 -26.020 -2.560 1.00 21.41 H new ATOM 0 HA GLN A 80 -1.908 -28.088 -2.420 1.00 40.42 H new ATOM 0 HB2 GLN A 80 -1.428 -27.467 -4.965 1.00 54.22 H new ATOM 0 HB3 GLN A 80 0.246 -27.541 -4.452 1.00 54.22 H new ATOM 0 HG2 GLN A 80 0.116 -29.742 -4.893 1.00 55.01 H new ATOM 0 HG3 GLN A 80 -0.752 -29.870 -3.375 1.00 55.01 H new ATOM 0 HE21 GLN A 80 -0.878 -30.313 -6.759 1.00 52.41 H new ATOM 0 HE22 GLN A 80 -2.600 -30.683 -6.901 1.00 52.41 H new ATOM 627 N LYS A 81 -0.090 -26.763 -0.758 1.00 63.43 N ATOM 628 CA LYS A 81 0.994 -26.686 0.215 1.00 21.53 C ATOM 629 C LYS A 81 1.274 -28.055 0.827 1.00 30.20 C ATOM 630 O LYS A 81 0.470 -28.979 0.698 1.00 33.50 O ATOM 631 CB LYS A 81 0.647 -25.684 1.318 1.00 22.43 C ATOM 632 CG LYS A 81 1.406 -24.373 1.210 1.00 41.11 C ATOM 633 CD LYS A 81 2.643 -24.371 2.092 1.00 61.24 C ATOM 634 CE LYS A 81 2.430 -23.540 3.349 1.00 2.15 C ATOM 635 NZ LYS A 81 1.382 -24.127 4.230 1.00 21.14 N ATOM 0 H LYS A 81 -0.946 -26.285 -0.474 1.00 63.43 H new ATOM 0 HA LYS A 81 1.891 -26.349 -0.304 1.00 21.53 H new ATOM 0 HB2 LYS A 81 -0.423 -25.478 1.287 1.00 22.43 H new ATOM 0 HB3 LYS A 81 0.856 -26.137 2.287 1.00 22.43 H new ATOM 0 HG2 LYS A 81 1.697 -24.204 0.173 1.00 41.11 H new ATOM 0 HG3 LYS A 81 0.753 -23.549 1.496 1.00 41.11 H new ATOM 0 HD2 LYS A 81 2.895 -25.395 2.370 1.00 61.24 H new ATOM 0 HD3 LYS A 81 3.490 -23.975 1.532 1.00 61.24 H new ATOM 0 HE2 LYS A 81 3.368 -23.467 3.899 1.00 2.15 H new ATOM 0 HE3 LYS A 81 2.144 -22.526 3.070 1.00 2.15 H new ATOM 0 HZ1 LYS A 81 1.278 -23.542 5.083 1.00 21.14 H new ATOM 0 HZ2 LYS A 81 0.477 -24.158 3.719 1.00 21.14 H new ATOM 0 HZ3 LYS A 81 1.659 -25.092 4.503 1.00 21.14 H new ATOM 649 N ILE A 82 2.418 -28.178 1.493 1.00 41.42 N ATOM 650 CA ILE A 82 2.801 -29.433 2.127 1.00 34.02 C ATOM 651 C ILE A 82 2.348 -29.476 3.582 1.00 2.20 C ATOM 652 O ILE A 82 3.157 -29.670 4.489 1.00 40.24 O ATOM 653 CB ILE A 82 4.324 -29.651 2.069 1.00 51.35 C ATOM 654 CG1 ILE A 82 4.852 -29.344 0.666 1.00 63.45 C ATOM 655 CG2 ILE A 82 4.672 -31.076 2.472 1.00 33.03 C ATOM 656 CD1 ILE A 82 4.276 -30.243 -0.406 1.00 62.22 C ATOM 0 H ILE A 82 3.095 -27.424 1.607 1.00 41.42 H new ATOM 0 HA ILE A 82 2.306 -30.230 1.572 1.00 34.02 H new ATOM 0 HB ILE A 82 4.800 -28.969 2.773 1.00 51.35 H new ATOM 0 HG12 ILE A 82 4.625 -28.307 0.420 1.00 63.45 H new ATOM 0 HG13 ILE A 82 5.938 -29.441 0.666 1.00 63.45 H new ATOM 0 HG21 ILE A 82 5.752 -31.214 2.426 1.00 33.03 H new ATOM 0 HG22 ILE A 82 4.326 -31.261 3.489 1.00 33.03 H new ATOM 0 HG23 ILE A 82 4.188 -31.775 1.791 1.00 33.03 H new ATOM 0 HD11 ILE A 82 4.694 -29.969 -1.374 1.00 62.22 H new ATOM 0 HD12 ILE A 82 4.526 -31.280 -0.184 1.00 62.22 H new ATOM 0 HD13 ILE A 82 3.192 -30.128 -0.433 1.00 62.22 H new ATOM 668 N ARG A 83 1.048 -29.295 3.797 1.00 54.12 N ATOM 669 CA ARG A 83 0.486 -29.313 5.143 1.00 32.43 C ATOM 670 C ARG A 83 -0.386 -30.547 5.351 1.00 54.31 C ATOM 671 O ARG A 83 -1.577 -30.436 5.647 1.00 71.25 O ATOM 672 CB ARG A 83 -0.333 -28.046 5.392 1.00 42.41 C ATOM 673 CG ARG A 83 -1.309 -27.722 4.274 1.00 53.33 C ATOM 674 CD ARG A 83 -2.620 -27.177 4.818 1.00 53.54 C ATOM 675 NE ARG A 83 -3.707 -27.295 3.849 1.00 40.13 N ATOM 676 CZ ARG A 83 -4.965 -26.957 4.112 1.00 72.21 C ATOM 677 NH1 ARG A 83 -5.293 -26.482 5.304 1.00 64.14 N ATOM 678 NH2 ARG A 83 -5.898 -27.094 3.177 1.00 60.12 N ATOM 0 H ARG A 83 0.365 -29.134 3.057 1.00 54.12 H new ATOM 0 HA ARG A 83 1.311 -29.349 5.855 1.00 32.43 H new ATOM 0 HB2 ARG A 83 -0.886 -28.159 6.324 1.00 42.41 H new ATOM 0 HB3 ARG A 83 0.347 -27.204 5.524 1.00 42.41 H new ATOM 0 HG2 ARG A 83 -0.862 -26.991 3.600 1.00 53.33 H new ATOM 0 HG3 ARG A 83 -1.503 -28.620 3.687 1.00 53.33 H new ATOM 0 HD2 ARG A 83 -2.886 -27.715 5.728 1.00 53.54 H new ATOM 0 HD3 ARG A 83 -2.491 -26.130 5.092 1.00 53.54 H new ATOM 0 HE ARG A 83 -3.489 -27.656 2.920 1.00 40.13 H new ATOM 0 HH11 ARG A 83 -4.579 -26.374 6.024 1.00 64.14 H new ATOM 0 HH12 ARG A 83 -6.260 -26.224 5.502 1.00 64.14 H new ATOM 0 HH21 ARG A 83 -5.649 -27.459 2.258 1.00 60.12 H new ATOM 0 HH22 ARG A 83 -6.864 -26.835 3.378 1.00 60.12 H new ATOM 692 N LYS A 84 0.212 -31.722 5.192 1.00 23.12 N ATOM 693 CA LYS A 84 -0.509 -32.978 5.363 1.00 45.10 C ATOM 694 C LYS A 84 0.097 -33.805 6.492 1.00 21.23 C ATOM 695 O LYS A 84 1.316 -33.966 6.532 1.00 22.43 O ATOM 696 CB LYS A 84 -0.490 -33.782 4.061 1.00 1.22 C ATOM 697 CG LYS A 84 -1.703 -33.538 3.178 1.00 63.20 C ATOM 698 CD LYS A 84 -2.680 -34.700 3.241 1.00 31.31 C ATOM 699 CE LYS A 84 -3.750 -34.585 2.166 1.00 2.24 C ATOM 700 NZ LYS A 84 -5.122 -34.709 2.734 1.00 65.42 N ATOM 0 H LYS A 84 1.195 -31.831 4.945 1.00 23.12 H new ATOM 0 HA LYS A 84 -1.541 -32.742 5.623 1.00 45.10 H new ATOM 0 HB2 LYS A 84 0.412 -33.532 3.502 1.00 1.22 H new ATOM 0 HB3 LYS A 84 -0.433 -34.844 4.300 1.00 1.22 H new ATOM 0 HG2 LYS A 84 -2.204 -32.622 3.491 1.00 63.20 H new ATOM 0 HG3 LYS A 84 -1.380 -33.388 2.148 1.00 63.20 H new ATOM 0 HD2 LYS A 84 -2.139 -35.639 3.119 1.00 31.31 H new ATOM 0 HD3 LYS A 84 -3.151 -34.728 4.224 1.00 31.31 H new ATOM 0 HE2 LYS A 84 -3.653 -33.626 1.658 1.00 2.24 H new ATOM 0 HE3 LYS A 84 -3.596 -35.360 1.416 1.00 2.24 H new ATOM 0 HZ1 LYS A 84 -5.823 -34.625 1.970 1.00 65.42 H new ATOM 0 HZ2 LYS A 84 -5.224 -35.635 3.197 1.00 65.42 H new ATOM 0 HZ3 LYS A 84 -5.278 -33.954 3.432 1.00 65.42 H new TER 714 LYS A 84 ATOM 715 N GLY B 141 -2.687 31.208 -6.152 1.00 75.54 N ATOM 716 CA GLY B 141 -2.870 30.286 -7.258 1.00 4.13 C ATOM 717 C GLY B 141 -2.084 30.693 -8.488 1.00 34.10 C ATOM 718 O GLY B 141 -2.432 30.316 -9.608 1.00 1.33 O ATOM 0 HA2 GLY B 141 -2.563 29.287 -6.949 1.00 4.13 H new ATOM 0 HA3 GLY B 141 -3.929 30.231 -7.509 1.00 4.13 H new ATOM 722 N CYS B 142 -1.023 31.465 -8.282 1.00 13.12 N ATOM 723 CA CYS B 142 -0.187 31.925 -9.385 1.00 54.41 C ATOM 724 C CYS B 142 0.475 30.748 -10.094 1.00 64.03 C ATOM 725 O CYS B 142 0.584 29.648 -9.553 1.00 33.04 O ATOM 726 CB CYS B 142 0.880 32.894 -8.874 1.00 64.35 C ATOM 727 SG CYS B 142 0.449 34.639 -9.071 1.00 4.42 S ATOM 0 H CYS B 142 -0.721 31.785 -7.362 1.00 13.12 H new ATOM 0 HA CYS B 142 -0.826 32.443 -10.100 1.00 54.41 H new ATOM 0 HB2 CYS B 142 1.062 32.693 -7.818 1.00 64.35 H new ATOM 0 HB3 CYS B 142 1.814 32.700 -9.401 1.00 64.35 H new ATOM 0 HG CYS B 142 1.412 35.379 -8.608 1.00 4.42 H new ATOM 733 N PRO B 143 0.927 30.982 -11.335 1.00 72.13 N ATOM 734 CA PRO B 143 1.584 29.954 -12.145 1.00 23.53 C ATOM 735 C PRO B 143 2.963 29.585 -11.608 1.00 62.12 C ATOM 736 O PRO B 143 3.959 30.234 -11.930 1.00 3.32 O ATOM 737 CB PRO B 143 1.706 30.610 -13.523 1.00 20.01 C ATOM 738 CG PRO B 143 1.711 32.075 -13.245 1.00 23.44 C ATOM 739 CD PRO B 143 0.830 32.270 -12.042 1.00 71.25 C ATOM 0 HA PRO B 143 1.022 29.020 -12.150 1.00 23.53 H new ATOM 0 HB2 PRO B 143 2.620 30.300 -14.030 1.00 20.01 H new ATOM 0 HB3 PRO B 143 0.873 30.332 -14.169 1.00 20.01 H new ATOM 0 HG2 PRO B 143 2.722 32.432 -13.050 1.00 23.44 H new ATOM 0 HG3 PRO B 143 1.334 32.636 -14.100 1.00 23.44 H new ATOM 0 HD2 PRO B 143 1.176 33.096 -11.421 1.00 71.25 H new ATOM 0 HD3 PRO B 143 -0.197 32.495 -12.329 1.00 71.25 H new ATOM 747 N ALA B 144 3.014 28.541 -10.787 1.00 14.51 N ATOM 748 CA ALA B 144 4.271 28.086 -10.206 1.00 14.03 C ATOM 749 C ALA B 144 4.469 26.591 -10.430 1.00 34.41 C ATOM 750 O ALA B 144 3.667 25.775 -9.979 1.00 43.34 O ATOM 751 CB ALA B 144 4.314 28.410 -8.721 1.00 1.24 C ATOM 0 H ALA B 144 2.199 27.994 -10.509 1.00 14.51 H new ATOM 0 HA ALA B 144 5.085 28.612 -10.704 1.00 14.03 H new ATOM 0 HB1 ALA B 144 5.258 28.064 -8.300 1.00 1.24 H new ATOM 0 HB2 ALA B 144 4.227 29.487 -8.581 1.00 1.24 H new ATOM 0 HB3 ALA B 144 3.487 27.911 -8.216 1.00 1.24 H new ATOM 757 N GLU B 145 5.543 26.239 -11.132 1.00 3.15 N ATOM 758 CA GLU B 145 5.844 24.841 -11.416 1.00 60.52 C ATOM 759 C GLU B 145 7.348 24.585 -11.355 1.00 0.42 C ATOM 760 O GLU B 145 8.004 24.439 -12.385 1.00 42.04 O ATOM 761 CB GLU B 145 5.305 24.451 -12.794 1.00 23.33 C ATOM 762 CG GLU B 145 5.600 23.010 -13.176 1.00 33.04 C ATOM 763 CD GLU B 145 4.737 22.522 -14.324 1.00 2.33 C ATOM 764 OE1 GLU B 145 3.586 22.992 -14.442 1.00 35.31 O ATOM 765 OE2 GLU B 145 5.213 21.671 -15.104 1.00 31.01 O ATOM 0 H GLU B 145 6.218 26.902 -11.514 1.00 3.15 H new ATOM 0 HA GLU B 145 5.358 24.229 -10.656 1.00 60.52 H new ATOM 0 HB2 GLU B 145 4.227 24.609 -12.812 1.00 23.33 H new ATOM 0 HB3 GLU B 145 5.737 25.113 -13.545 1.00 23.33 H new ATOM 0 HG2 GLU B 145 6.651 22.919 -13.452 1.00 33.04 H new ATOM 0 HG3 GLU B 145 5.442 22.369 -12.309 1.00 33.04 H new ATOM 772 N GLN B 146 7.884 24.533 -10.139 1.00 11.01 N ATOM 773 CA GLN B 146 9.309 24.296 -9.944 1.00 71.42 C ATOM 774 C GLN B 146 9.559 23.500 -8.666 1.00 13.44 C ATOM 775 O GLN B 146 8.917 23.735 -7.642 1.00 21.51 O ATOM 776 CB GLN B 146 10.065 25.624 -9.886 1.00 72.12 C ATOM 777 CG GLN B 146 9.659 26.505 -8.716 1.00 54.52 C ATOM 778 CD GLN B 146 10.367 27.846 -8.722 1.00 64.11 C ATOM 779 OE1 GLN B 146 11.520 27.951 -9.143 1.00 4.55 O ATOM 780 NE2 GLN B 146 9.680 28.881 -8.252 1.00 22.24 N ATOM 0 H GLN B 146 7.353 24.652 -9.276 1.00 11.01 H new ATOM 0 HA GLN B 146 9.674 23.714 -10.791 1.00 71.42 H new ATOM 0 HB2 GLN B 146 11.134 25.421 -9.823 1.00 72.12 H new ATOM 0 HB3 GLN B 146 9.898 26.169 -10.815 1.00 72.12 H new ATOM 0 HG2 GLN B 146 8.582 26.667 -8.745 1.00 54.52 H new ATOM 0 HG3 GLN B 146 9.878 25.987 -7.783 1.00 54.52 H new ATOM 0 HE21 GLN B 146 8.727 28.749 -7.913 1.00 22.24 H new ATOM 0 HE22 GLN B 146 10.105 29.808 -8.230 1.00 22.24 H new ATOM 789 N ARG B 147 10.493 22.558 -8.736 1.00 25.25 N ATOM 790 CA ARG B 147 10.826 21.726 -7.585 1.00 14.15 C ATOM 791 C ARG B 147 12.027 20.835 -7.888 1.00 12.51 C ATOM 792 O ARG B 147 12.208 20.384 -9.018 1.00 34.54 O ATOM 793 CB ARG B 147 9.625 20.864 -7.188 1.00 21.40 C ATOM 794 CG ARG B 147 9.259 19.814 -8.225 1.00 52.15 C ATOM 795 CD ARG B 147 9.912 18.475 -7.917 1.00 53.43 C ATOM 796 NE ARG B 147 10.758 18.014 -9.013 1.00 33.34 N ATOM 797 CZ ARG B 147 10.285 17.460 -10.125 1.00 1.50 C ATOM 798 NH1 ARG B 147 8.979 17.301 -10.285 1.00 32.22 N ATOM 799 NH2 ARG B 147 11.119 17.065 -11.078 1.00 32.11 N ATOM 0 H ARG B 147 11.033 22.351 -9.577 1.00 25.25 H new ATOM 0 HA ARG B 147 11.083 22.384 -6.755 1.00 14.15 H new ATOM 0 HB2 ARG B 147 9.842 20.368 -6.242 1.00 21.40 H new ATOM 0 HB3 ARG B 147 8.764 21.511 -7.019 1.00 21.40 H new ATOM 0 HG2 ARG B 147 8.176 19.693 -8.256 1.00 52.15 H new ATOM 0 HG3 ARG B 147 9.570 20.153 -9.213 1.00 52.15 H new ATOM 0 HD2 ARG B 147 10.510 18.563 -7.010 1.00 53.43 H new ATOM 0 HD3 ARG B 147 9.139 17.732 -7.718 1.00 53.43 H new ATOM 0 HE ARG B 147 11.768 18.123 -8.921 1.00 33.34 H new ATOM 0 HH11 ARG B 147 8.335 17.604 -9.554 1.00 32.22 H new ATOM 0 HH12 ARG B 147 8.618 16.876 -11.139 1.00 32.22 H new ATOM 0 HH21 ARG B 147 12.125 17.186 -10.958 1.00 32.11 H new ATOM 0 HH22 ARG B 147 10.755 16.640 -11.931 1.00 32.11 H new ATOM 813 N ALA B 148 12.844 20.587 -6.870 1.00 72.45 N ATOM 814 CA ALA B 148 14.028 19.750 -7.026 1.00 14.24 C ATOM 815 C ALA B 148 14.699 19.493 -5.681 1.00 32.02 C ATOM 816 O ALA B 148 15.918 19.345 -5.605 1.00 60.44 O ATOM 817 CB ALA B 148 15.008 20.398 -7.993 1.00 22.12 C ATOM 0 H ALA B 148 12.708 20.954 -5.928 1.00 72.45 H new ATOM 0 HA ALA B 148 13.714 18.790 -7.434 1.00 14.24 H new ATOM 0 HB1 ALA B 148 15.887 19.763 -8.100 1.00 22.12 H new ATOM 0 HB2 ALA B 148 14.531 20.524 -8.965 1.00 22.12 H new ATOM 0 HB3 ALA B 148 15.309 21.372 -7.608 1.00 22.12 H new ATOM 823 N SER B 149 13.895 19.440 -4.624 1.00 51.05 N ATOM 824 CA SER B 149 14.413 19.205 -3.281 1.00 33.13 C ATOM 825 C SER B 149 14.025 17.816 -2.785 1.00 3.43 C ATOM 826 O SER B 149 13.095 17.185 -3.290 1.00 13.41 O ATOM 827 CB SER B 149 13.889 20.269 -2.316 1.00 63.11 C ATOM 828 OG SER B 149 12.666 20.817 -2.776 1.00 11.22 O ATOM 0 H SER B 149 12.883 19.557 -4.671 1.00 51.05 H new ATOM 0 HA SER B 149 15.501 19.266 -3.322 1.00 33.13 H new ATOM 0 HB2 SER B 149 13.746 19.830 -1.329 1.00 63.11 H new ATOM 0 HB3 SER B 149 14.629 21.062 -2.208 1.00 63.11 H new ATOM 0 HG SER B 149 12.512 21.683 -2.343 1.00 11.22 H new ATOM 834 N PRO B 150 14.753 17.325 -1.770 1.00 35.25 N ATOM 835 CA PRO B 150 14.503 16.006 -1.183 1.00 63.34 C ATOM 836 C PRO B 150 13.197 15.959 -0.397 1.00 41.55 C ATOM 837 O PRO B 150 12.681 14.882 -0.094 1.00 70.25 O ATOM 838 CB PRO B 150 15.697 15.803 -0.248 1.00 64.14 C ATOM 839 CG PRO B 150 16.148 17.181 0.097 1.00 15.00 C ATOM 840 CD PRO B 150 15.875 18.022 -1.120 1.00 65.31 C ATOM 0 HA PRO B 150 14.404 15.233 -1.945 1.00 63.34 H new ATOM 0 HB2 PRO B 150 15.411 15.245 0.644 1.00 64.14 H new ATOM 0 HB3 PRO B 150 16.491 15.238 -0.737 1.00 64.14 H new ATOM 0 HG2 PRO B 150 15.609 17.563 0.964 1.00 15.00 H new ATOM 0 HG3 PRO B 150 17.208 17.193 0.350 1.00 15.00 H new ATOM 0 HD2 PRO B 150 15.611 19.045 -0.851 1.00 65.31 H new ATOM 0 HD3 PRO B 150 16.746 18.079 -1.773 1.00 65.31 H new ATOM 848 N LEU B 151 12.667 17.132 -0.069 1.00 60.13 N ATOM 849 CA LEU B 151 11.420 17.226 0.682 1.00 12.40 C ATOM 850 C LEU B 151 10.326 16.389 0.026 1.00 41.40 C ATOM 851 O LEU B 151 9.524 15.750 0.709 1.00 33.40 O ATOM 852 CB LEU B 151 10.971 18.684 0.784 1.00 55.50 C ATOM 853 CG LEU B 151 12.036 19.685 1.233 1.00 35.33 C ATOM 854 CD1 LEU B 151 12.046 20.901 0.319 1.00 0.43 C ATOM 855 CD2 LEU B 151 11.802 20.103 2.677 1.00 20.43 C ATOM 0 H LEU B 151 13.082 18.032 -0.311 1.00 60.13 H new ATOM 0 HA LEU B 151 11.598 16.837 1.685 1.00 12.40 H new ATOM 0 HB2 LEU B 151 10.595 18.996 -0.190 1.00 55.50 H new ATOM 0 HB3 LEU B 151 10.134 18.738 1.480 1.00 55.50 H new ATOM 0 HG LEU B 151 13.010 19.201 1.170 1.00 35.33 H new ATOM 0 HD11 LEU B 151 12.810 21.602 0.654 1.00 0.43 H new ATOM 0 HD12 LEU B 151 12.264 20.587 -0.702 1.00 0.43 H new ATOM 0 HD13 LEU B 151 11.070 21.386 0.348 1.00 0.43 H new ATOM 0 HD21 LEU B 151 12.570 20.815 2.979 1.00 20.43 H new ATOM 0 HD22 LEU B 151 10.820 20.568 2.767 1.00 20.43 H new ATOM 0 HD23 LEU B 151 11.848 19.225 3.322 1.00 20.43 H new ATOM 867 N THR B 152 10.299 16.398 -1.303 1.00 3.54 N ATOM 868 CA THR B 152 9.304 15.640 -2.051 1.00 22.32 C ATOM 869 C THR B 152 9.428 14.146 -1.774 1.00 30.13 C ATOM 870 O THR B 152 8.435 13.417 -1.787 1.00 41.13 O ATOM 871 CB THR B 152 9.437 15.881 -3.567 1.00 5.41 C ATOM 872 OG1 THR B 152 9.478 17.287 -3.836 1.00 73.41 O ATOM 873 CG2 THR B 152 8.276 15.249 -4.319 1.00 50.41 C ATOM 0 H THR B 152 10.955 16.922 -1.883 1.00 3.54 H new ATOM 0 HA THR B 152 8.326 15.989 -1.719 1.00 22.32 H new ATOM 0 HB THR B 152 10.364 15.419 -3.907 1.00 5.41 H new ATOM 0 HG1 THR B 152 9.564 17.433 -4.801 1.00 73.41 H new ATOM 0 HG21 THR B 152 8.392 15.432 -5.387 1.00 50.41 H new ATOM 0 HG22 THR B 152 8.264 14.175 -4.134 1.00 50.41 H new ATOM 0 HG23 THR B 152 7.339 15.686 -3.975 1.00 50.41 H new ATOM 881 N SER B 153 10.652 13.695 -1.522 1.00 23.43 N ATOM 882 CA SER B 153 10.906 12.286 -1.244 1.00 44.12 C ATOM 883 C SER B 153 10.315 11.883 0.104 1.00 72.44 C ATOM 884 O SER B 153 9.497 10.966 0.185 1.00 63.42 O ATOM 885 CB SER B 153 12.411 12.005 -1.258 1.00 11.23 C ATOM 886 OG SER B 153 13.105 12.984 -2.010 1.00 41.22 O ATOM 0 H SER B 153 11.484 14.285 -1.505 1.00 23.43 H new ATOM 0 HA SER B 153 10.425 11.695 -2.023 1.00 44.12 H new ATOM 0 HB2 SER B 153 12.791 11.990 -0.236 1.00 11.23 H new ATOM 0 HB3 SER B 153 12.596 11.018 -1.682 1.00 11.23 H new ATOM 0 HG SER B 153 14.064 12.783 -2.002 1.00 41.22 H new ATOM 892 N ILE B 154 10.735 12.574 1.158 1.00 52.21 N ATOM 893 CA ILE B 154 10.247 12.290 2.501 1.00 2.30 C ATOM 894 C ILE B 154 8.723 12.264 2.539 1.00 14.34 C ATOM 895 O ILE B 154 8.121 11.375 3.142 1.00 32.01 O ATOM 896 CB ILE B 154 10.756 13.329 3.517 1.00 14.20 C ATOM 897 CG1 ILE B 154 12.286 13.361 3.524 1.00 5.23 C ATOM 898 CG2 ILE B 154 10.220 13.019 4.906 1.00 4.22 C ATOM 899 CD1 ILE B 154 12.864 14.433 4.421 1.00 31.14 C ATOM 0 H ILE B 154 11.412 13.335 1.108 1.00 52.21 H new ATOM 0 HA ILE B 154 10.632 11.307 2.774 1.00 2.30 H new ATOM 0 HB ILE B 154 10.393 14.313 3.221 1.00 14.20 H new ATOM 0 HG12 ILE B 154 12.660 12.389 3.846 1.00 5.23 H new ATOM 0 HG13 ILE B 154 12.643 13.519 2.506 1.00 5.23 H new ATOM 0 HG21 ILE B 154 10.589 13.762 5.613 1.00 4.22 H new ATOM 0 HG22 ILE B 154 9.130 13.043 4.889 1.00 4.22 H new ATOM 0 HG23 ILE B 154 10.556 12.029 5.213 1.00 4.22 H new ATOM 0 HD11 ILE B 154 13.952 14.397 4.376 1.00 31.14 H new ATOM 0 HD12 ILE B 154 12.519 15.412 4.087 1.00 31.14 H new ATOM 0 HD13 ILE B 154 12.537 14.264 5.447 1.00 31.14 H new ATOM 911 N ILE B 155 8.104 13.244 1.888 1.00 11.21 N ATOM 912 CA ILE B 155 6.650 13.332 1.844 1.00 44.54 C ATOM 913 C ILE B 155 6.053 12.184 1.038 1.00 21.45 C ATOM 914 O ILE B 155 5.077 11.560 1.454 1.00 51.21 O ATOM 915 CB ILE B 155 6.184 14.668 1.235 1.00 31.13 C ATOM 916 CG1 ILE B 155 6.742 15.843 2.041 1.00 71.20 C ATOM 917 CG2 ILE B 155 4.665 14.727 1.186 1.00 2.31 C ATOM 918 CD1 ILE B 155 6.641 17.170 1.322 1.00 5.10 C ATOM 0 H ILE B 155 8.587 13.988 1.384 1.00 11.21 H new ATOM 0 HA ILE B 155 6.300 13.270 2.874 1.00 44.54 H new ATOM 0 HB ILE B 155 6.564 14.737 0.216 1.00 31.13 H new ATOM 0 HG12 ILE B 155 6.207 15.910 2.988 1.00 71.20 H new ATOM 0 HG13 ILE B 155 7.787 15.646 2.279 1.00 71.20 H new ATOM 0 HG21 ILE B 155 4.352 15.677 0.753 1.00 2.31 H new ATOM 0 HG22 ILE B 155 4.289 13.908 0.574 1.00 2.31 H new ATOM 0 HG23 ILE B 155 4.265 14.639 2.196 1.00 2.31 H new ATOM 0 HD11 ILE B 155 7.055 17.957 1.952 1.00 5.10 H new ATOM 0 HD12 ILE B 155 7.200 17.121 0.388 1.00 5.10 H new ATOM 0 HD13 ILE B 155 5.595 17.389 1.108 1.00 5.10 H new ATOM 930 N SER B 156 6.649 11.908 -0.118 1.00 23.11 N ATOM 931 CA SER B 156 6.176 10.835 -0.985 1.00 34.12 C ATOM 932 C SER B 156 6.257 9.487 -0.275 1.00 72.53 C ATOM 933 O SER B 156 5.355 8.659 -0.387 1.00 2.35 O ATOM 934 CB SER B 156 6.995 10.794 -2.276 1.00 74.55 C ATOM 935 OG SER B 156 8.306 10.311 -2.033 1.00 11.44 O ATOM 0 H SER B 156 7.460 12.413 -0.476 1.00 23.11 H new ATOM 0 HA SER B 156 5.133 11.034 -1.231 1.00 34.12 H new ATOM 0 HB2 SER B 156 6.498 10.155 -3.006 1.00 74.55 H new ATOM 0 HB3 SER B 156 7.046 11.793 -2.710 1.00 74.55 H new ATOM 0 HG SER B 156 8.657 10.716 -1.212 1.00 11.44 H new ATOM 941 N ALA B 157 7.346 9.275 0.456 1.00 71.43 N ATOM 942 CA ALA B 157 7.547 8.030 1.186 1.00 65.11 C ATOM 943 C ALA B 157 6.499 7.861 2.281 1.00 13.33 C ATOM 944 O ALA B 157 5.882 6.803 2.407 1.00 34.44 O ATOM 945 CB ALA B 157 8.946 7.986 1.782 1.00 44.51 C ATOM 0 H ALA B 157 8.103 9.950 0.558 1.00 71.43 H new ATOM 0 HA ALA B 157 7.438 7.204 0.483 1.00 65.11 H new ATOM 0 HB1 ALA B 157 9.081 7.050 2.324 1.00 44.51 H new ATOM 0 HB2 ALA B 157 9.684 8.052 0.983 1.00 44.51 H new ATOM 0 HB3 ALA B 157 9.076 8.824 2.467 1.00 44.51 H new ATOM 951 N VAL B 158 6.301 8.911 3.073 1.00 33.13 N ATOM 952 CA VAL B 158 5.326 8.879 4.156 1.00 3.25 C ATOM 953 C VAL B 158 3.948 8.476 3.644 1.00 44.14 C ATOM 954 O VAL B 158 3.261 7.659 4.257 1.00 14.51 O ATOM 955 CB VAL B 158 5.222 10.246 4.858 1.00 62.03 C ATOM 956 CG1 VAL B 158 4.138 10.218 5.924 1.00 3.42 C ATOM 957 CG2 VAL B 158 6.563 10.639 5.460 1.00 0.14 C ATOM 0 H VAL B 158 6.803 9.794 2.984 1.00 33.13 H new ATOM 0 HA VAL B 158 5.674 8.136 4.874 1.00 3.25 H new ATOM 0 HB VAL B 158 4.949 10.996 4.116 1.00 62.03 H new ATOM 0 HG11 VAL B 158 4.079 11.192 6.409 1.00 3.42 H new ATOM 0 HG12 VAL B 158 3.179 9.985 5.462 1.00 3.42 H new ATOM 0 HG13 VAL B 158 4.378 9.457 6.667 1.00 3.42 H new ATOM 0 HG21 VAL B 158 6.471 11.607 5.952 1.00 0.14 H new ATOM 0 HG22 VAL B 158 6.868 9.889 6.190 1.00 0.14 H new ATOM 0 HG23 VAL B 158 7.312 10.703 4.670 1.00 0.14 H new ATOM 967 N VAL B 159 3.549 9.055 2.516 1.00 33.52 N ATOM 968 CA VAL B 159 2.253 8.756 1.919 1.00 63.42 C ATOM 969 C VAL B 159 2.143 7.279 1.555 1.00 43.54 C ATOM 970 O VAL B 159 1.159 6.619 1.885 1.00 43.11 O ATOM 971 CB VAL B 159 2.007 9.603 0.657 1.00 42.33 C ATOM 972 CG1 VAL B 159 0.685 9.223 0.008 1.00 43.22 C ATOM 973 CG2 VAL B 159 2.037 11.085 0.997 1.00 53.01 C ATOM 0 H VAL B 159 4.105 9.734 1.997 1.00 33.52 H new ATOM 0 HA VAL B 159 1.497 9.001 2.665 1.00 63.42 H new ATOM 0 HB VAL B 159 2.806 9.401 -0.057 1.00 42.33 H new ATOM 0 HG11 VAL B 159 0.528 9.832 -0.882 1.00 43.22 H new ATOM 0 HG12 VAL B 159 0.707 8.170 -0.272 1.00 43.22 H new ATOM 0 HG13 VAL B 159 -0.129 9.394 0.713 1.00 43.22 H new ATOM 0 HG21 VAL B 159 1.861 11.669 0.094 1.00 53.01 H new ATOM 0 HG22 VAL B 159 1.260 11.306 1.729 1.00 53.01 H new ATOM 0 HG23 VAL B 159 3.011 11.343 1.412 1.00 53.01 H new ATOM 983 N GLY B 160 3.162 6.766 0.874 1.00 22.32 N ATOM 984 CA GLY B 160 3.161 5.370 0.477 1.00 32.04 C ATOM 985 C GLY B 160 3.126 4.429 1.665 1.00 35.13 C ATOM 986 O GLY B 160 2.335 3.485 1.695 1.00 75.13 O ATOM 0 H GLY B 160 3.989 7.292 0.590 1.00 22.32 H new ATOM 0 HA2 GLY B 160 2.298 5.177 -0.161 1.00 32.04 H new ATOM 0 HA3 GLY B 160 4.050 5.164 -0.119 1.00 32.04 H new ATOM 990 N ILE B 161 3.986 4.685 2.645 1.00 4.55 N ATOM 991 CA ILE B 161 4.049 3.853 3.841 1.00 3.11 C ATOM 992 C ILE B 161 2.769 3.971 4.662 1.00 0.34 C ATOM 993 O ILE B 161 2.364 3.026 5.340 1.00 24.41 O ATOM 994 CB ILE B 161 5.250 4.232 4.728 1.00 34.05 C ATOM 995 CG1 ILE B 161 6.555 4.099 3.939 1.00 33.12 C ATOM 996 CG2 ILE B 161 5.286 3.359 5.973 1.00 72.41 C ATOM 997 CD1 ILE B 161 7.762 4.641 4.673 1.00 34.32 C ATOM 0 H ILE B 161 4.648 5.461 2.635 1.00 4.55 H new ATOM 0 HA ILE B 161 4.167 2.824 3.503 1.00 3.11 H new ATOM 0 HB ILE B 161 5.139 5.270 5.040 1.00 34.05 H new ATOM 0 HG12 ILE B 161 6.724 3.048 3.705 1.00 33.12 H new ATOM 0 HG13 ILE B 161 6.451 4.624 2.989 1.00 33.12 H new ATOM 0 HG21 ILE B 161 6.140 3.639 6.589 1.00 72.41 H new ATOM 0 HG22 ILE B 161 4.367 3.499 6.542 1.00 72.41 H new ATOM 0 HG23 ILE B 161 5.377 2.313 5.681 1.00 72.41 H new ATOM 0 HD11 ILE B 161 8.651 4.514 4.055 1.00 34.32 H new ATOM 0 HD12 ILE B 161 7.615 5.700 4.883 1.00 34.32 H new ATOM 0 HD13 ILE B 161 7.891 4.100 5.610 1.00 34.32 H new ATOM 1009 N LEU B 162 2.135 5.135 4.594 1.00 52.43 N ATOM 1010 CA LEU B 162 0.898 5.376 5.329 1.00 75.02 C ATOM 1011 C LEU B 162 -0.254 4.570 4.738 1.00 13.11 C ATOM 1012 O LEU B 162 -1.018 3.934 5.464 1.00 41.03 O ATOM 1013 CB LEU B 162 0.553 6.867 5.311 1.00 42.35 C ATOM 1014 CG LEU B 162 -0.651 7.288 6.154 1.00 64.11 C ATOM 1015 CD1 LEU B 162 -0.239 7.509 7.601 1.00 10.04 C ATOM 1016 CD2 LEU B 162 -1.289 8.545 5.582 1.00 2.23 C ATOM 0 H LEU B 162 2.456 5.927 4.038 1.00 52.43 H new ATOM 0 HA LEU B 162 1.050 5.056 6.360 1.00 75.02 H new ATOM 0 HB2 LEU B 162 1.424 7.425 5.654 1.00 42.35 H new ATOM 0 HB3 LEU B 162 0.370 7.165 4.278 1.00 42.35 H new ATOM 0 HG LEU B 162 -1.388 6.485 6.126 1.00 64.11 H new ATOM 0 HD11 LEU B 162 -1.109 7.808 8.185 1.00 10.04 H new ATOM 0 HD12 LEU B 162 0.171 6.585 8.008 1.00 10.04 H new ATOM 0 HD13 LEU B 162 0.517 8.293 7.648 1.00 10.04 H new ATOM 0 HD21 LEU B 162 -2.144 8.830 6.195 1.00 2.23 H new ATOM 0 HD22 LEU B 162 -0.559 9.354 5.579 1.00 2.23 H new ATOM 0 HD23 LEU B 162 -1.621 8.352 4.562 1.00 2.23 H new ATOM 1028 N LEU B 163 -0.371 4.599 3.414 1.00 41.54 N ATOM 1029 CA LEU B 163 -1.429 3.869 2.724 1.00 23.34 C ATOM 1030 C LEU B 163 -1.284 2.366 2.942 1.00 13.21 C ATOM 1031 O LEU B 163 -2.274 1.654 3.110 1.00 35.13 O ATOM 1032 CB LEU B 163 -1.400 4.183 1.228 1.00 72.42 C ATOM 1033 CG LEU B 163 -2.756 4.220 0.523 1.00 53.33 C ATOM 1034 CD1 LEU B 163 -2.669 5.030 -0.761 1.00 54.41 C ATOM 1035 CD2 LEU B 163 -3.246 2.809 0.235 1.00 33.12 C ATOM 0 H LEU B 163 0.253 5.120 2.798 1.00 41.54 H new ATOM 0 HA LEU B 163 -2.386 4.188 3.137 1.00 23.34 H new ATOM 0 HB2 LEU B 163 -0.915 5.149 1.089 1.00 72.42 H new ATOM 0 HB3 LEU B 163 -0.776 3.439 0.733 1.00 72.42 H new ATOM 0 HG LEU B 163 -3.475 4.704 1.184 1.00 53.33 H new ATOM 0 HD11 LEU B 163 -3.644 5.045 -1.249 1.00 54.41 H new ATOM 0 HD12 LEU B 163 -2.364 6.050 -0.528 1.00 54.41 H new ATOM 0 HD13 LEU B 163 -1.936 4.576 -1.428 1.00 54.41 H new ATOM 0 HD21 LEU B 163 -4.212 2.855 -0.267 1.00 33.12 H new ATOM 0 HD22 LEU B 163 -2.528 2.298 -0.406 1.00 33.12 H new ATOM 0 HD23 LEU B 163 -3.349 2.261 1.172 1.00 33.12 H new ATOM 1047 N VAL B 164 -0.043 1.890 2.941 1.00 20.42 N ATOM 1048 CA VAL B 164 0.233 0.472 3.142 1.00 13.21 C ATOM 1049 C VAL B 164 -0.243 0.009 4.514 1.00 45.01 C ATOM 1050 O VAL B 164 -1.048 -0.915 4.625 1.00 4.22 O ATOM 1051 CB VAL B 164 1.736 0.167 3.001 1.00 45.42 C ATOM 1052 CG1 VAL B 164 2.006 -1.310 3.248 1.00 33.22 C ATOM 1053 CG2 VAL B 164 2.239 0.588 1.629 1.00 13.15 C ATOM 0 H VAL B 164 0.788 2.466 2.803 1.00 20.42 H new ATOM 0 HA VAL B 164 -0.313 -0.070 2.370 1.00 13.21 H new ATOM 0 HB VAL B 164 2.278 0.741 3.752 1.00 45.42 H new ATOM 0 HG11 VAL B 164 3.073 -1.507 3.144 1.00 33.22 H new ATOM 0 HG12 VAL B 164 1.684 -1.575 4.255 1.00 33.22 H new ATOM 0 HG13 VAL B 164 1.454 -1.907 2.522 1.00 33.22 H new ATOM 0 HG21 VAL B 164 3.303 0.365 1.547 1.00 13.15 H new ATOM 0 HG22 VAL B 164 1.694 0.043 0.859 1.00 13.15 H new ATOM 0 HG23 VAL B 164 2.081 1.658 1.496 1.00 13.15 H new ATOM 1063 N VAL B 165 0.260 0.659 5.559 1.00 65.11 N ATOM 1064 CA VAL B 165 -0.114 0.315 6.926 1.00 10.02 C ATOM 1065 C VAL B 165 -1.629 0.281 7.089 1.00 3.31 C ATOM 1066 O VAL B 165 -2.187 -0.682 7.615 1.00 33.21 O ATOM 1067 CB VAL B 165 0.479 1.314 7.938 1.00 0.15 C ATOM 1068 CG1 VAL B 165 0.059 0.950 9.354 1.00 61.14 C ATOM 1069 CG2 VAL B 165 1.994 1.360 7.816 1.00 42.21 C ATOM 0 H VAL B 165 0.928 1.427 5.485 1.00 65.11 H new ATOM 0 HA VAL B 165 0.292 -0.677 7.126 1.00 10.02 H new ATOM 0 HB VAL B 165 0.091 2.307 7.713 1.00 0.15 H new ATOM 0 HG11 VAL B 165 0.487 1.666 10.056 1.00 61.14 H new ATOM 0 HG12 VAL B 165 -1.028 0.974 9.429 1.00 61.14 H new ATOM 0 HG13 VAL B 165 0.417 -0.051 9.594 1.00 61.14 H new ATOM 0 HG21 VAL B 165 2.396 2.071 8.538 1.00 42.21 H new ATOM 0 HG22 VAL B 165 2.405 0.370 8.014 1.00 42.21 H new ATOM 0 HG23 VAL B 165 2.269 1.672 6.808 1.00 42.21 H new ATOM 1079 N VAL B 166 -2.292 1.340 6.633 1.00 23.20 N ATOM 1080 CA VAL B 166 -3.744 1.431 6.726 1.00 23.40 C ATOM 1081 C VAL B 166 -4.414 0.224 6.078 1.00 64.53 C ATOM 1082 O VAL B 166 -5.405 -0.298 6.590 1.00 33.32 O ATOM 1083 CB VAL B 166 -4.269 2.715 6.058 1.00 43.45 C ATOM 1084 CG1 VAL B 166 -5.788 2.777 6.138 1.00 62.41 C ATOM 1085 CG2 VAL B 166 -3.644 3.944 6.702 1.00 32.52 C ATOM 0 H VAL B 166 -1.846 2.146 6.196 1.00 23.20 H new ATOM 0 HA VAL B 166 -3.992 1.454 7.787 1.00 23.40 H new ATOM 0 HB VAL B 166 -3.984 2.698 5.006 1.00 43.45 H new ATOM 0 HG11 VAL B 166 -6.140 3.691 5.661 1.00 62.41 H new ATOM 0 HG12 VAL B 166 -6.215 1.914 5.628 1.00 62.41 H new ATOM 0 HG13 VAL B 166 -6.098 2.771 7.183 1.00 62.41 H new ATOM 0 HG21 VAL B 166 -4.026 4.843 6.218 1.00 32.52 H new ATOM 0 HG22 VAL B 166 -3.897 3.968 7.762 1.00 32.52 H new ATOM 0 HG23 VAL B 166 -2.561 3.903 6.588 1.00 32.52 H new ATOM 1095 N LEU B 167 -3.864 -0.216 4.952 1.00 42.12 N ATOM 1096 CA LEU B 167 -4.408 -1.363 4.234 1.00 35.35 C ATOM 1097 C LEU B 167 -4.304 -2.631 5.074 1.00 61.43 C ATOM 1098 O LEU B 167 -5.280 -3.363 5.237 1.00 50.42 O ATOM 1099 CB LEU B 167 -3.670 -1.555 2.907 1.00 30.11 C ATOM 1100 CG LEU B 167 -4.488 -2.160 1.766 1.00 10.02 C ATOM 1101 CD1 LEU B 167 -4.394 -1.290 0.522 1.00 34.45 C ATOM 1102 CD2 LEU B 167 -4.018 -3.577 1.465 1.00 40.44 C ATOM 0 H LEU B 167 -3.042 0.204 4.517 1.00 42.12 H new ATOM 0 HA LEU B 167 -5.461 -1.168 4.033 1.00 35.35 H new ATOM 0 HB2 LEU B 167 -3.291 -0.586 2.582 1.00 30.11 H new ATOM 0 HB3 LEU B 167 -2.804 -2.193 3.085 1.00 30.11 H new ATOM 0 HG LEU B 167 -5.532 -2.203 2.076 1.00 10.02 H new ATOM 0 HD11 LEU B 167 -4.982 -1.736 -0.280 1.00 34.45 H new ATOM 0 HD12 LEU B 167 -4.779 -0.295 0.744 1.00 34.45 H new ATOM 0 HD13 LEU B 167 -3.353 -1.214 0.209 1.00 34.45 H new ATOM 0 HD21 LEU B 167 -4.611 -3.992 0.650 1.00 40.44 H new ATOM 0 HD22 LEU B 167 -2.967 -3.558 1.175 1.00 40.44 H new ATOM 0 HD23 LEU B 167 -4.138 -4.197 2.354 1.00 40.44 H new ATOM 1114 N GLY B 168 -3.114 -2.885 5.609 1.00 61.43 N ATOM 1115 CA GLY B 168 -2.904 -4.064 6.428 1.00 5.44 C ATOM 1116 C GLY B 168 -3.868 -4.138 7.595 1.00 53.52 C ATOM 1117 O GLY B 168 -4.435 -5.194 7.876 1.00 65.01 O ATOM 0 H GLY B 168 -2.291 -2.295 5.490 1.00 61.43 H new ATOM 0 HA2 GLY B 168 -3.016 -4.956 5.811 1.00 5.44 H new ATOM 0 HA3 GLY B 168 -1.881 -4.063 6.805 1.00 5.44 H new ATOM 1121 N VAL B 169 -4.056 -3.013 8.278 1.00 53.43 N ATOM 1122 CA VAL B 169 -4.958 -2.954 9.422 1.00 51.13 C ATOM 1123 C VAL B 169 -6.377 -3.343 9.024 1.00 14.23 C ATOM 1124 O VAL B 169 -7.014 -4.168 9.678 1.00 22.51 O ATOM 1125 CB VAL B 169 -4.980 -1.546 10.048 1.00 21.33 C ATOM 1126 CG1 VAL B 169 -5.971 -1.489 11.200 1.00 53.23 C ATOM 1127 CG2 VAL B 169 -3.587 -1.148 10.512 1.00 32.44 C ATOM 0 H VAL B 169 -3.595 -2.130 8.059 1.00 53.43 H new ATOM 0 HA VAL B 169 -4.582 -3.665 10.158 1.00 51.13 H new ATOM 0 HB VAL B 169 -5.302 -0.834 9.288 1.00 21.33 H new ATOM 0 HG11 VAL B 169 -5.973 -0.487 11.629 1.00 53.23 H new ATOM 0 HG12 VAL B 169 -6.969 -1.728 10.833 1.00 53.23 H new ATOM 0 HG13 VAL B 169 -5.683 -2.211 11.964 1.00 53.23 H new ATOM 0 HG21 VAL B 169 -3.621 -0.151 10.951 1.00 32.44 H new ATOM 0 HG22 VAL B 169 -3.234 -1.861 11.257 1.00 32.44 H new ATOM 0 HG23 VAL B 169 -2.907 -1.146 9.660 1.00 32.44 H new ATOM 1137 N VAL B 170 -6.868 -2.742 7.943 1.00 4.43 N ATOM 1138 CA VAL B 170 -8.212 -3.027 7.456 1.00 15.54 C ATOM 1139 C VAL B 170 -8.378 -4.507 7.131 1.00 22.21 C ATOM 1140 O VAL B 170 -9.293 -5.164 7.629 1.00 23.34 O ATOM 1141 CB VAL B 170 -8.540 -2.199 6.199 1.00 54.11 C ATOM 1142 CG1 VAL B 170 -9.974 -2.445 5.756 1.00 73.20 C ATOM 1143 CG2 VAL B 170 -8.301 -0.718 6.459 1.00 24.41 C ATOM 0 H VAL B 170 -6.355 -2.056 7.389 1.00 4.43 H new ATOM 0 HA VAL B 170 -8.902 -2.754 8.255 1.00 15.54 H new ATOM 0 HB VAL B 170 -7.877 -2.516 5.394 1.00 54.11 H new ATOM 0 HG11 VAL B 170 -10.187 -1.852 4.867 1.00 73.20 H new ATOM 0 HG12 VAL B 170 -10.108 -3.502 5.527 1.00 73.20 H new ATOM 0 HG13 VAL B 170 -10.656 -2.158 6.556 1.00 73.20 H new ATOM 0 HG21 VAL B 170 -8.538 -0.148 5.561 1.00 24.41 H new ATOM 0 HG22 VAL B 170 -8.938 -0.385 7.278 1.00 24.41 H new ATOM 0 HG23 VAL B 170 -7.256 -0.559 6.725 1.00 24.41 H new ATOM 1153 N PHE B 171 -7.486 -5.028 6.295 1.00 74.34 N ATOM 1154 CA PHE B 171 -7.532 -6.432 5.904 1.00 61.31 C ATOM 1155 C PHE B 171 -7.589 -7.337 7.132 1.00 11.53 C ATOM 1156 O PHE B 171 -8.476 -8.180 7.253 1.00 44.11 O ATOM 1157 CB PHE B 171 -6.312 -6.787 5.052 1.00 14.20 C ATOM 1158 CG PHE B 171 -6.510 -8.010 4.202 1.00 71.10 C ATOM 1159 CD1 PHE B 171 -7.627 -8.134 3.393 1.00 10.40 C ATOM 1160 CD2 PHE B 171 -5.577 -9.034 4.213 1.00 70.31 C ATOM 1161 CE1 PHE B 171 -7.811 -9.259 2.611 1.00 44.20 C ATOM 1162 CE2 PHE B 171 -5.756 -10.162 3.433 1.00 62.12 C ATOM 1163 CZ PHE B 171 -6.874 -10.274 2.631 1.00 55.43 C ATOM 0 H PHE B 171 -6.722 -4.498 5.875 1.00 74.34 H new ATOM 0 HA PHE B 171 -8.436 -6.589 5.315 1.00 61.31 H new ATOM 0 HB2 PHE B 171 -6.070 -5.942 4.408 1.00 14.20 H new ATOM 0 HB3 PHE B 171 -5.455 -6.944 5.707 1.00 14.20 H new ATOM 0 HD1 PHE B 171 -8.362 -7.343 3.373 1.00 10.40 H new ATOM 0 HD2 PHE B 171 -4.700 -8.951 4.838 1.00 70.31 H new ATOM 0 HE1 PHE B 171 -8.687 -9.344 1.985 1.00 44.20 H new ATOM 0 HE2 PHE B 171 -5.022 -10.954 3.451 1.00 62.12 H new ATOM 0 HZ PHE B 171 -7.016 -11.153 2.020 1.00 55.43 H new ATOM 1173 N GLY B 172 -6.634 -7.154 8.039 1.00 25.33 N ATOM 1174 CA GLY B 172 -6.593 -7.962 9.244 1.00 50.35 C ATOM 1175 C GLY B 172 -7.914 -7.962 9.987 1.00 51.41 C ATOM 1176 O GLY B 172 -8.516 -9.015 10.196 1.00 10.12 O ATOM 0 H GLY B 172 -5.889 -6.462 7.961 1.00 25.33 H new ATOM 0 HA2 GLY B 172 -6.327 -8.986 8.982 1.00 50.35 H new ATOM 0 HA3 GLY B 172 -5.809 -7.587 9.902 1.00 50.35 H new ATOM 1180 N ILE B 173 -8.365 -6.779 10.390 1.00 34.10 N ATOM 1181 CA ILE B 173 -9.624 -6.647 11.114 1.00 61.42 C ATOM 1182 C ILE B 173 -10.780 -7.242 10.319 1.00 40.22 C ATOM 1183 O ILE B 173 -11.667 -7.887 10.880 1.00 41.31 O ATOM 1184 CB ILE B 173 -9.938 -5.174 11.433 1.00 52.42 C ATOM 1185 CG1 ILE B 173 -8.814 -4.560 12.272 1.00 14.34 C ATOM 1186 CG2 ILE B 173 -11.270 -5.062 12.161 1.00 33.14 C ATOM 1187 CD1 ILE B 173 -8.663 -5.194 13.637 1.00 52.42 C ATOM 0 H ILE B 173 -7.878 -5.898 10.228 1.00 34.10 H new ATOM 0 HA ILE B 173 -9.510 -7.196 12.049 1.00 61.42 H new ATOM 0 HB ILE B 173 -10.010 -4.622 10.496 1.00 52.42 H new ATOM 0 HG12 ILE B 173 -7.873 -4.656 11.730 1.00 14.34 H new ATOM 0 HG13 ILE B 173 -9.004 -3.494 12.395 1.00 14.34 H new ATOM 0 HG21 ILE B 173 -11.478 -4.015 12.380 1.00 33.14 H new ATOM 0 HG22 ILE B 173 -12.063 -5.466 11.532 1.00 33.14 H new ATOM 0 HG23 ILE B 173 -11.224 -5.625 13.093 1.00 33.14 H new ATOM 0 HD11 ILE B 173 -7.849 -4.709 14.175 1.00 52.42 H new ATOM 0 HD12 ILE B 173 -9.590 -5.075 14.198 1.00 52.42 H new ATOM 0 HD13 ILE B 173 -8.441 -6.255 13.523 1.00 52.42 H new ATOM 1199 N LEU B 174 -10.765 -7.022 9.009 1.00 62.14 N ATOM 1200 CA LEU B 174 -11.813 -7.537 8.134 1.00 23.51 C ATOM 1201 C LEU B 174 -11.883 -9.059 8.209 1.00 10.04 C ATOM 1202 O LEU B 174 -12.911 -9.625 8.583 1.00 1.45 O ATOM 1203 CB LEU B 174 -11.562 -7.097 6.691 1.00 62.55 C ATOM 1204 CG LEU B 174 -12.035 -5.690 6.327 1.00 51.13 C ATOM 1205 CD1 LEU B 174 -11.680 -5.363 4.885 1.00 23.10 C ATOM 1206 CD2 LEU B 174 -13.534 -5.556 6.552 1.00 71.22 C ATOM 0 H LEU B 174 -10.039 -6.490 8.529 1.00 62.14 H new ATOM 0 HA LEU B 174 -12.767 -7.130 8.470 1.00 23.51 H new ATOM 0 HB2 LEU B 174 -10.492 -7.161 6.494 1.00 62.55 H new ATOM 0 HB3 LEU B 174 -12.052 -7.807 6.025 1.00 62.55 H new ATOM 0 HG LEU B 174 -11.525 -4.978 6.976 1.00 51.13 H new ATOM 0 HD11 LEU B 174 -12.025 -4.357 4.644 1.00 23.10 H new ATOM 0 HD12 LEU B 174 -10.599 -5.417 4.755 1.00 23.10 H new ATOM 0 HD13 LEU B 174 -12.161 -6.080 4.220 1.00 23.10 H new ATOM 0 HD21 LEU B 174 -13.853 -4.548 6.288 1.00 71.22 H new ATOM 0 HD22 LEU B 174 -14.061 -6.278 5.929 1.00 71.22 H new ATOM 0 HD23 LEU B 174 -13.763 -5.746 7.601 1.00 71.22 H new ATOM 1218 N ILE B 175 -10.785 -9.716 7.850 1.00 65.14 N ATOM 1219 CA ILE B 175 -10.722 -11.172 7.880 1.00 43.42 C ATOM 1220 C ILE B 175 -11.150 -11.713 9.240 1.00 21.23 C ATOM 1221 O ILE B 175 -11.773 -12.771 9.332 1.00 64.00 O ATOM 1222 CB ILE B 175 -9.304 -11.680 7.561 1.00 23.45 C ATOM 1223 CG1 ILE B 175 -8.857 -11.181 6.185 1.00 54.33 C ATOM 1224 CG2 ILE B 175 -9.262 -13.200 7.617 1.00 31.34 C ATOM 1225 CD1 ILE B 175 -7.383 -11.386 5.917 1.00 22.22 C ATOM 0 H ILE B 175 -9.927 -9.263 7.535 1.00 65.14 H new ATOM 0 HA ILE B 175 -11.409 -11.534 7.115 1.00 43.42 H new ATOM 0 HB ILE B 175 -8.616 -11.288 8.310 1.00 23.45 H new ATOM 0 HG12 ILE B 175 -9.433 -11.696 5.416 1.00 54.33 H new ATOM 0 HG13 ILE B 175 -9.089 -10.119 6.099 1.00 54.33 H new ATOM 0 HG21 ILE B 175 -8.253 -13.545 7.389 1.00 31.34 H new ATOM 0 HG22 ILE B 175 -9.543 -13.535 8.615 1.00 31.34 H new ATOM 0 HG23 ILE B 175 -9.959 -13.610 6.887 1.00 31.34 H new ATOM 0 HD11 ILE B 175 -7.138 -11.009 4.924 1.00 22.22 H new ATOM 0 HD12 ILE B 175 -6.799 -10.848 6.664 1.00 22.22 H new ATOM 0 HD13 ILE B 175 -7.148 -12.449 5.970 1.00 22.22 H new ATOM 1237 N LYS B 176 -10.812 -10.979 10.296 1.00 32.25 N ATOM 1238 CA LYS B 176 -11.163 -11.383 11.652 1.00 43.55 C ATOM 1239 C LYS B 176 -12.671 -11.310 11.869 1.00 61.14 C ATOM 1240 O LYS B 176 -13.310 -12.311 12.192 1.00 41.33 O ATOM 1241 CB LYS B 176 -10.447 -10.494 12.672 1.00 23.44 C ATOM 1242 CG LYS B 176 -9.089 -11.028 13.095 1.00 55.03 C ATOM 1243 CD LYS B 176 -8.269 -9.963 13.806 1.00 52.23 C ATOM 1244 CE LYS B 176 -7.027 -10.557 14.453 1.00 51.41 C ATOM 1245 NZ LYS B 176 -6.719 -9.909 15.759 1.00 55.51 N ATOM 0 H LYS B 176 -10.295 -10.101 10.238 1.00 32.25 H new ATOM 0 HA LYS B 176 -10.844 -12.416 11.791 1.00 43.55 H new ATOM 0 HB2 LYS B 176 -10.321 -9.498 12.248 1.00 23.44 H new ATOM 0 HB3 LYS B 176 -11.077 -10.387 13.555 1.00 23.44 H new ATOM 0 HG2 LYS B 176 -9.223 -11.886 13.754 1.00 55.03 H new ATOM 0 HG3 LYS B 176 -8.546 -11.381 12.218 1.00 55.03 H new ATOM 0 HD2 LYS B 176 -7.976 -9.192 13.094 1.00 52.23 H new ATOM 0 HD3 LYS B 176 -8.881 -9.479 14.567 1.00 52.23 H new ATOM 0 HE2 LYS B 176 -7.172 -11.627 14.603 1.00 51.41 H new ATOM 0 HE3 LYS B 176 -6.177 -10.442 13.781 1.00 51.41 H new ATOM 0 HZ1 LYS B 176 -5.866 -10.341 16.168 1.00 55.51 H new ATOM 0 HZ2 LYS B 176 -6.556 -8.892 15.612 1.00 55.51 H new ATOM 0 HZ3 LYS B 176 -7.520 -10.041 16.409 1.00 55.51 H new ATOM 1259 N ARG B 177 -13.233 -10.119 11.687 1.00 50.20 N ATOM 1260 CA ARG B 177 -14.666 -9.916 11.863 1.00 21.32 C ATOM 1261 C ARG B 177 -15.463 -10.876 10.983 1.00 40.14 C ATOM 1262 O ARG B 177 -16.607 -11.210 11.292 1.00 25.25 O ATOM 1263 CB ARG B 177 -15.042 -8.471 11.530 1.00 53.12 C ATOM 1264 CG ARG B 177 -14.475 -7.454 12.506 1.00 50.12 C ATOM 1265 CD ARG B 177 -15.298 -7.388 13.783 1.00 52.44 C ATOM 1266 NE ARG B 177 -14.462 -7.454 14.978 1.00 32.22 N ATOM 1267 CZ ARG B 177 -14.878 -7.096 16.187 1.00 64.21 C ATOM 1268 NH1 ARG B 177 -16.114 -6.648 16.362 1.00 34.45 N ATOM 1269 NH2 ARG B 177 -14.057 -7.186 17.227 1.00 34.44 N ATOM 0 H ARG B 177 -12.718 -9.281 11.418 1.00 50.20 H new ATOM 0 HA ARG B 177 -14.911 -10.117 12.906 1.00 21.32 H new ATOM 0 HB2 ARG B 177 -14.689 -8.235 10.526 1.00 53.12 H new ATOM 0 HB3 ARG B 177 -16.128 -8.381 11.515 1.00 53.12 H new ATOM 0 HG2 ARG B 177 -13.445 -7.716 12.749 1.00 50.12 H new ATOM 0 HG3 ARG B 177 -14.451 -6.471 12.036 1.00 50.12 H new ATOM 0 HD2 ARG B 177 -15.875 -6.463 13.795 1.00 52.44 H new ATOM 0 HD3 ARG B 177 -16.014 -8.210 13.796 1.00 52.44 H new ATOM 0 HE ARG B 177 -13.505 -7.794 14.879 1.00 32.22 H new ATOM 0 HH11 ARG B 177 -16.748 -6.578 15.566 1.00 34.45 H new ATOM 0 HH12 ARG B 177 -16.430 -6.374 17.292 1.00 34.45 H new ATOM 0 HH21 ARG B 177 -13.106 -7.530 17.097 1.00 34.44 H new ATOM 0 HH22 ARG B 177 -14.378 -6.911 18.155 1.00 34.44 H new ATOM 1283 N ARG B 178 -14.850 -11.314 9.888 1.00 44.01 N ATOM 1284 CA ARG B 178 -15.503 -12.233 8.964 1.00 23.33 C ATOM 1285 C ARG B 178 -15.739 -13.589 9.622 1.00 5.10 C ATOM 1286 O ARG B 178 -16.620 -14.344 9.212 1.00 51.51 O ATOM 1287 CB ARG B 178 -14.656 -12.408 7.703 1.00 15.24 C ATOM 1288 CG ARG B 178 -14.839 -11.291 6.687 1.00 71.41 C ATOM 1289 CD ARG B 178 -16.033 -11.552 5.782 1.00 61.32 C ATOM 1290 NE ARG B 178 -17.269 -11.006 6.335 1.00 65.23 N ATOM 1291 CZ ARG B 178 -17.561 -9.710 6.343 1.00 13.01 C ATOM 1292 NH1 ARG B 178 -16.711 -8.832 5.829 1.00 52.42 N ATOM 1293 NH2 ARG B 178 -18.707 -9.290 6.865 1.00 42.00 N ATOM 0 H ARG B 178 -13.903 -11.047 9.619 1.00 44.01 H new ATOM 0 HA ARG B 178 -16.469 -11.808 8.690 1.00 23.33 H new ATOM 0 HB2 ARG B 178 -13.605 -12.462 7.986 1.00 15.24 H new ATOM 0 HB3 ARG B 178 -14.909 -13.359 7.234 1.00 15.24 H new ATOM 0 HG2 ARG B 178 -14.976 -10.343 7.207 1.00 71.41 H new ATOM 0 HG3 ARG B 178 -13.937 -11.196 6.083 1.00 71.41 H new ATOM 0 HD2 ARG B 178 -15.848 -11.111 4.802 1.00 61.32 H new ATOM 0 HD3 ARG B 178 -16.146 -12.626 5.632 1.00 61.32 H new ATOM 0 HE ARG B 178 -17.945 -11.655 6.737 1.00 65.23 H new ATOM 0 HH11 ARG B 178 -15.830 -9.151 5.426 1.00 52.42 H new ATOM 0 HH12 ARG B 178 -16.938 -7.838 5.837 1.00 52.42 H new ATOM 0 HH21 ARG B 178 -19.364 -9.963 7.260 1.00 42.00 H new ATOM 0 HH22 ARG B 178 -18.930 -8.295 6.871 1.00 42.00 H new ATOM 1307 N GLN B 179 -14.946 -13.891 10.646 1.00 41.03 N ATOM 1308 CA GLN B 179 -15.069 -15.156 11.360 1.00 12.33 C ATOM 1309 C GLN B 179 -16.514 -15.408 11.776 1.00 23.03 C ATOM 1310 O GLN B 179 -17.252 -14.473 12.088 1.00 34.43 O ATOM 1311 CB GLN B 179 -14.162 -15.162 12.591 1.00 44.35 C ATOM 1312 CG GLN B 179 -14.697 -14.326 13.744 1.00 51.12 C ATOM 1313 CD GLN B 179 -13.650 -14.061 14.807 1.00 50.14 C ATOM 1314 OE1 GLN B 179 -13.811 -14.688 15.966 1.00 54.00 O flip ATOM 1315 NE2 GLN B 179 -12.706 -13.300 14.590 1.00 70.22 N flip ATOM 0 H GLN B 179 -14.212 -13.277 10.999 1.00 41.03 H new ATOM 0 HA GLN B 179 -14.760 -15.956 10.687 1.00 12.33 H new ATOM 0 HB2 GLN B 179 -14.029 -16.190 12.929 1.00 44.35 H new ATOM 0 HB3 GLN B 179 -13.177 -14.789 12.309 1.00 44.35 H new ATOM 0 HG2 GLN B 179 -15.066 -13.376 13.358 1.00 51.12 H new ATOM 0 HG3 GLN B 179 -15.546 -14.838 14.196 1.00 51.12 H new ATOM 0 HE21 GLN B 179 -12.621 -12.839 13.684 1.00 70.22 H new ATOM 0 HE22 GLN B 179 -12.010 -13.131 15.316 1.00 70.22 H new ATOM 1324 N GLN B 180 -16.911 -16.677 11.780 1.00 55.14 N ATOM 1325 CA GLN B 180 -18.270 -17.051 12.157 1.00 64.44 C ATOM 1326 C GLN B 180 -19.286 -16.462 11.185 1.00 21.04 C ATOM 1327 O GLN B 180 -20.309 -15.913 11.596 1.00 74.40 O ATOM 1328 CB GLN B 180 -18.574 -16.578 13.581 1.00 75.51 C ATOM 1329 CG GLN B 180 -19.599 -17.439 14.300 1.00 44.34 C ATOM 1330 CD GLN B 180 -18.967 -18.387 15.300 1.00 41.43 C ATOM 1331 OE1 GLN B 180 -18.353 -19.386 14.923 1.00 11.54 O ATOM 1332 NE2 GLN B 180 -19.114 -18.079 16.584 1.00 32.54 N ATOM 0 H GLN B 180 -16.312 -17.463 11.527 1.00 55.14 H new ATOM 0 HA GLN B 180 -18.346 -18.138 12.118 1.00 64.44 H new ATOM 0 HB2 GLN B 180 -17.649 -16.570 14.158 1.00 75.51 H new ATOM 0 HB3 GLN B 180 -18.936 -15.550 13.545 1.00 75.51 H new ATOM 0 HG2 GLN B 180 -20.311 -16.795 14.816 1.00 44.34 H new ATOM 0 HG3 GLN B 180 -20.163 -18.014 13.566 1.00 44.34 H new ATOM 0 HE21 GLN B 180 -19.631 -17.241 16.852 1.00 32.54 H new ATOM 0 HE22 GLN B 180 -18.710 -18.680 17.302 1.00 32.54 H new ATOM 1341 N LYS B 181 -18.999 -16.581 9.894 1.00 32.42 N ATOM 1342 CA LYS B 181 -19.888 -16.062 8.860 1.00 5.23 C ATOM 1343 C LYS B 181 -21.195 -16.849 8.822 1.00 32.43 C ATOM 1344 O LYS B 181 -21.294 -17.934 9.397 1.00 61.24 O ATOM 1345 CB LYS B 181 -19.205 -16.121 7.493 1.00 63.45 C ATOM 1346 CG LYS B 181 -18.743 -14.766 6.985 1.00 0.31 C ATOM 1347 CD LYS B 181 -19.765 -14.145 6.047 1.00 45.52 C ATOM 1348 CE LYS B 181 -19.329 -14.254 4.595 1.00 71.22 C ATOM 1349 NZ LYS B 181 -19.264 -15.670 4.141 1.00 32.12 N ATOM 0 H LYS B 181 -18.157 -17.033 9.537 1.00 32.42 H new ATOM 0 HA LYS B 181 -20.116 -15.023 9.100 1.00 5.23 H new ATOM 0 HB2 LYS B 181 -18.346 -16.789 7.554 1.00 63.45 H new ATOM 0 HB3 LYS B 181 -19.895 -16.555 6.770 1.00 63.45 H new ATOM 0 HG2 LYS B 181 -18.570 -14.099 7.830 1.00 0.31 H new ATOM 0 HG3 LYS B 181 -17.791 -14.876 6.466 1.00 0.31 H new ATOM 0 HD2 LYS B 181 -20.727 -14.640 6.177 1.00 45.52 H new ATOM 0 HD3 LYS B 181 -19.909 -13.096 6.307 1.00 45.52 H new ATOM 0 HE2 LYS B 181 -20.026 -13.702 3.964 1.00 71.22 H new ATOM 0 HE3 LYS B 181 -18.351 -13.788 4.473 1.00 71.22 H new ATOM 0 HZ1 LYS B 181 -19.012 -15.700 3.132 1.00 32.12 H new ATOM 0 HZ2 LYS B 181 -18.544 -16.179 4.693 1.00 32.12 H new ATOM 0 HZ3 LYS B 181 -20.190 -16.122 4.280 1.00 32.12 H new ATOM 1363 N ILE B 182 -22.192 -16.298 8.140 1.00 10.13 N ATOM 1364 CA ILE B 182 -23.490 -16.951 8.024 1.00 75.10 C ATOM 1365 C ILE B 182 -23.563 -17.811 6.767 1.00 53.15 C ATOM 1366 O ILE B 182 -24.448 -17.632 5.930 1.00 53.13 O ATOM 1367 CB ILE B 182 -24.636 -15.922 7.995 1.00 44.51 C ATOM 1368 CG1 ILE B 182 -24.437 -14.873 9.091 1.00 73.41 C ATOM 1369 CG2 ILE B 182 -25.978 -16.620 8.162 1.00 23.21 C ATOM 1370 CD1 ILE B 182 -24.446 -15.448 10.490 1.00 31.44 C ATOM 0 H ILE B 182 -22.126 -15.401 7.659 1.00 10.13 H new ATOM 0 HA ILE B 182 -23.604 -17.586 8.903 1.00 75.10 H new ATOM 0 HB ILE B 182 -24.627 -15.418 7.029 1.00 44.51 H new ATOM 0 HG12 ILE B 182 -23.489 -14.361 8.924 1.00 73.41 H new ATOM 0 HG13 ILE B 182 -25.223 -14.123 9.011 1.00 73.41 H new ATOM 0 HG21 ILE B 182 -26.778 -15.880 8.140 1.00 23.21 H new ATOM 0 HG22 ILE B 182 -26.121 -17.333 7.350 1.00 23.21 H new ATOM 0 HG23 ILE B 182 -25.998 -17.147 9.116 1.00 23.21 H new ATOM 0 HD11 ILE B 182 -24.300 -14.646 11.214 1.00 31.44 H new ATOM 0 HD12 ILE B 182 -25.403 -15.935 10.677 1.00 31.44 H new ATOM 0 HD13 ILE B 182 -23.642 -16.177 10.589 1.00 31.44 H new ATOM 1382 N ARG B 183 -22.628 -18.747 6.642 1.00 71.13 N ATOM 1383 CA ARG B 183 -22.587 -19.636 5.487 1.00 64.05 C ATOM 1384 C ARG B 183 -22.939 -21.065 5.890 1.00 35.44 C ATOM 1385 O ARG B 183 -22.144 -21.987 5.704 1.00 13.24 O ATOM 1386 CB ARG B 183 -21.200 -19.603 4.842 1.00 12.43 C ATOM 1387 CG ARG B 183 -20.061 -19.758 5.836 1.00 71.45 C ATOM 1388 CD ARG B 183 -18.935 -20.606 5.265 1.00 71.31 C ATOM 1389 NE ARG B 183 -18.074 -21.148 6.312 1.00 61.31 N ATOM 1390 CZ ARG B 183 -17.064 -21.979 6.077 1.00 73.32 C ATOM 1391 NH1 ARG B 183 -16.790 -22.359 4.837 1.00 73.24 N ATOM 1392 NH2 ARG B 183 -16.325 -22.429 7.082 1.00 3.01 N ATOM 0 H ARG B 183 -21.889 -18.909 7.326 1.00 71.13 H new ATOM 0 HA ARG B 183 -23.325 -19.288 4.764 1.00 64.05 H new ATOM 0 HB2 ARG B 183 -21.135 -20.399 4.101 1.00 12.43 H new ATOM 0 HB3 ARG B 183 -21.079 -18.660 4.308 1.00 12.43 H new ATOM 0 HG2 ARG B 183 -19.676 -18.775 6.106 1.00 71.45 H new ATOM 0 HG3 ARG B 183 -20.435 -20.217 6.751 1.00 71.45 H new ATOM 0 HD2 ARG B 183 -19.357 -21.425 4.683 1.00 71.31 H new ATOM 0 HD3 ARG B 183 -18.338 -20.003 4.581 1.00 71.31 H new ATOM 0 HE ARG B 183 -18.258 -20.874 7.277 1.00 61.31 H new ATOM 0 HH11 ARG B 183 -17.355 -22.013 4.061 1.00 73.24 H new ATOM 0 HH12 ARG B 183 -16.014 -22.997 4.659 1.00 73.24 H new ATOM 0 HH21 ARG B 183 -16.531 -22.137 8.037 1.00 3.01 H new ATOM 0 HH22 ARG B 183 -15.550 -23.067 6.900 1.00 3.01 H new ATOM 1406 N LYS B 184 -24.135 -21.242 6.441 1.00 73.21 N ATOM 1407 CA LYS B 184 -24.593 -22.558 6.868 1.00 0.40 C ATOM 1408 C LYS B 184 -25.851 -22.968 6.109 1.00 25.14 C ATOM 1409 O LYS B 184 -26.797 -22.190 5.990 1.00 14.25 O ATOM 1410 CB LYS B 184 -24.870 -22.560 8.374 1.00 15.40 C ATOM 1411 CG LYS B 184 -23.687 -23.018 9.209 1.00 0.52 C ATOM 1412 CD LYS B 184 -23.885 -24.434 9.725 1.00 34.31 C ATOM 1413 CE LYS B 184 -22.842 -24.796 10.771 1.00 42.43 C ATOM 1414 NZ LYS B 184 -22.159 -26.081 10.453 1.00 1.41 N ATOM 0 H LYS B 184 -24.805 -20.490 6.602 1.00 73.21 H new ATOM 0 HA LYS B 184 -23.806 -23.279 6.648 1.00 0.40 H new ATOM 0 HB2 LYS B 184 -25.155 -21.555 8.684 1.00 15.40 H new ATOM 0 HB3 LYS B 184 -25.721 -23.210 8.578 1.00 15.40 H new ATOM 0 HG2 LYS B 184 -22.778 -22.972 8.610 1.00 0.52 H new ATOM 0 HG3 LYS B 184 -23.549 -22.339 10.050 1.00 0.52 H new ATOM 0 HD2 LYS B 184 -24.882 -24.530 10.155 1.00 34.31 H new ATOM 0 HD3 LYS B 184 -23.828 -25.137 8.894 1.00 34.31 H new ATOM 0 HE2 LYS B 184 -22.102 -23.998 10.837 1.00 42.43 H new ATOM 0 HE3 LYS B 184 -23.319 -24.870 11.748 1.00 42.43 H new ATOM 0 HZ1 LYS B 184 -21.456 -26.292 11.190 1.00 1.41 H new ATOM 0 HZ2 LYS B 184 -22.861 -26.847 10.415 1.00 1.41 H new ATOM 0 HZ3 LYS B 184 -21.682 -26.002 9.532 1.00 1.41 H new TER 1428 LYS B 184