USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1071 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 109 THR OG1 : rot 160:sc= -0.225 USER MOD Set 1.2: A 111 ASN : amide:sc= -0.206 K(o=-0.43,f=-4.4!) USER MOD Single : A 3 THR OG1 : rot -160:sc= 0 USER MOD Single : A 9 SER OG : rot -109:sc= 0.283 USER MOD Single : A 24 LYS NZ :NH3+ -141:sc= 0.48 (180deg=-0.406) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.161 K(o=-0.16,f=-2.4!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 170:sc= 0.0784 USER MOD Single : A 37 LYS NZ :NH3+ -170:sc= -1.02 (180deg=-1.42) USER MOD Single : A 39 LYS NZ :NH3+ -144:sc= 0.471 (180deg=0.0116) USER MOD Single : A 41 LYS NZ :NH3+ -153:sc= 0.829 (180deg=0.178) USER MOD Single : A 46 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0636) USER MOD Single : A 49 LYS NZ :NH3+ -171:sc=-0.00991 (180deg=-0.0868) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 THR OG1 : rot -170:sc= -0.437 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= -0.21 K(o=-0.21,f=-4.1!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl -146:sc= -0.276 (180deg=-1.2) USER MOD Single : A 87 GLN : amide:sc= -0.0838 X(o=-0.084,f=-0.069) USER MOD Single : A 89 GLN : amide:sc=-0.00102 X(o=-0.001,f=-0.4) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.103 X(o=-0.1,f=-0.098) USER MOD Single : A 100 LYS NZ :NH3+ -168:sc= -0.0225 (180deg=-0.216) USER MOD Single : A 101 LYS NZ :NH3+ -133:sc= 1.11 (180deg=0.055) USER MOD Single : A 116 LYS NZ :NH3+ -164:sc= 1.35 (180deg=1.14) USER MOD Single : A 117 LYS NZ :NH3+ -101:sc= 0.0689 (180deg=-0.863) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 1.902 13.713 -0.471 1.00 31.11 N ATOM 21 CA GLY A 2 2.831 12.766 0.119 1.00 51.24 C ATOM 22 C GLY A 2 2.051 11.625 0.731 1.00 63.21 C ATOM 23 O GLY A 2 1.882 11.552 1.949 1.00 62.22 O ATOM 0 HA2 GLY A 2 3.516 12.389 -0.640 1.00 51.24 H new ATOM 0 HA3 GLY A 2 3.437 13.258 0.880 1.00 51.24 H new ATOM 27 N THR A 3 1.515 10.768 -0.139 1.00 63.43 N ATOM 28 CA THR A 3 0.642 9.654 0.246 1.00 71.41 C ATOM 29 C THR A 3 1.296 8.333 -0.180 1.00 31.25 C ATOM 30 O THR A 3 1.540 8.133 -1.365 1.00 52.25 O ATOM 31 CB THR A 3 -0.745 9.805 -0.457 1.00 32.15 C ATOM 32 OG1 THR A 3 -1.274 11.125 -0.234 1.00 13.11 O ATOM 33 CG2 THR A 3 -1.760 8.764 0.031 1.00 44.30 C ATOM 0 H THR A 3 1.676 10.827 -1.144 1.00 63.43 H new ATOM 0 HA THR A 3 0.496 9.659 1.326 1.00 71.41 H new ATOM 0 HB THR A 3 -0.582 9.642 -1.522 1.00 32.15 H new ATOM 0 HG1 THR A 3 -2.242 11.120 -0.389 1.00 13.11 H new ATOM 0 HG21 THR A 3 -2.708 8.910 -0.487 1.00 44.30 H new ATOM 0 HG22 THR A 3 -1.383 7.763 -0.177 1.00 44.30 H new ATOM 0 HG23 THR A 3 -1.911 8.879 1.104 1.00 44.30 H new ATOM 41 N VAL A 4 1.602 7.452 0.782 1.00 51.11 N ATOM 42 CA VAL A 4 2.198 6.132 0.499 1.00 53.11 C ATOM 43 C VAL A 4 1.206 5.020 0.900 1.00 24.12 C ATOM 44 O VAL A 4 0.959 4.783 2.087 1.00 23.12 O ATOM 45 CB VAL A 4 3.572 5.947 1.248 1.00 42.32 C ATOM 46 CG1 VAL A 4 4.240 4.602 0.871 1.00 24.35 C ATOM 47 CG2 VAL A 4 4.524 7.135 0.959 1.00 52.44 C ATOM 0 H VAL A 4 1.446 7.629 1.774 1.00 51.11 H new ATOM 0 HA VAL A 4 2.400 6.067 -0.570 1.00 53.11 H new ATOM 0 HB VAL A 4 3.366 5.929 2.318 1.00 42.32 H new ATOM 0 HG11 VAL A 4 5.186 4.504 1.404 1.00 24.35 H new ATOM 0 HG12 VAL A 4 3.581 3.779 1.147 1.00 24.35 H new ATOM 0 HG13 VAL A 4 4.424 4.576 -0.203 1.00 24.35 H new ATOM 0 HG21 VAL A 4 5.465 6.984 1.487 1.00 52.44 H new ATOM 0 HG22 VAL A 4 4.715 7.196 -0.112 1.00 52.44 H new ATOM 0 HG23 VAL A 4 4.062 8.062 1.299 1.00 52.44 H new ATOM 57 N VAL A 5 0.609 4.369 -0.107 1.00 11.54 N ATOM 58 CA VAL A 5 -0.308 3.238 0.097 1.00 71.14 C ATOM 59 C VAL A 5 0.500 1.928 0.023 1.00 62.30 C ATOM 60 O VAL A 5 1.058 1.607 -1.020 1.00 44.11 O ATOM 61 CB VAL A 5 -1.471 3.234 -0.966 1.00 73.23 C ATOM 62 CG1 VAL A 5 -2.457 2.053 -0.750 1.00 35.15 C ATOM 63 CG2 VAL A 5 -2.222 4.588 -0.967 1.00 31.11 C ATOM 0 H VAL A 5 0.748 4.612 -1.088 1.00 11.54 H new ATOM 0 HA VAL A 5 -0.775 3.333 1.077 1.00 71.14 H new ATOM 0 HB VAL A 5 -1.012 3.093 -1.944 1.00 73.23 H new ATOM 0 HG11 VAL A 5 -3.242 2.091 -1.506 1.00 35.15 H new ATOM 0 HG12 VAL A 5 -1.918 1.109 -0.834 1.00 35.15 H new ATOM 0 HG13 VAL A 5 -2.904 2.129 0.241 1.00 35.15 H new ATOM 0 HG21 VAL A 5 -3.020 4.561 -1.709 1.00 31.11 H new ATOM 0 HG22 VAL A 5 -2.649 4.768 0.019 1.00 31.11 H new ATOM 0 HG23 VAL A 5 -1.526 5.390 -1.212 1.00 31.11 H new ATOM 73 N ILE A 6 0.584 1.191 1.143 1.00 14.14 N ATOM 74 CA ILE A 6 1.350 -0.065 1.225 1.00 73.33 C ATOM 75 C ILE A 6 0.400 -1.255 1.041 1.00 61.12 C ATOM 76 O ILE A 6 -0.418 -1.548 1.910 1.00 50.15 O ATOM 77 CB ILE A 6 2.120 -0.178 2.597 1.00 40.31 C ATOM 78 CG1 ILE A 6 3.144 0.990 2.744 1.00 43.01 C ATOM 79 CG2 ILE A 6 2.823 -1.553 2.764 1.00 1.21 C ATOM 80 CD1 ILE A 6 4.199 1.041 1.653 1.00 43.11 C ATOM 0 H ILE A 6 0.124 1.448 2.016 1.00 14.14 H new ATOM 0 HA ILE A 6 2.096 -0.071 0.430 1.00 73.33 H new ATOM 0 HB ILE A 6 1.380 -0.101 3.394 1.00 40.31 H new ATOM 0 HG12 ILE A 6 2.600 1.935 2.751 1.00 43.01 H new ATOM 0 HG13 ILE A 6 3.642 0.901 3.710 1.00 43.01 H new ATOM 0 HG21 ILE A 6 3.340 -1.583 3.723 1.00 1.21 H new ATOM 0 HG22 ILE A 6 2.079 -2.349 2.727 1.00 1.21 H new ATOM 0 HG23 ILE A 6 3.544 -1.693 1.959 1.00 1.21 H new ATOM 0 HD11 ILE A 6 4.868 1.882 1.833 1.00 43.11 H new ATOM 0 HD12 ILE A 6 4.772 0.114 1.658 1.00 43.11 H new ATOM 0 HD13 ILE A 6 3.715 1.163 0.684 1.00 43.11 H new ATOM 92 N VAL A 7 0.499 -1.917 -0.113 1.00 44.53 N ATOM 93 CA VAL A 7 -0.306 -3.101 -0.426 1.00 14.52 C ATOM 94 C VAL A 7 0.562 -4.362 -0.269 1.00 70.54 C ATOM 95 O VAL A 7 1.683 -4.433 -0.787 1.00 2.12 O ATOM 96 CB VAL A 7 -0.919 -3.019 -1.862 1.00 41.14 C ATOM 97 CG1 VAL A 7 -1.761 -4.270 -2.184 1.00 54.22 C ATOM 98 CG2 VAL A 7 -1.759 -1.726 -2.035 1.00 25.55 C ATOM 0 H VAL A 7 1.141 -1.647 -0.859 1.00 44.53 H new ATOM 0 HA VAL A 7 -1.142 -3.148 0.272 1.00 14.52 H new ATOM 0 HB VAL A 7 -0.093 -2.983 -2.572 1.00 41.14 H new ATOM 0 HG11 VAL A 7 -2.173 -4.182 -3.189 1.00 54.22 H new ATOM 0 HG12 VAL A 7 -1.131 -5.157 -2.126 1.00 54.22 H new ATOM 0 HG13 VAL A 7 -2.575 -4.356 -1.464 1.00 54.22 H new ATOM 0 HG21 VAL A 7 -2.174 -1.694 -3.042 1.00 25.55 H new ATOM 0 HG22 VAL A 7 -2.571 -1.720 -1.308 1.00 25.55 H new ATOM 0 HG23 VAL A 7 -1.123 -0.855 -1.877 1.00 25.55 H new ATOM 108 N VAL A 8 0.022 -5.341 0.469 1.00 24.11 N ATOM 109 CA VAL A 8 0.719 -6.569 0.867 1.00 53.34 C ATOM 110 C VAL A 8 -0.046 -7.793 0.339 1.00 1.41 C ATOM 111 O VAL A 8 -1.170 -8.052 0.774 1.00 44.21 O ATOM 112 CB VAL A 8 0.809 -6.640 2.439 1.00 44.33 C ATOM 113 CG1 VAL A 8 1.420 -7.978 2.940 1.00 13.23 C ATOM 114 CG2 VAL A 8 1.572 -5.415 3.001 1.00 43.24 C ATOM 0 H VAL A 8 -0.937 -5.299 0.814 1.00 24.11 H new ATOM 0 HA VAL A 8 1.725 -6.564 0.447 1.00 53.34 H new ATOM 0 HB VAL A 8 -0.211 -6.609 2.823 1.00 44.33 H new ATOM 0 HG11 VAL A 8 1.459 -7.975 4.029 1.00 13.23 H new ATOM 0 HG12 VAL A 8 0.802 -8.810 2.602 1.00 13.23 H new ATOM 0 HG13 VAL A 8 2.428 -8.090 2.541 1.00 13.23 H new ATOM 0 HG21 VAL A 8 1.622 -5.485 4.088 1.00 43.24 H new ATOM 0 HG22 VAL A 8 2.582 -5.396 2.592 1.00 43.24 H new ATOM 0 HG23 VAL A 8 1.050 -4.501 2.720 1.00 43.24 H new ATOM 124 N SER A 9 0.544 -8.514 -0.623 1.00 22.25 N ATOM 125 CA SER A 9 0.045 -9.830 -1.053 1.00 24.13 C ATOM 126 C SER A 9 1.229 -10.720 -1.423 1.00 53.41 C ATOM 127 O SER A 9 2.157 -10.272 -2.110 1.00 35.10 O ATOM 128 CB SER A 9 -0.932 -9.712 -2.245 1.00 4.54 C ATOM 129 OG SER A 9 -1.524 -10.966 -2.551 1.00 53.10 O ATOM 0 H SER A 9 1.377 -8.205 -1.124 1.00 22.25 H new ATOM 0 HA SER A 9 -0.508 -10.275 -0.226 1.00 24.13 H new ATOM 0 HB2 SER A 9 -1.711 -8.987 -2.009 1.00 4.54 H new ATOM 0 HB3 SER A 9 -0.400 -9.335 -3.119 1.00 4.54 H new ATOM 0 HG SER A 9 -1.162 -11.300 -3.398 1.00 53.10 H new ATOM 135 N ARG A 10 1.196 -11.976 -0.944 1.00 55.33 N ATOM 136 CA ARG A 10 2.185 -13.007 -1.300 1.00 0.01 C ATOM 137 C ARG A 10 2.094 -13.332 -2.790 1.00 4.42 C ATOM 138 O ARG A 10 3.116 -13.522 -3.464 1.00 11.44 O ATOM 139 CB ARG A 10 1.947 -14.268 -0.439 1.00 51.53 C ATOM 140 CG ARG A 10 2.733 -15.540 -0.837 1.00 43.13 C ATOM 141 CD ARG A 10 2.512 -16.702 0.159 1.00 41.34 C ATOM 142 NE ARG A 10 3.111 -16.416 1.481 1.00 43.33 N ATOM 143 CZ ARG A 10 2.472 -15.904 2.551 1.00 12.10 C ATOM 144 NH1 ARG A 10 1.167 -15.617 2.518 1.00 44.02 N ATOM 145 NH2 ARG A 10 3.154 -15.663 3.650 1.00 62.03 N ATOM 0 H ARG A 10 0.480 -12.305 -0.297 1.00 55.33 H new ATOM 0 HA ARG A 10 3.190 -12.634 -1.100 1.00 0.01 H new ATOM 0 HB2 ARG A 10 2.193 -14.026 0.595 1.00 51.53 H new ATOM 0 HB3 ARG A 10 0.883 -14.503 -0.467 1.00 51.53 H new ATOM 0 HG2 ARG A 10 2.427 -15.856 -1.834 1.00 43.13 H new ATOM 0 HG3 ARG A 10 3.796 -15.306 -0.889 1.00 43.13 H new ATOM 0 HD2 ARG A 10 1.443 -16.882 0.276 1.00 41.34 H new ATOM 0 HD3 ARG A 10 2.947 -17.616 -0.247 1.00 41.34 H new ATOM 0 HE ARG A 10 4.103 -16.627 1.593 1.00 43.33 H new ATOM 0 HH11 ARG A 10 0.629 -15.785 1.668 1.00 44.02 H new ATOM 0 HH12 ARG A 10 0.709 -15.230 3.343 1.00 44.02 H new ATOM 0 HH21 ARG A 10 4.153 -15.864 3.684 1.00 62.03 H new ATOM 0 HH22 ARG A 10 2.683 -15.275 4.468 1.00 62.03 H new ATOM 159 N ASP A 11 0.853 -13.390 -3.290 1.00 55.44 N ATOM 160 CA ASP A 11 0.579 -13.591 -4.708 1.00 41.52 C ATOM 161 C ASP A 11 0.700 -12.247 -5.460 1.00 15.12 C ATOM 162 O ASP A 11 -0.016 -11.282 -5.168 1.00 54.52 O ATOM 163 CB ASP A 11 -0.819 -14.224 -4.912 1.00 52.55 C ATOM 164 CG ASP A 11 -1.176 -14.398 -6.400 1.00 31.44 C ATOM 165 OD1 ASP A 11 -0.450 -15.118 -7.122 1.00 51.42 O ATOM 166 OD2 ASP A 11 -2.162 -13.805 -6.858 1.00 52.04 O ATOM 0 H ASP A 11 0.014 -13.298 -2.717 1.00 55.44 H new ATOM 0 HA ASP A 11 1.315 -14.283 -5.117 1.00 41.52 H new ATOM 0 HB2 ASP A 11 -0.850 -15.195 -4.418 1.00 52.55 H new ATOM 0 HB3 ASP A 11 -1.571 -13.598 -4.432 1.00 52.55 H new ATOM 171 N GLU A 12 1.616 -12.215 -6.437 1.00 63.53 N ATOM 172 CA GLU A 12 1.942 -11.007 -7.211 1.00 13.20 C ATOM 173 C GLU A 12 0.825 -10.660 -8.222 1.00 10.53 C ATOM 174 O GLU A 12 0.749 -9.529 -8.727 1.00 31.23 O ATOM 175 CB GLU A 12 3.303 -11.214 -7.920 1.00 44.03 C ATOM 176 CG GLU A 12 3.928 -9.937 -8.511 1.00 73.11 C ATOM 177 CD GLU A 12 5.301 -10.178 -9.150 1.00 4.55 C ATOM 178 OE1 GLU A 12 5.355 -10.773 -10.246 1.00 12.31 O ATOM 179 OE2 GLU A 12 6.332 -9.793 -8.556 1.00 35.20 O ATOM 0 H GLU A 12 2.157 -13.033 -6.716 1.00 63.53 H new ATOM 0 HA GLU A 12 2.018 -10.159 -6.531 1.00 13.20 H new ATOM 0 HB2 GLU A 12 4.005 -11.648 -7.208 1.00 44.03 H new ATOM 0 HB3 GLU A 12 3.172 -11.941 -8.721 1.00 44.03 H new ATOM 0 HG2 GLU A 12 3.253 -9.523 -9.260 1.00 73.11 H new ATOM 0 HG3 GLU A 12 4.027 -9.190 -7.723 1.00 73.11 H new ATOM 186 N ARG A 13 -0.044 -11.648 -8.505 1.00 55.42 N ATOM 187 CA ARG A 13 -1.157 -11.492 -9.454 1.00 1.12 C ATOM 188 C ARG A 13 -2.301 -10.689 -8.820 1.00 62.44 C ATOM 189 O ARG A 13 -2.975 -9.929 -9.508 1.00 61.52 O ATOM 190 CB ARG A 13 -1.669 -12.869 -9.926 1.00 4.10 C ATOM 191 CG ARG A 13 -0.587 -13.776 -10.531 1.00 41.21 C ATOM 192 CD ARG A 13 -1.144 -15.137 -10.962 1.00 41.31 C ATOM 193 NE ARG A 13 -0.103 -15.999 -11.537 1.00 72.44 N ATOM 194 CZ ARG A 13 0.129 -16.183 -12.845 1.00 64.41 C ATOM 195 NH1 ARG A 13 -0.597 -15.552 -13.773 1.00 60.32 N ATOM 196 NH2 ARG A 13 1.098 -16.999 -13.224 1.00 50.52 N ATOM 0 H ARG A 13 0.007 -12.575 -8.082 1.00 55.42 H new ATOM 0 HA ARG A 13 -0.788 -10.944 -10.321 1.00 1.12 H new ATOM 0 HB2 ARG A 13 -2.125 -13.383 -9.080 1.00 4.10 H new ATOM 0 HB3 ARG A 13 -2.454 -12.717 -10.667 1.00 4.10 H new ATOM 0 HG2 ARG A 13 -0.140 -13.280 -11.392 1.00 41.21 H new ATOM 0 HG3 ARG A 13 0.208 -13.926 -9.801 1.00 41.21 H new ATOM 0 HD2 ARG A 13 -1.593 -15.634 -10.102 1.00 41.31 H new ATOM 0 HD3 ARG A 13 -1.938 -14.989 -11.694 1.00 41.31 H new ATOM 0 HE ARG A 13 0.497 -16.502 -10.883 1.00 72.44 H new ATOM 0 HH11 ARG A 13 -1.344 -14.917 -13.491 1.00 60.32 H new ATOM 0 HH12 ARG A 13 -0.404 -15.706 -14.763 1.00 60.32 H new ATOM 0 HH21 ARG A 13 1.661 -17.482 -12.524 1.00 50.52 H new ATOM 0 HH22 ARG A 13 1.282 -17.146 -14.216 1.00 50.52 H new ATOM 210 N ILE A 14 -2.534 -10.879 -7.504 1.00 14.43 N ATOM 211 CA ILE A 14 -3.484 -10.040 -6.743 1.00 21.54 C ATOM 212 C ILE A 14 -3.010 -8.576 -6.784 1.00 54.20 C ATOM 213 O ILE A 14 -3.811 -7.665 -6.998 1.00 11.31 O ATOM 214 CB ILE A 14 -3.657 -10.532 -5.251 1.00 34.33 C ATOM 215 CG1 ILE A 14 -4.359 -11.928 -5.204 1.00 33.21 C ATOM 216 CG2 ILE A 14 -4.431 -9.501 -4.389 1.00 72.31 C ATOM 217 CD1 ILE A 14 -4.518 -12.526 -3.808 1.00 52.14 C ATOM 0 H ILE A 14 -2.079 -11.603 -6.948 1.00 14.43 H new ATOM 0 HA ILE A 14 -4.464 -10.124 -7.212 1.00 21.54 H new ATOM 0 HB ILE A 14 -2.659 -10.631 -4.825 1.00 34.33 H new ATOM 0 HG12 ILE A 14 -5.346 -11.837 -5.658 1.00 33.21 H new ATOM 0 HG13 ILE A 14 -3.789 -12.625 -5.818 1.00 33.21 H new ATOM 0 HG21 ILE A 14 -4.528 -9.878 -3.371 1.00 72.31 H new ATOM 0 HG22 ILE A 14 -3.887 -8.556 -4.376 1.00 72.31 H new ATOM 0 HG23 ILE A 14 -5.422 -9.343 -4.813 1.00 72.31 H new ATOM 0 HD11 ILE A 14 -5.015 -13.493 -3.881 1.00 52.14 H new ATOM 0 HD12 ILE A 14 -3.536 -12.656 -3.354 1.00 52.14 H new ATOM 0 HD13 ILE A 14 -5.117 -11.856 -3.191 1.00 52.14 H new ATOM 229 N LEU A 15 -1.687 -8.381 -6.631 1.00 21.43 N ATOM 230 CA LEU A 15 -1.048 -7.054 -6.676 1.00 43.13 C ATOM 231 C LEU A 15 -1.329 -6.315 -8.005 1.00 72.24 C ATOM 232 O LEU A 15 -1.541 -5.099 -7.998 1.00 31.11 O ATOM 233 CB LEU A 15 0.479 -7.184 -6.462 1.00 55.34 C ATOM 234 CG LEU A 15 0.952 -7.750 -5.089 1.00 2.21 C ATOM 235 CD1 LEU A 15 2.481 -7.917 -5.071 1.00 1.13 C ATOM 236 CD2 LEU A 15 0.475 -6.862 -3.915 1.00 42.42 C ATOM 0 H LEU A 15 -1.029 -9.144 -6.472 1.00 21.43 H new ATOM 0 HA LEU A 15 -1.482 -6.462 -5.870 1.00 43.13 H new ATOM 0 HB2 LEU A 15 0.879 -7.824 -7.249 1.00 55.34 H new ATOM 0 HB3 LEU A 15 0.925 -6.199 -6.595 1.00 55.34 H new ATOM 0 HG LEU A 15 0.499 -8.733 -4.958 1.00 2.21 H new ATOM 0 HD11 LEU A 15 2.792 -8.313 -4.104 1.00 1.13 H new ATOM 0 HD12 LEU A 15 2.781 -8.607 -5.860 1.00 1.13 H new ATOM 0 HD13 LEU A 15 2.955 -6.949 -5.236 1.00 1.13 H new ATOM 0 HD21 LEU A 15 0.823 -7.286 -2.973 1.00 42.42 H new ATOM 0 HD22 LEU A 15 0.880 -5.857 -4.031 1.00 42.42 H new ATOM 0 HD23 LEU A 15 -0.614 -6.816 -3.912 1.00 42.42 H new ATOM 248 N GLU A 16 -1.335 -7.052 -9.147 1.00 44.31 N ATOM 249 CA GLU A 16 -1.588 -6.438 -10.472 1.00 44.50 C ATOM 250 C GLU A 16 -3.100 -6.219 -10.705 1.00 5.21 C ATOM 251 O GLU A 16 -3.489 -5.328 -11.469 1.00 32.43 O ATOM 252 CB GLU A 16 -0.942 -7.251 -11.627 1.00 21.10 C ATOM 253 CG GLU A 16 -1.577 -8.623 -11.908 1.00 72.25 C ATOM 254 CD GLU A 16 -0.814 -9.451 -12.956 1.00 54.44 C ATOM 255 OE1 GLU A 16 0.085 -10.229 -12.580 1.00 33.43 O ATOM 256 OE2 GLU A 16 -1.103 -9.327 -14.161 1.00 44.42 O ATOM 0 H GLU A 16 -1.170 -8.058 -9.175 1.00 44.31 H new ATOM 0 HA GLU A 16 -1.107 -5.460 -10.471 1.00 44.50 H new ATOM 0 HB2 GLU A 16 -0.990 -6.655 -12.538 1.00 21.10 H new ATOM 0 HB3 GLU A 16 0.113 -7.399 -11.398 1.00 21.10 H new ATOM 0 HG2 GLU A 16 -1.628 -9.188 -10.977 1.00 72.25 H new ATOM 0 HG3 GLU A 16 -2.602 -8.477 -12.249 1.00 72.25 H new ATOM 263 N GLU A 17 -3.950 -7.023 -10.036 1.00 63.32 N ATOM 264 CA GLU A 17 -5.415 -6.814 -10.036 1.00 41.21 C ATOM 265 C GLU A 17 -5.770 -5.522 -9.277 1.00 21.55 C ATOM 266 O GLU A 17 -6.681 -4.790 -9.654 1.00 30.42 O ATOM 267 CB GLU A 17 -6.144 -8.025 -9.398 1.00 3.43 C ATOM 268 CG GLU A 17 -5.989 -9.344 -10.170 1.00 71.44 C ATOM 269 CD GLU A 17 -6.504 -9.265 -11.612 1.00 10.12 C ATOM 270 OE1 GLU A 17 -5.681 -9.244 -12.554 1.00 75.31 O ATOM 271 OE2 GLU A 17 -7.737 -9.197 -11.814 1.00 55.24 O ATOM 0 H GLU A 17 -3.647 -7.827 -9.486 1.00 63.32 H new ATOM 0 HA GLU A 17 -5.746 -6.719 -11.070 1.00 41.21 H new ATOM 0 HB2 GLU A 17 -5.768 -8.166 -8.385 1.00 3.43 H new ATOM 0 HB3 GLU A 17 -7.205 -7.791 -9.314 1.00 3.43 H new ATOM 0 HG2 GLU A 17 -4.937 -9.629 -10.182 1.00 71.44 H new ATOM 0 HG3 GLU A 17 -6.526 -10.132 -9.642 1.00 71.44 H new ATOM 278 N LEU A 18 -5.025 -5.264 -8.199 1.00 43.44 N ATOM 279 CA LEU A 18 -5.159 -4.048 -7.393 1.00 41.21 C ATOM 280 C LEU A 18 -4.495 -2.852 -8.117 1.00 24.53 C ATOM 281 O LEU A 18 -4.925 -1.705 -7.972 1.00 75.15 O ATOM 282 CB LEU A 18 -4.535 -4.302 -5.995 1.00 22.24 C ATOM 283 CG LEU A 18 -5.178 -5.471 -5.177 1.00 20.11 C ATOM 284 CD1 LEU A 18 -4.521 -5.647 -3.800 1.00 11.50 C ATOM 285 CD2 LEU A 18 -6.694 -5.292 -5.038 1.00 74.40 C ATOM 0 H LEU A 18 -4.304 -5.900 -7.858 1.00 43.44 H new ATOM 0 HA LEU A 18 -6.211 -3.796 -7.259 1.00 41.21 H new ATOM 0 HB2 LEU A 18 -3.473 -4.511 -6.122 1.00 22.24 H new ATOM 0 HB3 LEU A 18 -4.612 -3.386 -5.409 1.00 22.24 H new ATOM 0 HG LEU A 18 -4.995 -6.384 -5.743 1.00 20.11 H new ATOM 0 HD11 LEU A 18 -5.001 -6.470 -3.270 1.00 11.50 H new ATOM 0 HD12 LEU A 18 -3.461 -5.867 -3.928 1.00 11.50 H new ATOM 0 HD13 LEU A 18 -4.634 -4.729 -3.223 1.00 11.50 H new ATOM 0 HD21 LEU A 18 -7.107 -6.122 -4.465 1.00 74.40 H new ATOM 0 HD22 LEU A 18 -6.904 -4.355 -4.523 1.00 74.40 H new ATOM 0 HD23 LEU A 18 -7.150 -5.272 -6.028 1.00 74.40 H new ATOM 297 N LEU A 19 -3.462 -3.157 -8.924 1.00 55.42 N ATOM 298 CA LEU A 19 -2.742 -2.166 -9.747 1.00 72.12 C ATOM 299 C LEU A 19 -3.667 -1.529 -10.793 1.00 51.32 C ATOM 300 O LEU A 19 -3.661 -0.299 -10.954 1.00 22.31 O ATOM 301 CB LEU A 19 -1.524 -2.837 -10.437 1.00 22.11 C ATOM 302 CG LEU A 19 -0.730 -1.976 -11.469 1.00 20.55 C ATOM 303 CD1 LEU A 19 -0.087 -0.755 -10.803 1.00 71.51 C ATOM 304 CD2 LEU A 19 0.319 -2.824 -12.215 1.00 62.11 C ATOM 0 H LEU A 19 -3.100 -4.105 -9.024 1.00 55.42 H new ATOM 0 HA LEU A 19 -2.389 -1.371 -9.091 1.00 72.12 H new ATOM 0 HB2 LEU A 19 -0.830 -3.160 -9.661 1.00 22.11 H new ATOM 0 HB3 LEU A 19 -1.875 -3.736 -10.945 1.00 22.11 H new ATOM 0 HG LEU A 19 -1.443 -1.608 -12.207 1.00 20.55 H new ATOM 0 HD11 LEU A 19 0.458 -0.178 -11.550 1.00 71.51 H new ATOM 0 HD12 LEU A 19 -0.863 -0.132 -10.358 1.00 71.51 H new ATOM 0 HD13 LEU A 19 0.602 -1.085 -10.026 1.00 71.51 H new ATOM 0 HD21 LEU A 19 0.855 -2.196 -12.926 1.00 62.11 H new ATOM 0 HD22 LEU A 19 1.024 -3.244 -11.498 1.00 62.11 H new ATOM 0 HD23 LEU A 19 -0.180 -3.633 -12.749 1.00 62.11 H new ATOM 316 N GLU A 20 -4.480 -2.369 -11.486 1.00 51.42 N ATOM 317 CA GLU A 20 -5.346 -1.886 -12.579 1.00 71.22 C ATOM 318 C GLU A 20 -6.392 -0.886 -12.055 1.00 15.21 C ATOM 319 O GLU A 20 -6.812 -0.009 -12.794 1.00 14.45 O ATOM 320 CB GLU A 20 -6.059 -3.042 -13.339 1.00 41.45 C ATOM 321 CG GLU A 20 -7.211 -3.742 -12.573 1.00 61.22 C ATOM 322 CD GLU A 20 -8.234 -4.418 -13.502 1.00 43.12 C ATOM 323 OE1 GLU A 20 -8.945 -3.691 -14.233 1.00 2.42 O ATOM 324 OE2 GLU A 20 -8.342 -5.659 -13.498 1.00 24.12 O ATOM 0 H GLU A 20 -4.549 -3.371 -11.306 1.00 51.42 H new ATOM 0 HA GLU A 20 -4.687 -1.384 -13.288 1.00 71.22 H new ATOM 0 HB2 GLU A 20 -6.457 -2.646 -14.274 1.00 41.45 H new ATOM 0 HB3 GLU A 20 -5.314 -3.793 -13.602 1.00 41.45 H new ATOM 0 HG2 GLU A 20 -6.790 -4.490 -11.901 1.00 61.22 H new ATOM 0 HG3 GLU A 20 -7.724 -3.008 -11.951 1.00 61.22 H new ATOM 331 N VAL A 21 -6.787 -1.035 -10.771 1.00 53.33 N ATOM 332 CA VAL A 21 -7.790 -0.171 -10.125 1.00 25.12 C ATOM 333 C VAL A 21 -7.276 1.280 -10.033 1.00 53.40 C ATOM 334 O VAL A 21 -8.043 2.232 -10.238 1.00 23.02 O ATOM 335 CB VAL A 21 -8.172 -0.696 -8.694 1.00 12.02 C ATOM 336 CG1 VAL A 21 -9.271 0.180 -8.044 1.00 23.22 C ATOM 337 CG2 VAL A 21 -8.612 -2.177 -8.752 1.00 75.11 C ATOM 0 H VAL A 21 -6.417 -1.760 -10.156 1.00 53.33 H new ATOM 0 HA VAL A 21 -8.687 -0.195 -10.744 1.00 25.12 H new ATOM 0 HB VAL A 21 -7.282 -0.627 -8.068 1.00 12.02 H new ATOM 0 HG11 VAL A 21 -9.511 -0.211 -7.055 1.00 23.22 H new ATOM 0 HG12 VAL A 21 -8.912 1.205 -7.951 1.00 23.22 H new ATOM 0 HG13 VAL A 21 -10.165 0.164 -8.667 1.00 23.22 H new ATOM 0 HG21 VAL A 21 -8.872 -2.519 -7.750 1.00 75.11 H new ATOM 0 HG22 VAL A 21 -9.480 -2.273 -9.405 1.00 75.11 H new ATOM 0 HG23 VAL A 21 -7.795 -2.784 -9.142 1.00 75.11 H new ATOM 347 N VAL A 22 -5.971 1.437 -9.736 1.00 72.21 N ATOM 348 CA VAL A 22 -5.321 2.761 -9.717 1.00 63.42 C ATOM 349 C VAL A 22 -5.369 3.381 -11.129 1.00 21.02 C ATOM 350 O VAL A 22 -5.735 4.540 -11.295 1.00 5.40 O ATOM 351 CB VAL A 22 -3.820 2.706 -9.240 1.00 3.10 C ATOM 352 CG1 VAL A 22 -3.241 4.134 -9.078 1.00 43.32 C ATOM 353 CG2 VAL A 22 -3.661 1.897 -7.934 1.00 20.20 C ATOM 0 H VAL A 22 -5.347 0.663 -9.506 1.00 72.21 H new ATOM 0 HA VAL A 22 -5.872 3.369 -9.000 1.00 63.42 H new ATOM 0 HB VAL A 22 -3.252 2.189 -10.013 1.00 3.10 H new ATOM 0 HG11 VAL A 22 -2.204 4.071 -8.748 1.00 43.32 H new ATOM 0 HG12 VAL A 22 -3.287 4.656 -10.034 1.00 43.32 H new ATOM 0 HG13 VAL A 22 -3.825 4.681 -8.338 1.00 43.32 H new ATOM 0 HG21 VAL A 22 -2.612 1.884 -7.640 1.00 20.20 H new ATOM 0 HG22 VAL A 22 -4.253 2.360 -7.145 1.00 20.20 H new ATOM 0 HG23 VAL A 22 -4.006 0.876 -8.094 1.00 20.20 H new ATOM 363 N LEU A 23 -5.051 2.545 -12.130 1.00 31.15 N ATOM 364 CA LEU A 23 -4.871 2.970 -13.529 1.00 70.12 C ATOM 365 C LEU A 23 -6.212 3.320 -14.206 1.00 32.12 C ATOM 366 O LEU A 23 -6.268 4.250 -15.018 1.00 74.21 O ATOM 367 CB LEU A 23 -4.125 1.860 -14.316 1.00 54.24 C ATOM 368 CG LEU A 23 -2.745 1.431 -13.721 1.00 73.34 C ATOM 369 CD1 LEU A 23 -2.102 0.302 -14.549 1.00 72.14 C ATOM 370 CD2 LEU A 23 -1.794 2.640 -13.568 1.00 52.24 C ATOM 0 H LEU A 23 -4.910 1.545 -11.990 1.00 31.15 H new ATOM 0 HA LEU A 23 -4.272 3.881 -13.533 1.00 70.12 H new ATOM 0 HB2 LEU A 23 -4.768 0.981 -14.370 1.00 54.24 H new ATOM 0 HB3 LEU A 23 -3.970 2.204 -15.338 1.00 54.24 H new ATOM 0 HG LEU A 23 -2.927 1.036 -12.722 1.00 73.34 H new ATOM 0 HD11 LEU A 23 -1.144 0.028 -14.108 1.00 72.14 H new ATOM 0 HD12 LEU A 23 -2.761 -0.566 -14.554 1.00 72.14 H new ATOM 0 HD13 LEU A 23 -1.946 0.645 -15.572 1.00 72.14 H new ATOM 0 HD21 LEU A 23 -0.844 2.305 -13.152 1.00 52.24 H new ATOM 0 HD22 LEU A 23 -1.623 3.094 -14.544 1.00 52.24 H new ATOM 0 HD23 LEU A 23 -2.244 3.375 -12.900 1.00 52.24 H new ATOM 382 N LYS A 24 -7.291 2.571 -13.865 1.00 31.41 N ATOM 383 CA LYS A 24 -8.645 2.824 -14.408 1.00 4.54 C ATOM 384 C LYS A 24 -9.190 4.150 -13.847 1.00 51.51 C ATOM 385 O LYS A 24 -9.928 4.867 -14.533 1.00 53.13 O ATOM 386 CB LYS A 24 -9.633 1.657 -14.085 1.00 42.42 C ATOM 387 CG LYS A 24 -9.287 0.280 -14.708 1.00 13.14 C ATOM 388 CD LYS A 24 -9.144 0.324 -16.246 1.00 60.13 C ATOM 389 CE LYS A 24 -8.976 -1.078 -16.870 1.00 64.22 C ATOM 390 NZ LYS A 24 -7.838 -1.841 -16.282 1.00 22.34 N ATOM 0 H LYS A 24 -7.247 1.786 -13.215 1.00 31.41 H new ATOM 0 HA LYS A 24 -8.562 2.889 -15.493 1.00 4.54 H new ATOM 0 HB2 LYS A 24 -9.685 1.541 -13.002 1.00 42.42 H new ATOM 0 HB3 LYS A 24 -10.628 1.946 -14.423 1.00 42.42 H new ATOM 0 HG2 LYS A 24 -8.356 -0.084 -14.274 1.00 13.14 H new ATOM 0 HG3 LYS A 24 -10.064 -0.437 -14.443 1.00 13.14 H new ATOM 0 HD2 LYS A 24 -10.023 0.805 -16.675 1.00 60.13 H new ATOM 0 HD3 LYS A 24 -8.284 0.940 -16.509 1.00 60.13 H new ATOM 0 HE2 LYS A 24 -9.897 -1.645 -16.732 1.00 64.22 H new ATOM 0 HE3 LYS A 24 -8.822 -0.976 -17.944 1.00 64.22 H new ATOM 0 HZ1 LYS A 24 -7.350 -2.370 -17.033 1.00 22.34 H new ATOM 0 HZ2 LYS A 24 -7.171 -1.180 -15.834 1.00 22.34 H new ATOM 0 HZ3 LYS A 24 -8.198 -2.506 -15.568 1.00 22.34 H new ATOM 404 N SER A 25 -8.811 4.459 -12.587 1.00 1.43 N ATOM 405 CA SER A 25 -9.142 5.733 -11.941 1.00 4.12 C ATOM 406 C SER A 25 -8.281 6.859 -12.556 1.00 61.43 C ATOM 407 O SER A 25 -8.746 7.599 -13.432 1.00 23.24 O ATOM 408 CB SER A 25 -8.941 5.622 -10.404 1.00 21.25 C ATOM 409 OG SER A 25 -9.243 6.846 -9.738 1.00 63.42 O ATOM 0 H SER A 25 -8.268 3.829 -11.997 1.00 1.43 H new ATOM 0 HA SER A 25 -10.190 5.976 -12.114 1.00 4.12 H new ATOM 0 HB2 SER A 25 -9.577 4.829 -10.011 1.00 21.25 H new ATOM 0 HB3 SER A 25 -7.910 5.338 -10.192 1.00 21.25 H new ATOM 0 HG SER A 25 -9.106 6.736 -8.774 1.00 63.42 H new ATOM 415 N ASP A 26 -7.006 6.951 -12.110 1.00 73.14 N ATOM 416 CA ASP A 26 -6.039 7.978 -12.553 1.00 2.14 C ATOM 417 C ASP A 26 -4.625 7.362 -12.672 1.00 20.12 C ATOM 418 O ASP A 26 -4.098 6.849 -11.679 1.00 61.43 O ATOM 419 CB ASP A 26 -5.987 9.171 -11.552 1.00 61.24 C ATOM 420 CG ASP A 26 -7.257 10.040 -11.552 1.00 0.33 C ATOM 421 OD1 ASP A 26 -8.266 9.641 -10.937 1.00 3.11 O ATOM 422 OD2 ASP A 26 -7.258 11.125 -12.170 1.00 35.31 O ATOM 0 H ASP A 26 -6.617 6.305 -11.423 1.00 73.14 H new ATOM 0 HA ASP A 26 -6.369 8.346 -13.525 1.00 2.14 H new ATOM 0 HB2 ASP A 26 -5.824 8.782 -10.547 1.00 61.24 H new ATOM 0 HB3 ASP A 26 -5.129 9.798 -11.794 1.00 61.24 H new ATOM 427 N PRO A 27 -3.979 7.412 -13.884 1.00 2.21 N ATOM 428 CA PRO A 27 -2.557 6.992 -14.059 1.00 1.13 C ATOM 429 C PRO A 27 -1.562 8.044 -13.502 1.00 73.04 C ATOM 430 O PRO A 27 -0.346 7.861 -13.585 1.00 51.34 O ATOM 431 CB PRO A 27 -2.432 6.851 -15.595 1.00 50.04 C ATOM 432 CG PRO A 27 -3.402 7.863 -16.141 1.00 72.31 C ATOM 433 CD PRO A 27 -4.580 7.858 -15.180 1.00 24.52 C ATOM 0 HA PRO A 27 -2.315 6.079 -13.516 1.00 1.13 H new ATOM 0 HB2 PRO A 27 -1.415 7.053 -15.932 1.00 50.04 H new ATOM 0 HB3 PRO A 27 -2.682 5.842 -15.924 1.00 50.04 H new ATOM 0 HG2 PRO A 27 -2.947 8.852 -16.198 1.00 72.31 H new ATOM 0 HG3 PRO A 27 -3.718 7.599 -17.150 1.00 72.31 H new ATOM 0 HD2 PRO A 27 -5.030 8.847 -15.093 1.00 24.52 H new ATOM 0 HD3 PRO A 27 -5.365 7.179 -15.512 1.00 24.52 H new ATOM 441 N ASN A 28 -2.109 9.152 -12.959 1.00 60.53 N ATOM 442 CA ASN A 28 -1.332 10.250 -12.340 1.00 71.01 C ATOM 443 C ASN A 28 -0.737 9.821 -10.992 1.00 41.31 C ATOM 444 O ASN A 28 0.279 10.372 -10.545 1.00 3.32 O ATOM 445 CB ASN A 28 -2.227 11.508 -12.155 1.00 1.42 C ATOM 446 CG ASN A 28 -2.744 12.090 -13.475 1.00 21.40 C ATOM 447 OD1 ASN A 28 -2.993 11.366 -14.440 1.00 71.21 O ATOM 448 ND2 ASN A 28 -2.896 13.403 -13.533 1.00 60.10 N ATOM 0 H ASN A 28 -3.116 9.312 -12.937 1.00 60.53 H new ATOM 0 HA ASN A 28 -0.508 10.495 -13.010 1.00 71.01 H new ATOM 0 HB2 ASN A 28 -3.077 11.250 -11.523 1.00 1.42 H new ATOM 0 HB3 ASN A 28 -1.659 12.274 -11.627 1.00 1.42 H new ATOM 0 HD21 ASN A 28 -3.227 13.841 -14.393 1.00 60.10 H new ATOM 0 HD22 ASN A 28 -2.682 13.978 -12.718 1.00 60.10 H new ATOM 455 N VAL A 29 -1.391 8.857 -10.338 1.00 31.42 N ATOM 456 CA VAL A 29 -0.895 8.271 -9.091 1.00 5.23 C ATOM 457 C VAL A 29 0.233 7.286 -9.436 1.00 40.24 C ATOM 458 O VAL A 29 0.009 6.324 -10.179 1.00 11.21 O ATOM 459 CB VAL A 29 -2.043 7.537 -8.312 1.00 61.34 C ATOM 460 CG1 VAL A 29 -1.549 6.981 -6.955 1.00 72.24 C ATOM 461 CG2 VAL A 29 -3.261 8.468 -8.116 1.00 15.44 C ATOM 0 H VAL A 29 -2.276 8.462 -10.657 1.00 31.42 H new ATOM 0 HA VAL A 29 -0.519 9.063 -8.443 1.00 5.23 H new ATOM 0 HB VAL A 29 -2.357 6.687 -8.919 1.00 61.34 H new ATOM 0 HG11 VAL A 29 -2.372 6.480 -6.446 1.00 72.24 H new ATOM 0 HG12 VAL A 29 -0.741 6.269 -7.126 1.00 72.24 H new ATOM 0 HG13 VAL A 29 -1.185 7.801 -6.336 1.00 72.24 H new ATOM 0 HG21 VAL A 29 -4.042 7.936 -7.574 1.00 15.44 H new ATOM 0 HG22 VAL A 29 -2.959 9.347 -7.547 1.00 15.44 H new ATOM 0 HG23 VAL A 29 -3.642 8.779 -9.089 1.00 15.44 H new ATOM 471 N LYS A 30 1.446 7.569 -8.928 1.00 61.21 N ATOM 472 CA LYS A 30 2.642 6.741 -9.168 1.00 43.13 C ATOM 473 C LYS A 30 2.436 5.330 -8.586 1.00 20.03 C ATOM 474 O LYS A 30 1.928 5.187 -7.484 1.00 21.14 O ATOM 475 CB LYS A 30 3.903 7.428 -8.563 1.00 2.32 C ATOM 476 CG LYS A 30 5.209 6.593 -8.649 1.00 65.42 C ATOM 477 CD LYS A 30 5.602 6.216 -10.105 1.00 0.04 C ATOM 478 CE LYS A 30 6.616 5.067 -10.163 1.00 34.23 C ATOM 479 NZ LYS A 30 6.908 4.650 -11.555 1.00 32.34 N ATOM 0 H LYS A 30 1.625 8.381 -8.337 1.00 61.21 H new ATOM 0 HA LYS A 30 2.799 6.641 -10.242 1.00 43.13 H new ATOM 0 HB2 LYS A 30 4.062 8.377 -9.075 1.00 2.32 H new ATOM 0 HB3 LYS A 30 3.705 7.659 -7.516 1.00 2.32 H new ATOM 0 HG2 LYS A 30 6.023 7.157 -8.195 1.00 65.42 H new ATOM 0 HG3 LYS A 30 5.088 5.681 -8.065 1.00 65.42 H new ATOM 0 HD2 LYS A 30 4.706 5.933 -10.658 1.00 0.04 H new ATOM 0 HD3 LYS A 30 6.021 7.091 -10.603 1.00 0.04 H new ATOM 0 HE2 LYS A 30 7.541 5.376 -9.676 1.00 34.23 H new ATOM 0 HE3 LYS A 30 6.230 4.215 -9.603 1.00 34.23 H new ATOM 0 HZ1 LYS A 30 7.598 3.872 -11.547 1.00 32.34 H new ATOM 0 HZ2 LYS A 30 6.031 4.330 -12.013 1.00 32.34 H new ATOM 0 HZ3 LYS A 30 7.301 5.455 -12.083 1.00 32.34 H new ATOM 493 N THR A 31 2.791 4.294 -9.361 1.00 15.05 N ATOM 494 CA THR A 31 2.588 2.886 -8.964 1.00 22.14 C ATOM 495 C THR A 31 3.879 2.065 -9.128 1.00 60.25 C ATOM 496 O THR A 31 4.594 2.205 -10.124 1.00 3.23 O ATOM 497 CB THR A 31 1.448 2.242 -9.809 1.00 41.22 C ATOM 498 OG1 THR A 31 1.701 2.434 -11.214 1.00 1.33 O ATOM 499 CG2 THR A 31 0.067 2.819 -9.461 1.00 2.31 C ATOM 0 H THR A 31 3.225 4.404 -10.277 1.00 15.05 H new ATOM 0 HA THR A 31 2.307 2.879 -7.911 1.00 22.14 H new ATOM 0 HB THR A 31 1.438 1.178 -9.571 1.00 41.22 H new ATOM 0 HG1 THR A 31 0.980 2.024 -11.735 1.00 1.33 H new ATOM 0 HG21 THR A 31 -0.694 2.338 -10.076 1.00 2.31 H new ATOM 0 HG22 THR A 31 -0.149 2.636 -8.408 1.00 2.31 H new ATOM 0 HG23 THR A 31 0.063 3.892 -9.651 1.00 2.31 H new ATOM 507 N VAL A 32 4.155 1.209 -8.127 1.00 2.32 N ATOM 508 CA VAL A 32 5.321 0.301 -8.096 1.00 41.35 C ATOM 509 C VAL A 32 4.869 -1.079 -7.594 1.00 3.52 C ATOM 510 O VAL A 32 4.127 -1.156 -6.620 1.00 32.34 O ATOM 511 CB VAL A 32 6.454 0.846 -7.141 1.00 1.41 C ATOM 512 CG1 VAL A 32 7.630 -0.153 -7.013 1.00 20.23 C ATOM 513 CG2 VAL A 32 6.956 2.240 -7.588 1.00 22.31 C ATOM 0 H VAL A 32 3.564 1.126 -7.300 1.00 2.32 H new ATOM 0 HA VAL A 32 5.726 0.233 -9.106 1.00 41.35 H new ATOM 0 HB VAL A 32 6.008 0.955 -6.153 1.00 1.41 H new ATOM 0 HG11 VAL A 32 8.388 0.260 -6.347 1.00 20.23 H new ATOM 0 HG12 VAL A 32 7.264 -1.095 -6.605 1.00 20.23 H new ATOM 0 HG13 VAL A 32 8.067 -0.328 -7.996 1.00 20.23 H new ATOM 0 HG21 VAL A 32 7.735 2.582 -6.907 1.00 22.31 H new ATOM 0 HG22 VAL A 32 7.361 2.174 -8.598 1.00 22.31 H new ATOM 0 HG23 VAL A 32 6.126 2.947 -7.575 1.00 22.31 H new ATOM 523 N ARG A 33 5.321 -2.158 -8.265 1.00 74.12 N ATOM 524 CA ARG A 33 5.106 -3.546 -7.809 1.00 33.32 C ATOM 525 C ARG A 33 6.474 -4.236 -7.675 1.00 20.14 C ATOM 526 O ARG A 33 7.025 -4.756 -8.646 1.00 2.14 O ATOM 527 CB ARG A 33 4.162 -4.323 -8.775 1.00 2.51 C ATOM 528 CG ARG A 33 3.789 -5.749 -8.299 1.00 4.30 C ATOM 529 CD ARG A 33 2.835 -6.475 -9.263 1.00 25.42 C ATOM 530 NE ARG A 33 3.459 -6.740 -10.570 1.00 41.00 N ATOM 531 CZ ARG A 33 3.084 -7.695 -11.438 1.00 4.31 C ATOM 532 NH1 ARG A 33 2.077 -8.527 -11.160 1.00 41.22 N ATOM 533 NH2 ARG A 33 3.727 -7.811 -12.588 1.00 30.31 N ATOM 0 H ARG A 33 5.845 -2.091 -9.138 1.00 74.12 H new ATOM 0 HA ARG A 33 4.611 -3.538 -6.838 1.00 33.32 H new ATOM 0 HB2 ARG A 33 3.246 -3.747 -8.909 1.00 2.51 H new ATOM 0 HB3 ARG A 33 4.640 -4.393 -9.752 1.00 2.51 H new ATOM 0 HG2 ARG A 33 4.699 -6.338 -8.186 1.00 4.30 H new ATOM 0 HG3 ARG A 33 3.325 -5.688 -7.315 1.00 4.30 H new ATOM 0 HD2 ARG A 33 2.518 -7.417 -8.816 1.00 25.42 H new ATOM 0 HD3 ARG A 33 1.938 -5.872 -9.406 1.00 25.42 H new ATOM 0 HE ARG A 33 4.244 -6.147 -10.840 1.00 41.00 H new ATOM 0 HH11 ARG A 33 1.577 -8.444 -10.275 1.00 41.22 H new ATOM 0 HH12 ARG A 33 1.808 -9.245 -11.833 1.00 41.22 H new ATOM 0 HH21 ARG A 33 4.498 -7.180 -12.807 1.00 30.31 H new ATOM 0 HH22 ARG A 33 3.452 -8.532 -13.255 1.00 30.31 H new ATOM 547 N THR A 34 7.042 -4.172 -6.463 1.00 71.24 N ATOM 548 CA THR A 34 8.377 -4.719 -6.148 1.00 34.13 C ATOM 549 C THR A 34 8.241 -5.929 -5.199 1.00 65.31 C ATOM 550 O THR A 34 7.141 -6.265 -4.764 1.00 2.32 O ATOM 551 CB THR A 34 9.280 -3.604 -5.502 1.00 23.53 C ATOM 552 OG1 THR A 34 10.616 -4.089 -5.255 1.00 65.32 O ATOM 553 CG2 THR A 34 8.683 -3.061 -4.193 1.00 74.42 C ATOM 0 H THR A 34 6.586 -3.735 -5.662 1.00 71.24 H new ATOM 0 HA THR A 34 8.852 -5.054 -7.070 1.00 34.13 H new ATOM 0 HB THR A 34 9.322 -2.788 -6.224 1.00 23.53 H new ATOM 0 HG1 THR A 34 11.196 -3.339 -5.007 1.00 65.32 H new ATOM 0 HG21 THR A 34 9.341 -2.294 -3.784 1.00 74.42 H new ATOM 0 HG22 THR A 34 7.702 -2.629 -4.392 1.00 74.42 H new ATOM 0 HG23 THR A 34 8.583 -3.874 -3.474 1.00 74.42 H new ATOM 561 N ASP A 35 9.360 -6.607 -4.925 1.00 71.45 N ATOM 562 CA ASP A 35 9.443 -7.699 -3.924 1.00 32.31 C ATOM 563 C ASP A 35 10.425 -7.317 -2.803 1.00 22.44 C ATOM 564 O ASP A 35 10.492 -7.996 -1.774 1.00 32.41 O ATOM 565 CB ASP A 35 9.891 -9.021 -4.600 1.00 63.51 C ATOM 566 CG ASP A 35 11.289 -8.933 -5.252 1.00 20.10 C ATOM 567 OD1 ASP A 35 12.285 -9.404 -4.652 1.00 31.24 O ATOM 568 OD2 ASP A 35 11.394 -8.381 -6.374 1.00 50.21 O ATOM 0 H ASP A 35 10.247 -6.419 -5.391 1.00 71.45 H new ATOM 0 HA ASP A 35 8.454 -7.849 -3.491 1.00 32.31 H new ATOM 0 HB2 ASP A 35 9.895 -9.818 -3.856 1.00 63.51 H new ATOM 0 HB3 ASP A 35 9.160 -9.298 -5.360 1.00 63.51 H new ATOM 573 N ASP A 36 11.187 -6.227 -3.026 1.00 53.40 N ATOM 574 CA ASP A 36 12.233 -5.755 -2.098 1.00 20.24 C ATOM 575 C ASP A 36 11.683 -4.605 -1.231 1.00 64.01 C ATOM 576 O ASP A 36 11.054 -3.680 -1.752 1.00 4.43 O ATOM 577 CB ASP A 36 13.477 -5.287 -2.901 1.00 13.23 C ATOM 578 CG ASP A 36 14.689 -4.929 -2.013 1.00 70.42 C ATOM 579 OD1 ASP A 36 15.630 -5.739 -1.899 1.00 33.11 O ATOM 580 OD2 ASP A 36 14.707 -3.835 -1.417 1.00 30.25 O ATOM 0 H ASP A 36 11.093 -5.647 -3.860 1.00 53.40 H new ATOM 0 HA ASP A 36 12.530 -6.573 -1.442 1.00 20.24 H new ATOM 0 HB2 ASP A 36 13.767 -6.075 -3.597 1.00 13.23 H new ATOM 0 HB3 ASP A 36 13.206 -4.417 -3.499 1.00 13.23 H new ATOM 585 N LYS A 37 11.963 -4.665 0.083 1.00 14.23 N ATOM 586 CA LYS A 37 11.423 -3.710 1.077 1.00 2.11 C ATOM 587 C LYS A 37 12.064 -2.307 0.984 1.00 31.30 C ATOM 588 O LYS A 37 11.369 -1.294 1.066 1.00 43.15 O ATOM 589 CB LYS A 37 11.532 -4.258 2.543 1.00 42.22 C ATOM 590 CG LYS A 37 12.943 -4.422 3.180 1.00 75.52 C ATOM 591 CD LYS A 37 13.785 -5.568 2.569 1.00 24.10 C ATOM 592 CE LYS A 37 15.018 -5.933 3.421 1.00 11.12 C ATOM 593 NZ LYS A 37 15.928 -4.776 3.663 1.00 60.42 N ATOM 0 H LYS A 37 12.570 -5.376 0.490 1.00 14.23 H new ATOM 0 HA LYS A 37 10.368 -3.603 0.825 1.00 2.11 H new ATOM 0 HB2 LYS A 37 10.954 -3.595 3.187 1.00 42.22 H new ATOM 0 HB3 LYS A 37 11.043 -5.232 2.568 1.00 42.22 H new ATOM 0 HG2 LYS A 37 13.490 -3.486 3.070 1.00 75.52 H new ATOM 0 HG3 LYS A 37 12.828 -4.601 4.249 1.00 75.52 H new ATOM 0 HD2 LYS A 37 13.156 -6.451 2.453 1.00 24.10 H new ATOM 0 HD3 LYS A 37 14.113 -5.277 1.571 1.00 24.10 H new ATOM 0 HE2 LYS A 37 14.685 -6.331 4.379 1.00 11.12 H new ATOM 0 HE3 LYS A 37 15.574 -6.727 2.922 1.00 11.12 H new ATOM 0 HZ1 LYS A 37 16.814 -5.114 4.091 1.00 60.42 H new ATOM 0 HZ2 LYS A 37 16.138 -4.304 2.760 1.00 60.42 H new ATOM 0 HZ3 LYS A 37 15.468 -4.101 4.307 1.00 60.42 H new ATOM 607 N GLU A 38 13.388 -2.245 0.840 1.00 5.30 N ATOM 608 CA GLU A 38 14.123 -0.962 0.865 1.00 32.23 C ATOM 609 C GLU A 38 14.171 -0.289 -0.515 1.00 55.04 C ATOM 610 O GLU A 38 14.503 0.900 -0.613 1.00 2.31 O ATOM 611 CB GLU A 38 15.508 -1.136 1.524 1.00 23.33 C ATOM 612 CG GLU A 38 15.398 -1.549 3.011 1.00 5.03 C ATOM 613 CD GLU A 38 16.685 -1.359 3.821 1.00 2.02 C ATOM 614 OE1 GLU A 38 17.582 -2.220 3.737 1.00 70.12 O ATOM 615 OE2 GLU A 38 16.785 -0.355 4.571 1.00 61.44 O ATOM 0 H GLU A 38 13.981 -3.064 0.704 1.00 5.30 H new ATOM 0 HA GLU A 38 13.568 -0.265 1.493 1.00 32.23 H new ATOM 0 HB2 GLU A 38 16.076 -1.891 0.980 1.00 23.33 H new ATOM 0 HB3 GLU A 38 16.065 -0.202 1.448 1.00 23.33 H new ATOM 0 HG2 GLU A 38 14.601 -0.970 3.478 1.00 5.03 H new ATOM 0 HG3 GLU A 38 15.103 -2.597 3.063 1.00 5.03 H new ATOM 622 N LYS A 39 13.848 -1.057 -1.572 1.00 63.10 N ATOM 623 CA LYS A 39 13.613 -0.509 -2.917 1.00 31.41 C ATOM 624 C LYS A 39 12.408 0.445 -2.868 1.00 70.20 C ATOM 625 O LYS A 39 12.421 1.509 -3.497 1.00 44.02 O ATOM 626 CB LYS A 39 13.361 -1.637 -3.962 1.00 70.44 C ATOM 627 CG LYS A 39 13.129 -1.114 -5.401 1.00 5.33 C ATOM 628 CD LYS A 39 14.393 -0.446 -6.005 1.00 43.24 C ATOM 629 CE LYS A 39 14.082 0.419 -7.238 1.00 34.11 C ATOM 630 NZ LYS A 39 13.286 -0.307 -8.266 1.00 24.22 N ATOM 0 H LYS A 39 13.743 -2.070 -1.516 1.00 63.10 H new ATOM 0 HA LYS A 39 14.506 0.032 -3.230 1.00 31.41 H new ATOM 0 HB2 LYS A 39 14.215 -2.315 -3.965 1.00 70.44 H new ATOM 0 HB3 LYS A 39 12.493 -2.219 -3.652 1.00 70.44 H new ATOM 0 HG2 LYS A 39 12.820 -1.942 -6.039 1.00 5.33 H new ATOM 0 HG3 LYS A 39 12.310 -0.394 -5.394 1.00 5.33 H new ATOM 0 HD2 LYS A 39 14.869 0.173 -5.244 1.00 43.24 H new ATOM 0 HD3 LYS A 39 15.110 -1.219 -6.282 1.00 43.24 H new ATOM 0 HE2 LYS A 39 13.536 1.309 -6.924 1.00 34.11 H new ATOM 0 HE3 LYS A 39 15.017 0.759 -7.683 1.00 34.11 H new ATOM 0 HZ1 LYS A 39 13.592 -0.011 -9.215 1.00 24.22 H new ATOM 0 HZ2 LYS A 39 13.433 -1.331 -8.159 1.00 24.22 H new ATOM 0 HZ3 LYS A 39 12.277 -0.087 -8.143 1.00 24.22 H new ATOM 644 N VAL A 40 11.379 0.043 -2.084 1.00 41.33 N ATOM 645 CA VAL A 40 10.177 0.851 -1.837 1.00 71.11 C ATOM 646 C VAL A 40 10.568 2.242 -1.320 1.00 42.25 C ATOM 647 O VAL A 40 10.058 3.243 -1.803 1.00 45.44 O ATOM 648 CB VAL A 40 9.230 0.174 -0.780 1.00 51.41 C ATOM 649 CG1 VAL A 40 7.971 1.024 -0.531 1.00 32.32 C ATOM 650 CG2 VAL A 40 8.848 -1.264 -1.187 1.00 60.14 C ATOM 0 H VAL A 40 11.367 -0.858 -1.606 1.00 41.33 H new ATOM 0 HA VAL A 40 9.646 0.935 -2.785 1.00 71.11 H new ATOM 0 HB VAL A 40 9.789 0.113 0.154 1.00 51.41 H new ATOM 0 HG11 VAL A 40 7.337 0.529 0.204 1.00 32.32 H new ATOM 0 HG12 VAL A 40 8.263 2.005 -0.156 1.00 32.32 H new ATOM 0 HG13 VAL A 40 7.420 1.141 -1.464 1.00 32.32 H new ATOM 0 HG21 VAL A 40 8.193 -1.695 -0.429 1.00 60.14 H new ATOM 0 HG22 VAL A 40 8.330 -1.245 -2.146 1.00 60.14 H new ATOM 0 HG23 VAL A 40 9.750 -1.869 -1.274 1.00 60.14 H new ATOM 660 N LYS A 41 11.501 2.263 -0.347 1.00 4.32 N ATOM 661 CA LYS A 41 11.970 3.497 0.314 1.00 71.22 C ATOM 662 C LYS A 41 12.621 4.455 -0.691 1.00 54.13 C ATOM 663 O LYS A 41 12.392 5.669 -0.638 1.00 73.34 O ATOM 664 CB LYS A 41 12.980 3.160 1.427 1.00 62.44 C ATOM 665 CG LYS A 41 12.425 2.274 2.552 1.00 55.44 C ATOM 666 CD LYS A 41 13.501 1.984 3.617 1.00 31.41 C ATOM 667 CE LYS A 41 13.001 1.082 4.741 1.00 33.35 C ATOM 668 NZ LYS A 41 14.087 0.758 5.710 1.00 54.00 N ATOM 0 H LYS A 41 11.953 1.419 0.004 1.00 4.32 H new ATOM 0 HA LYS A 41 11.099 3.988 0.748 1.00 71.22 H new ATOM 0 HB2 LYS A 41 13.839 2.660 0.980 1.00 62.44 H new ATOM 0 HB3 LYS A 41 13.344 4.091 1.862 1.00 62.44 H new ATOM 0 HG2 LYS A 41 11.572 2.766 3.018 1.00 55.44 H new ATOM 0 HG3 LYS A 41 12.062 1.335 2.133 1.00 55.44 H new ATOM 0 HD2 LYS A 41 14.361 1.515 3.138 1.00 31.41 H new ATOM 0 HD3 LYS A 41 13.847 2.926 4.042 1.00 31.41 H new ATOM 0 HE2 LYS A 41 12.180 1.573 5.264 1.00 33.35 H new ATOM 0 HE3 LYS A 41 12.603 0.160 4.318 1.00 33.35 H new ATOM 0 HZ1 LYS A 41 13.887 -0.157 6.163 1.00 54.00 H new ATOM 0 HZ2 LYS A 41 14.996 0.704 5.208 1.00 54.00 H new ATOM 0 HZ3 LYS A 41 14.137 1.500 6.437 1.00 54.00 H new ATOM 682 N GLU A 42 13.444 3.882 -1.592 1.00 70.54 N ATOM 683 CA GLU A 42 14.101 4.631 -2.677 1.00 2.05 C ATOM 684 C GLU A 42 13.053 5.284 -3.595 1.00 3.23 C ATOM 685 O GLU A 42 13.228 6.419 -4.050 1.00 44.21 O ATOM 686 CB GLU A 42 15.030 3.701 -3.502 1.00 44.14 C ATOM 687 CG GLU A 42 16.169 3.052 -2.690 1.00 63.35 C ATOM 688 CD GLU A 42 17.051 2.117 -3.536 1.00 2.42 C ATOM 689 OE1 GLU A 42 18.081 2.573 -4.079 1.00 21.41 O ATOM 690 OE2 GLU A 42 16.711 0.925 -3.684 1.00 10.42 O ATOM 0 H GLU A 42 13.670 2.887 -1.586 1.00 70.54 H new ATOM 0 HA GLU A 42 14.708 5.416 -2.227 1.00 2.05 H new ATOM 0 HB2 GLU A 42 14.427 2.913 -3.952 1.00 44.14 H new ATOM 0 HB3 GLU A 42 15.465 4.276 -4.320 1.00 44.14 H new ATOM 0 HG2 GLU A 42 16.791 3.835 -2.256 1.00 63.35 H new ATOM 0 HG3 GLU A 42 15.742 2.488 -1.861 1.00 63.35 H new ATOM 697 N GLU A 43 11.955 4.549 -3.840 1.00 64.45 N ATOM 698 CA GLU A 43 10.856 4.992 -4.715 1.00 53.41 C ATOM 699 C GLU A 43 9.845 5.895 -3.974 1.00 43.45 C ATOM 700 O GLU A 43 9.087 6.633 -4.615 1.00 72.44 O ATOM 701 CB GLU A 43 10.208 3.761 -5.402 1.00 72.21 C ATOM 702 CG GLU A 43 11.250 2.939 -6.206 1.00 3.44 C ATOM 703 CD GLU A 43 10.666 2.047 -7.303 1.00 22.31 C ATOM 704 OE1 GLU A 43 10.730 0.803 -7.193 1.00 21.31 O ATOM 705 OE2 GLU A 43 10.169 2.597 -8.309 1.00 73.23 O ATOM 0 H GLU A 43 11.804 3.625 -3.434 1.00 64.45 H new ATOM 0 HA GLU A 43 11.262 5.628 -5.502 1.00 53.41 H new ATOM 0 HB2 GLU A 43 9.746 3.124 -4.648 1.00 72.21 H new ATOM 0 HB3 GLU A 43 9.413 4.093 -6.069 1.00 72.21 H new ATOM 0 HG2 GLU A 43 11.961 3.629 -6.660 1.00 3.44 H new ATOM 0 HG3 GLU A 43 11.811 2.314 -5.511 1.00 3.44 H new ATOM 712 N ILE A 44 9.859 5.843 -2.624 1.00 20.42 N ATOM 713 CA ILE A 44 9.146 6.810 -1.768 1.00 25.43 C ATOM 714 C ILE A 44 9.817 8.188 -1.931 1.00 35.52 C ATOM 715 O ILE A 44 9.129 9.208 -2.034 1.00 43.24 O ATOM 716 CB ILE A 44 9.141 6.358 -0.242 1.00 12.53 C ATOM 717 CG1 ILE A 44 8.195 5.131 -0.024 1.00 42.20 C ATOM 718 CG2 ILE A 44 8.775 7.516 0.721 1.00 4.13 C ATOM 719 CD1 ILE A 44 8.170 4.578 1.397 1.00 34.05 C ATOM 0 H ILE A 44 10.365 5.129 -2.100 1.00 20.42 H new ATOM 0 HA ILE A 44 8.103 6.862 -2.079 1.00 25.43 H new ATOM 0 HB ILE A 44 10.161 6.057 -0.001 1.00 12.53 H new ATOM 0 HG12 ILE A 44 7.182 5.419 -0.303 1.00 42.20 H new ATOM 0 HG13 ILE A 44 8.498 4.333 -0.702 1.00 42.20 H new ATOM 0 HG21 ILE A 44 8.787 7.152 1.748 1.00 4.13 H new ATOM 0 HG22 ILE A 44 9.501 8.322 0.613 1.00 4.13 H new ATOM 0 HG23 ILE A 44 7.780 7.889 0.479 1.00 4.13 H new ATOM 0 HD11 ILE A 44 7.486 3.731 1.446 1.00 34.05 H new ATOM 0 HD12 ILE A 44 9.171 4.252 1.678 1.00 34.05 H new ATOM 0 HD13 ILE A 44 7.835 5.355 2.084 1.00 34.05 H new ATOM 731 N GLU A 45 11.173 8.183 -1.984 1.00 43.23 N ATOM 732 CA GLU A 45 11.983 9.396 -2.224 1.00 1.11 C ATOM 733 C GLU A 45 11.670 9.986 -3.609 1.00 44.31 C ATOM 734 O GLU A 45 11.515 11.202 -3.742 1.00 54.11 O ATOM 735 CB GLU A 45 13.500 9.085 -2.124 1.00 73.41 C ATOM 736 CG GLU A 45 13.968 8.582 -0.750 1.00 4.21 C ATOM 737 CD GLU A 45 15.474 8.274 -0.726 1.00 75.51 C ATOM 738 OE1 GLU A 45 16.273 9.185 -0.435 1.00 21.40 O ATOM 739 OE2 GLU A 45 15.868 7.137 -1.041 1.00 74.45 O ATOM 0 H GLU A 45 11.731 7.338 -1.861 1.00 43.23 H new ATOM 0 HA GLU A 45 11.725 10.124 -1.455 1.00 1.11 H new ATOM 0 HB2 GLU A 45 13.753 8.336 -2.874 1.00 73.41 H new ATOM 0 HB3 GLU A 45 14.058 9.987 -2.374 1.00 73.41 H new ATOM 0 HG2 GLU A 45 13.740 9.333 0.007 1.00 4.21 H new ATOM 0 HG3 GLU A 45 13.411 7.683 -0.485 1.00 4.21 H new ATOM 746 N LYS A 46 11.568 9.097 -4.628 1.00 35.51 N ATOM 747 CA LYS A 46 11.265 9.490 -6.021 1.00 73.54 C ATOM 748 C LYS A 46 9.928 10.250 -6.085 1.00 51.53 C ATOM 749 O LYS A 46 9.871 11.372 -6.600 1.00 73.13 O ATOM 750 CB LYS A 46 11.227 8.240 -6.951 1.00 73.31 C ATOM 751 CG LYS A 46 12.566 7.478 -7.060 1.00 2.11 C ATOM 752 CD LYS A 46 12.470 6.215 -7.952 1.00 30.54 C ATOM 753 CE LYS A 46 12.304 6.531 -9.448 1.00 20.02 C ATOM 754 NZ LYS A 46 13.521 7.179 -10.012 1.00 12.43 N ATOM 0 H LYS A 46 11.693 8.092 -4.505 1.00 35.51 H new ATOM 0 HA LYS A 46 12.058 10.151 -6.371 1.00 73.54 H new ATOM 0 HB2 LYS A 46 10.463 7.554 -6.585 1.00 73.31 H new ATOM 0 HB3 LYS A 46 10.921 8.555 -7.949 1.00 73.31 H new ATOM 0 HG2 LYS A 46 13.326 8.146 -7.465 1.00 2.11 H new ATOM 0 HG3 LYS A 46 12.895 7.188 -6.062 1.00 2.11 H new ATOM 0 HD2 LYS A 46 13.368 5.613 -7.814 1.00 30.54 H new ATOM 0 HD3 LYS A 46 11.626 5.609 -7.621 1.00 30.54 H new ATOM 0 HE2 LYS A 46 12.096 5.611 -9.994 1.00 20.02 H new ATOM 0 HE3 LYS A 46 11.444 7.186 -9.588 1.00 20.02 H new ATOM 0 HZ1 LYS A 46 13.427 7.254 -11.045 1.00 12.43 H new ATOM 0 HZ2 LYS A 46 13.629 8.130 -9.604 1.00 12.43 H new ATOM 0 HZ3 LYS A 46 14.358 6.606 -9.781 1.00 12.43 H new ATOM 768 N ALA A 47 8.874 9.642 -5.503 1.00 45.55 N ATOM 769 CA ALA A 47 7.521 10.228 -5.464 1.00 52.11 C ATOM 770 C ALA A 47 7.468 11.490 -4.580 1.00 33.44 C ATOM 771 O ALA A 47 6.674 12.386 -4.840 1.00 50.32 O ATOM 772 CB ALA A 47 6.505 9.181 -4.982 1.00 1.14 C ATOM 0 H ALA A 47 8.938 8.732 -5.047 1.00 45.55 H new ATOM 0 HA ALA A 47 7.260 10.534 -6.477 1.00 52.11 H new ATOM 0 HB1 ALA A 47 5.510 9.624 -4.957 1.00 1.14 H new ATOM 0 HB2 ALA A 47 6.507 8.331 -5.665 1.00 1.14 H new ATOM 0 HB3 ALA A 47 6.777 8.844 -3.982 1.00 1.14 H new ATOM 778 N ARG A 48 8.332 11.547 -3.549 1.00 13.34 N ATOM 779 CA ARG A 48 8.421 12.690 -2.616 1.00 63.14 C ATOM 780 C ARG A 48 8.970 13.949 -3.329 1.00 54.14 C ATOM 781 O ARG A 48 8.472 15.063 -3.112 1.00 63.52 O ATOM 782 CB ARG A 48 9.316 12.303 -1.403 1.00 74.54 C ATOM 783 CG ARG A 48 9.564 13.419 -0.367 1.00 34.33 C ATOM 784 CD ARG A 48 8.278 13.901 0.331 1.00 53.22 C ATOM 785 NE ARG A 48 8.565 14.969 1.306 1.00 0.40 N ATOM 786 CZ ARG A 48 8.720 14.800 2.631 1.00 4.44 C ATOM 787 NH1 ARG A 48 8.614 13.593 3.183 1.00 24.32 N ATOM 788 NH2 ARG A 48 9.019 15.838 3.394 1.00 41.20 N ATOM 0 H ARG A 48 8.992 10.799 -3.337 1.00 13.34 H new ATOM 0 HA ARG A 48 7.420 12.930 -2.256 1.00 63.14 H new ATOM 0 HB2 ARG A 48 8.857 11.456 -0.893 1.00 74.54 H new ATOM 0 HB3 ARG A 48 10.280 11.964 -1.781 1.00 74.54 H new ATOM 0 HG2 ARG A 48 10.264 13.057 0.386 1.00 34.33 H new ATOM 0 HG3 ARG A 48 10.039 14.266 -0.862 1.00 34.33 H new ATOM 0 HD2 ARG A 48 7.572 14.267 -0.415 1.00 53.22 H new ATOM 0 HD3 ARG A 48 7.800 13.062 0.837 1.00 53.22 H new ATOM 0 HE ARG A 48 8.654 15.918 0.944 1.00 0.40 H new ATOM 0 HH11 ARG A 48 8.413 12.781 2.599 1.00 24.32 H new ATOM 0 HH12 ARG A 48 8.734 13.480 4.190 1.00 24.32 H new ATOM 0 HH21 ARG A 48 9.131 16.762 2.977 1.00 41.20 H new ATOM 0 HH22 ARG A 48 9.137 15.715 4.400 1.00 41.20 H new ATOM 802 N LYS A 49 9.991 13.743 -4.186 1.00 12.20 N ATOM 803 CA LYS A 49 10.633 14.825 -4.969 1.00 53.22 C ATOM 804 C LYS A 49 9.695 15.313 -6.088 1.00 32.53 C ATOM 805 O LYS A 49 9.719 16.489 -6.471 1.00 62.34 O ATOM 806 CB LYS A 49 11.973 14.327 -5.575 1.00 43.22 C ATOM 807 CG LYS A 49 13.004 13.874 -4.525 1.00 3.33 C ATOM 808 CD LYS A 49 14.278 13.255 -5.143 1.00 75.23 C ATOM 809 CE LYS A 49 15.217 12.663 -4.075 1.00 63.33 C ATOM 810 NZ LYS A 49 15.563 13.652 -3.022 1.00 51.14 N ATOM 0 H LYS A 49 10.396 12.822 -4.356 1.00 12.20 H new ATOM 0 HA LYS A 49 10.837 15.660 -4.299 1.00 53.22 H new ATOM 0 HB2 LYS A 49 11.768 13.496 -6.250 1.00 43.22 H new ATOM 0 HB3 LYS A 49 12.408 15.126 -6.175 1.00 43.22 H new ATOM 0 HG2 LYS A 49 13.286 14.729 -3.911 1.00 3.33 H new ATOM 0 HG3 LYS A 49 12.539 13.144 -3.862 1.00 3.33 H new ATOM 0 HD2 LYS A 49 13.994 12.473 -5.848 1.00 75.23 H new ATOM 0 HD3 LYS A 49 14.812 14.018 -5.710 1.00 75.23 H new ATOM 0 HE2 LYS A 49 14.741 11.797 -3.615 1.00 63.33 H new ATOM 0 HE3 LYS A 49 16.130 12.309 -4.553 1.00 63.33 H new ATOM 0 HZ1 LYS A 49 16.311 13.263 -2.413 1.00 51.14 H new ATOM 0 HZ2 LYS A 49 15.900 14.529 -3.467 1.00 51.14 H new ATOM 0 HZ3 LYS A 49 14.720 13.857 -2.448 1.00 51.14 H new ATOM 824 N GLN A 50 8.881 14.378 -6.609 1.00 13.33 N ATOM 825 CA GLN A 50 7.845 14.674 -7.612 1.00 13.22 C ATOM 826 C GLN A 50 6.614 15.336 -6.950 1.00 30.10 C ATOM 827 O GLN A 50 5.893 16.110 -7.592 1.00 52.40 O ATOM 828 CB GLN A 50 7.434 13.364 -8.342 1.00 1.13 C ATOM 829 CG GLN A 50 8.562 12.680 -9.139 1.00 42.50 C ATOM 830 CD GLN A 50 9.042 13.490 -10.347 1.00 42.11 C ATOM 831 OE1 GLN A 50 9.948 14.319 -10.243 1.00 13.14 O ATOM 832 NE2 GLN A 50 8.445 13.248 -11.504 1.00 34.11 N ATOM 0 H GLN A 50 8.924 13.394 -6.345 1.00 13.33 H new ATOM 0 HA GLN A 50 8.251 15.375 -8.341 1.00 13.22 H new ATOM 0 HB2 GLN A 50 7.053 12.659 -7.603 1.00 1.13 H new ATOM 0 HB3 GLN A 50 6.613 13.588 -9.023 1.00 1.13 H new ATOM 0 HG2 GLN A 50 9.407 12.501 -8.474 1.00 42.50 H new ATOM 0 HG3 GLN A 50 8.213 11.706 -9.482 1.00 42.50 H new ATOM 0 HE21 GLN A 50 7.698 12.555 -11.557 1.00 34.11 H new ATOM 0 HE22 GLN A 50 8.732 13.754 -12.342 1.00 34.11 H new ATOM 841 N GLY A 51 6.407 15.034 -5.654 1.00 25.51 N ATOM 842 CA GLY A 51 5.241 15.511 -4.912 1.00 32.34 C ATOM 843 C GLY A 51 3.960 14.824 -5.373 1.00 44.52 C ATOM 844 O GLY A 51 2.926 15.467 -5.551 1.00 23.22 O ATOM 0 H GLY A 51 7.042 14.457 -5.102 1.00 25.51 H new ATOM 0 HA2 GLY A 51 5.388 15.330 -3.847 1.00 32.34 H new ATOM 0 HA3 GLY A 51 5.143 16.589 -5.042 1.00 32.34 H new ATOM 848 N ARG A 52 4.049 13.497 -5.576 1.00 51.23 N ATOM 849 CA ARG A 52 2.948 12.666 -6.095 1.00 43.25 C ATOM 850 C ARG A 52 2.515 11.620 -5.049 1.00 61.44 C ATOM 851 O ARG A 52 3.337 11.181 -4.229 1.00 73.15 O ATOM 852 CB ARG A 52 3.389 11.938 -7.403 1.00 34.35 C ATOM 853 CG ARG A 52 3.822 12.871 -8.558 1.00 72.11 C ATOM 854 CD ARG A 52 2.715 13.851 -8.983 1.00 12.01 C ATOM 855 NE ARG A 52 1.465 13.148 -9.333 1.00 15.12 N ATOM 856 CZ ARG A 52 0.226 13.619 -9.119 1.00 72.45 C ATOM 857 NH1 ARG A 52 0.036 14.802 -8.555 1.00 54.13 N ATOM 858 NH2 ARG A 52 -0.816 12.887 -9.445 1.00 42.31 N ATOM 0 H ARG A 52 4.898 12.966 -5.382 1.00 51.23 H new ATOM 0 HA ARG A 52 2.104 13.321 -6.312 1.00 43.25 H new ATOM 0 HB2 ARG A 52 4.217 11.269 -7.167 1.00 34.35 H new ATOM 0 HB3 ARG A 52 2.565 11.315 -7.749 1.00 34.35 H new ATOM 0 HG2 ARG A 52 4.702 13.436 -8.251 1.00 72.11 H new ATOM 0 HG3 ARG A 52 4.114 12.266 -9.417 1.00 72.11 H new ATOM 0 HD2 ARG A 52 2.522 14.554 -8.173 1.00 12.01 H new ATOM 0 HD3 ARG A 52 3.055 14.435 -9.838 1.00 12.01 H new ATOM 0 HE ARG A 52 1.549 12.231 -9.772 1.00 15.12 H new ATOM 0 HH11 ARG A 52 0.837 15.369 -8.277 1.00 54.13 H new ATOM 0 HH12 ARG A 52 -0.911 15.146 -8.399 1.00 54.13 H new ATOM 0 HH21 ARG A 52 -0.682 11.965 -9.859 1.00 42.31 H new ATOM 0 HH22 ARG A 52 -1.759 13.241 -9.284 1.00 42.31 H new ATOM 872 N PRO A 53 1.205 11.212 -5.050 1.00 44.12 N ATOM 873 CA PRO A 53 0.759 10.012 -4.315 1.00 61.03 C ATOM 874 C PRO A 53 1.297 8.734 -5.004 1.00 61.40 C ATOM 875 O PRO A 53 1.295 8.638 -6.237 1.00 44.25 O ATOM 876 CB PRO A 53 -0.790 10.107 -4.373 1.00 3.13 C ATOM 877 CG PRO A 53 -1.087 10.923 -5.603 1.00 22.21 C ATOM 878 CD PRO A 53 0.067 11.901 -5.738 1.00 43.05 C ATOM 0 HA PRO A 53 1.123 9.961 -3.289 1.00 61.03 H new ATOM 0 HB2 PRO A 53 -1.244 9.118 -4.437 1.00 3.13 H new ATOM 0 HB3 PRO A 53 -1.190 10.583 -3.478 1.00 3.13 H new ATOM 0 HG2 PRO A 53 -1.166 10.287 -6.485 1.00 22.21 H new ATOM 0 HG3 PRO A 53 -2.036 11.449 -5.504 1.00 22.21 H new ATOM 0 HD2 PRO A 53 0.297 12.106 -6.784 1.00 43.05 H new ATOM 0 HD3 PRO A 53 -0.163 12.858 -5.269 1.00 43.05 H new ATOM 886 N ILE A 54 1.785 7.785 -4.203 1.00 24.34 N ATOM 887 CA ILE A 54 2.353 6.524 -4.690 1.00 42.23 C ATOM 888 C ILE A 54 1.639 5.332 -4.022 1.00 51.00 C ATOM 889 O ILE A 54 1.280 5.388 -2.838 1.00 10.50 O ATOM 890 CB ILE A 54 3.916 6.480 -4.455 1.00 71.44 C ATOM 891 CG1 ILE A 54 4.561 5.227 -5.130 1.00 73.42 C ATOM 892 CG2 ILE A 54 4.280 6.560 -2.951 1.00 73.31 C ATOM 893 CD1 ILE A 54 6.085 5.225 -5.144 1.00 54.45 C ATOM 0 H ILE A 54 1.798 7.870 -3.187 1.00 24.34 H new ATOM 0 HA ILE A 54 2.191 6.455 -5.766 1.00 42.23 H new ATOM 0 HB ILE A 54 4.334 7.366 -4.933 1.00 71.44 H new ATOM 0 HG12 ILE A 54 4.215 4.333 -4.611 1.00 73.42 H new ATOM 0 HG13 ILE A 54 4.202 5.159 -6.157 1.00 73.42 H new ATOM 0 HG21 ILE A 54 5.363 6.526 -2.837 1.00 73.31 H new ATOM 0 HG22 ILE A 54 3.900 7.492 -2.534 1.00 73.31 H new ATOM 0 HG23 ILE A 54 3.833 5.717 -2.423 1.00 73.31 H new ATOM 0 HD11 ILE A 54 6.443 4.318 -5.632 1.00 54.45 H new ATOM 0 HD12 ILE A 54 6.445 6.097 -5.690 1.00 54.45 H new ATOM 0 HD13 ILE A 54 6.458 5.258 -4.120 1.00 54.45 H new ATOM 905 N VAL A 55 1.393 4.278 -4.815 1.00 32.10 N ATOM 906 CA VAL A 55 0.810 3.020 -4.353 1.00 65.13 C ATOM 907 C VAL A 55 1.834 1.912 -4.639 1.00 61.23 C ATOM 908 O VAL A 55 2.214 1.682 -5.794 1.00 41.40 O ATOM 909 CB VAL A 55 -0.561 2.687 -5.052 1.00 41.34 C ATOM 910 CG1 VAL A 55 -1.195 1.415 -4.442 1.00 54.22 C ATOM 911 CG2 VAL A 55 -1.546 3.876 -4.962 1.00 33.30 C ATOM 0 H VAL A 55 1.600 4.282 -5.814 1.00 32.10 H new ATOM 0 HA VAL A 55 0.591 3.101 -3.288 1.00 65.13 H new ATOM 0 HB VAL A 55 -0.354 2.501 -6.106 1.00 41.34 H new ATOM 0 HG11 VAL A 55 -2.141 1.205 -4.941 1.00 54.22 H new ATOM 0 HG12 VAL A 55 -0.519 0.571 -4.577 1.00 54.22 H new ATOM 0 HG13 VAL A 55 -1.373 1.571 -3.378 1.00 54.22 H new ATOM 0 HG21 VAL A 55 -2.482 3.611 -5.455 1.00 33.30 H new ATOM 0 HG22 VAL A 55 -1.740 4.109 -3.915 1.00 33.30 H new ATOM 0 HG23 VAL A 55 -1.111 4.747 -5.453 1.00 33.30 H new ATOM 921 N ILE A 56 2.286 1.266 -3.570 1.00 25.35 N ATOM 922 CA ILE A 56 3.300 0.214 -3.604 1.00 24.21 C ATOM 923 C ILE A 56 2.612 -1.152 -3.475 1.00 50.24 C ATOM 924 O ILE A 56 1.654 -1.297 -2.719 1.00 11.23 O ATOM 925 CB ILE A 56 4.326 0.396 -2.429 1.00 52.44 C ATOM 926 CG1 ILE A 56 5.003 1.805 -2.477 1.00 15.22 C ATOM 927 CG2 ILE A 56 5.394 -0.728 -2.440 1.00 73.24 C ATOM 928 CD1 ILE A 56 5.969 2.007 -3.629 1.00 54.32 C ATOM 0 H ILE A 56 1.949 1.464 -2.628 1.00 25.35 H new ATOM 0 HA ILE A 56 3.840 0.274 -4.549 1.00 24.21 H new ATOM 0 HB ILE A 56 3.769 0.325 -1.495 1.00 52.44 H new ATOM 0 HG12 ILE A 56 4.224 2.565 -2.537 1.00 15.22 H new ATOM 0 HG13 ILE A 56 5.537 1.968 -1.541 1.00 15.22 H new ATOM 0 HG21 ILE A 56 6.091 -0.576 -1.616 1.00 73.24 H new ATOM 0 HG22 ILE A 56 4.905 -1.696 -2.328 1.00 73.24 H new ATOM 0 HG23 ILE A 56 5.938 -0.704 -3.384 1.00 73.24 H new ATOM 0 HD11 ILE A 56 6.389 3.012 -3.580 1.00 54.32 H new ATOM 0 HD12 ILE A 56 6.773 1.274 -3.562 1.00 54.32 H new ATOM 0 HD13 ILE A 56 5.440 1.880 -4.574 1.00 54.32 H new ATOM 940 N PHE A 57 3.117 -2.137 -4.218 1.00 0.02 N ATOM 941 CA PHE A 57 2.628 -3.517 -4.213 1.00 55.34 C ATOM 942 C PHE A 57 3.829 -4.438 -3.949 1.00 22.03 C ATOM 943 O PHE A 57 4.674 -4.610 -4.828 1.00 62.33 O ATOM 944 CB PHE A 57 1.965 -3.848 -5.580 1.00 32.33 C ATOM 945 CG PHE A 57 0.806 -2.931 -5.963 1.00 2.44 C ATOM 946 CD1 PHE A 57 -0.477 -3.164 -5.472 1.00 62.30 C ATOM 947 CD2 PHE A 57 0.994 -1.836 -6.811 1.00 44.10 C ATOM 948 CE1 PHE A 57 -1.523 -2.329 -5.801 1.00 22.34 C ATOM 949 CE2 PHE A 57 -0.055 -1.005 -7.139 1.00 50.43 C ATOM 950 CZ PHE A 57 -1.316 -1.256 -6.638 1.00 13.31 C ATOM 0 H PHE A 57 3.899 -1.994 -4.857 1.00 0.02 H new ATOM 0 HA PHE A 57 1.876 -3.659 -3.437 1.00 55.34 H new ATOM 0 HB2 PHE A 57 2.725 -3.796 -6.360 1.00 32.33 H new ATOM 0 HB3 PHE A 57 1.604 -4.876 -5.554 1.00 32.33 H new ATOM 0 HD1 PHE A 57 -0.654 -4.010 -4.825 1.00 62.30 H new ATOM 0 HD2 PHE A 57 1.976 -1.638 -7.215 1.00 44.10 H new ATOM 0 HE1 PHE A 57 -2.508 -2.517 -5.401 1.00 22.34 H new ATOM 0 HE2 PHE A 57 0.110 -0.158 -7.788 1.00 50.43 H new ATOM 0 HZ PHE A 57 -2.141 -0.611 -6.903 1.00 13.31 H new ATOM 960 N ILE A 58 3.938 -4.986 -2.728 1.00 34.32 N ATOM 961 CA ILE A 58 5.104 -5.798 -2.319 1.00 22.41 C ATOM 962 C ILE A 58 4.734 -7.290 -2.333 1.00 43.24 C ATOM 963 O ILE A 58 3.766 -7.698 -1.663 1.00 51.24 O ATOM 964 CB ILE A 58 5.620 -5.409 -0.888 1.00 72.25 C ATOM 965 CG1 ILE A 58 5.641 -3.861 -0.698 1.00 2.01 C ATOM 966 CG2 ILE A 58 7.029 -6.018 -0.634 1.00 1.20 C ATOM 967 CD1 ILE A 58 5.809 -3.400 0.739 1.00 11.44 C ATOM 0 H ILE A 58 3.230 -4.883 -2.001 1.00 34.32 H new ATOM 0 HA ILE A 58 5.903 -5.600 -3.033 1.00 22.41 H new ATOM 0 HB ILE A 58 4.928 -5.823 -0.154 1.00 72.25 H new ATOM 0 HG12 ILE A 58 6.453 -3.446 -1.295 1.00 2.01 H new ATOM 0 HG13 ILE A 58 4.712 -3.448 -1.092 1.00 2.01 H new ATOM 0 HG21 ILE A 58 7.372 -5.739 0.362 1.00 1.20 H new ATOM 0 HG22 ILE A 58 6.975 -7.104 -0.708 1.00 1.20 H new ATOM 0 HG23 ILE A 58 7.729 -5.638 -1.378 1.00 1.20 H new ATOM 0 HD11 ILE A 58 5.812 -2.311 0.774 1.00 11.44 H new ATOM 0 HD12 ILE A 58 4.984 -3.780 1.342 1.00 11.44 H new ATOM 0 HD13 ILE A 58 6.752 -3.778 1.135 1.00 11.44 H new ATOM 979 N ARG A 59 5.488 -8.093 -3.108 1.00 24.05 N ATOM 980 CA ARG A 59 5.268 -9.541 -3.205 1.00 21.25 C ATOM 981 C ARG A 59 5.839 -10.236 -1.953 1.00 73.30 C ATOM 982 O ARG A 59 7.062 -10.317 -1.780 1.00 73.25 O ATOM 983 CB ARG A 59 5.916 -10.114 -4.500 1.00 20.34 C ATOM 984 CG ARG A 59 5.538 -11.586 -4.795 1.00 33.10 C ATOM 985 CD ARG A 59 6.326 -12.193 -5.971 1.00 12.50 C ATOM 986 NE ARG A 59 7.760 -12.361 -5.664 1.00 14.34 N ATOM 987 CZ ARG A 59 8.784 -11.996 -6.457 1.00 40.11 C ATOM 988 NH1 ARG A 59 8.572 -11.421 -7.645 1.00 2.25 N ATOM 989 NH2 ARG A 59 10.022 -12.216 -6.049 1.00 24.44 N ATOM 0 H ARG A 59 6.262 -7.754 -3.680 1.00 24.05 H new ATOM 0 HA ARG A 59 4.196 -9.733 -3.258 1.00 21.25 H new ATOM 0 HB2 ARG A 59 5.618 -9.496 -5.347 1.00 20.34 H new ATOM 0 HB3 ARG A 59 7.000 -10.038 -4.416 1.00 20.34 H new ATOM 0 HG2 ARG A 59 5.713 -12.185 -3.901 1.00 33.10 H new ATOM 0 HG3 ARG A 59 4.472 -11.643 -5.013 1.00 33.10 H new ATOM 0 HD2 ARG A 59 5.897 -13.161 -6.230 1.00 12.50 H new ATOM 0 HD3 ARG A 59 6.218 -11.552 -6.846 1.00 12.50 H new ATOM 0 HE ARG A 59 7.996 -12.793 -4.770 1.00 14.34 H new ATOM 0 HH11 ARG A 59 7.619 -11.251 -7.966 1.00 2.25 H new ATOM 0 HH12 ARG A 59 9.363 -11.152 -8.230 1.00 2.25 H new ATOM 0 HH21 ARG A 59 10.190 -12.657 -5.145 1.00 24.44 H new ATOM 0 HH22 ARG A 59 10.809 -11.945 -6.639 1.00 24.44 H new ATOM 1003 N GLY A 60 4.928 -10.702 -1.078 1.00 50.24 N ATOM 1004 CA GLY A 60 5.296 -11.444 0.126 1.00 51.13 C ATOM 1005 C GLY A 60 5.888 -10.570 1.220 1.00 64.41 C ATOM 1006 O GLY A 60 6.889 -10.946 1.849 1.00 62.25 O ATOM 0 H GLY A 60 3.923 -10.572 -1.192 1.00 50.24 H new ATOM 0 HA2 GLY A 60 4.413 -11.951 0.515 1.00 51.13 H new ATOM 0 HA3 GLY A 60 6.016 -12.218 -0.140 1.00 51.13 H new ATOM 1010 N ALA A 61 5.264 -9.401 1.450 1.00 3.35 N ATOM 1011 CA ALA A 61 5.696 -8.460 2.495 1.00 61.45 C ATOM 1012 C ALA A 61 5.410 -9.026 3.900 1.00 12.54 C ATOM 1013 O ALA A 61 4.245 -9.162 4.294 1.00 44.33 O ATOM 1014 CB ALA A 61 5.005 -7.103 2.315 1.00 50.23 C ATOM 0 H ALA A 61 4.452 -9.085 0.920 1.00 3.35 H new ATOM 0 HA ALA A 61 6.772 -8.319 2.398 1.00 61.45 H new ATOM 0 HB1 ALA A 61 5.336 -6.419 3.097 1.00 50.23 H new ATOM 0 HB2 ALA A 61 5.262 -6.690 1.339 1.00 50.23 H new ATOM 0 HB3 ALA A 61 3.925 -7.233 2.381 1.00 50.23 H new ATOM 1020 N THR A 62 6.479 -9.365 4.631 1.00 21.41 N ATOM 1021 CA THR A 62 6.390 -9.892 6.006 1.00 64.32 C ATOM 1022 C THR A 62 6.191 -8.750 7.017 1.00 2.21 C ATOM 1023 O THR A 62 6.261 -7.576 6.643 1.00 32.11 O ATOM 1024 CB THR A 62 7.678 -10.704 6.361 1.00 42.10 C ATOM 1025 OG1 THR A 62 8.834 -9.861 6.240 1.00 33.30 O ATOM 1026 CG2 THR A 62 7.847 -11.927 5.445 1.00 61.41 C ATOM 0 H THR A 62 7.436 -9.283 4.287 1.00 21.41 H new ATOM 0 HA THR A 62 5.527 -10.556 6.061 1.00 64.32 H new ATOM 0 HB THR A 62 7.575 -11.056 7.387 1.00 42.10 H new ATOM 0 HG1 THR A 62 9.645 -10.407 6.308 1.00 33.30 H new ATOM 0 HG21 THR A 62 8.753 -12.467 5.722 1.00 61.41 H new ATOM 0 HG22 THR A 62 6.985 -12.585 5.554 1.00 61.41 H new ATOM 0 HG23 THR A 62 7.923 -11.598 4.409 1.00 61.41 H new ATOM 1034 N GLU A 63 5.950 -9.118 8.293 1.00 51.25 N ATOM 1035 CA GLU A 63 5.752 -8.167 9.411 1.00 64.22 C ATOM 1036 C GLU A 63 6.838 -7.077 9.431 1.00 42.45 C ATOM 1037 O GLU A 63 6.519 -5.878 9.484 1.00 52.41 O ATOM 1038 CB GLU A 63 5.772 -8.929 10.759 1.00 50.25 C ATOM 1039 CG GLU A 63 4.689 -10.017 10.914 1.00 72.32 C ATOM 1040 CD GLU A 63 4.859 -10.836 12.202 1.00 32.20 C ATOM 1041 OE1 GLU A 63 5.304 -12.003 12.139 1.00 63.42 O ATOM 1042 OE2 GLU A 63 4.581 -10.295 13.291 1.00 4.30 O ATOM 0 H GLU A 63 5.886 -10.095 8.581 1.00 51.25 H new ATOM 0 HA GLU A 63 4.786 -7.684 9.265 1.00 64.22 H new ATOM 0 HB2 GLU A 63 6.751 -9.393 10.881 1.00 50.25 H new ATOM 0 HB3 GLU A 63 5.658 -8.207 11.568 1.00 50.25 H new ATOM 0 HG2 GLU A 63 3.705 -9.548 10.912 1.00 72.32 H new ATOM 0 HG3 GLU A 63 4.725 -10.686 10.054 1.00 72.32 H new ATOM 1049 N GLU A 64 8.119 -7.521 9.343 1.00 15.12 N ATOM 1050 CA GLU A 64 9.283 -6.629 9.375 1.00 62.53 C ATOM 1051 C GLU A 64 9.256 -5.659 8.184 1.00 35.54 C ATOM 1052 O GLU A 64 9.450 -4.474 8.373 1.00 41.54 O ATOM 1053 CB GLU A 64 10.627 -7.423 9.407 1.00 62.22 C ATOM 1054 CG GLU A 64 10.923 -8.286 8.155 1.00 3.33 C ATOM 1055 CD GLU A 64 12.343 -8.875 8.128 1.00 23.34 C ATOM 1056 OE1 GLU A 64 13.311 -8.100 7.951 1.00 62.33 O ATOM 1057 OE2 GLU A 64 12.500 -10.106 8.271 1.00 41.15 O ATOM 0 H GLU A 64 8.362 -8.507 9.248 1.00 15.12 H new ATOM 0 HA GLU A 64 9.224 -6.052 10.298 1.00 62.53 H new ATOM 0 HB2 GLU A 64 11.444 -6.714 9.539 1.00 62.22 H new ATOM 0 HB3 GLU A 64 10.624 -8.073 10.282 1.00 62.22 H new ATOM 0 HG2 GLU A 64 10.201 -9.101 8.108 1.00 3.33 H new ATOM 0 HG3 GLU A 64 10.775 -7.678 7.263 1.00 3.33 H new ATOM 1064 N VAL A 65 8.963 -6.190 6.975 1.00 41.44 N ATOM 1065 CA VAL A 65 8.934 -5.420 5.716 1.00 21.14 C ATOM 1066 C VAL A 65 7.921 -4.266 5.801 1.00 4.14 C ATOM 1067 O VAL A 65 8.295 -3.094 5.659 1.00 11.41 O ATOM 1068 CB VAL A 65 8.588 -6.379 4.504 1.00 53.01 C ATOM 1069 CG1 VAL A 65 8.266 -5.610 3.200 1.00 52.35 C ATOM 1070 CG2 VAL A 65 9.737 -7.391 4.269 1.00 14.45 C ATOM 0 H VAL A 65 8.738 -7.177 6.848 1.00 41.44 H new ATOM 0 HA VAL A 65 9.920 -4.987 5.552 1.00 21.14 H new ATOM 0 HB VAL A 65 7.683 -6.920 4.780 1.00 53.01 H new ATOM 0 HG11 VAL A 65 8.037 -6.320 2.406 1.00 52.35 H new ATOM 0 HG12 VAL A 65 7.407 -4.960 3.364 1.00 52.35 H new ATOM 0 HG13 VAL A 65 9.127 -5.008 2.911 1.00 52.35 H new ATOM 0 HG21 VAL A 65 9.483 -8.042 3.433 1.00 14.45 H new ATOM 0 HG22 VAL A 65 10.656 -6.851 4.042 1.00 14.45 H new ATOM 0 HG23 VAL A 65 9.881 -7.993 5.166 1.00 14.45 H new ATOM 1080 N VAL A 66 6.659 -4.626 6.110 1.00 13.13 N ATOM 1081 CA VAL A 66 5.532 -3.687 6.105 1.00 53.41 C ATOM 1082 C VAL A 66 5.789 -2.555 7.104 1.00 14.01 C ATOM 1083 O VAL A 66 5.895 -1.404 6.699 1.00 4.22 O ATOM 1084 CB VAL A 66 4.158 -4.386 6.433 1.00 54.50 C ATOM 1085 CG1 VAL A 66 2.972 -3.410 6.229 1.00 13.11 C ATOM 1086 CG2 VAL A 66 3.967 -5.666 5.591 1.00 11.34 C ATOM 0 H VAL A 66 6.398 -5.577 6.369 1.00 13.13 H new ATOM 0 HA VAL A 66 5.457 -3.284 5.095 1.00 53.41 H new ATOM 0 HB VAL A 66 4.179 -4.676 7.484 1.00 54.50 H new ATOM 0 HG11 VAL A 66 2.037 -3.920 6.463 1.00 13.11 H new ATOM 0 HG12 VAL A 66 3.091 -2.550 6.888 1.00 13.11 H new ATOM 0 HG13 VAL A 66 2.952 -3.073 5.193 1.00 13.11 H new ATOM 0 HG21 VAL A 66 3.010 -6.126 5.840 1.00 11.34 H new ATOM 0 HG22 VAL A 66 3.982 -5.410 4.532 1.00 11.34 H new ATOM 0 HG23 VAL A 66 4.773 -6.367 5.807 1.00 11.34 H new ATOM 1096 N ARG A 67 5.985 -2.921 8.393 1.00 43.21 N ATOM 1097 CA ARG A 67 6.103 -1.945 9.497 1.00 64.44 C ATOM 1098 C ARG A 67 7.317 -1.008 9.310 1.00 3.11 C ATOM 1099 O ARG A 67 7.268 0.145 9.716 1.00 73.22 O ATOM 1100 CB ARG A 67 6.198 -2.669 10.873 1.00 54.12 C ATOM 1101 CG ARG A 67 7.556 -3.355 11.150 1.00 13.33 C ATOM 1102 CD ARG A 67 7.603 -4.090 12.493 1.00 71.10 C ATOM 1103 NE ARG A 67 7.323 -3.205 13.643 1.00 62.15 N ATOM 1104 CZ ARG A 67 7.705 -3.438 14.911 1.00 0.34 C ATOM 1105 NH1 ARG A 67 8.396 -4.535 15.234 1.00 64.51 N ATOM 1106 NH2 ARG A 67 7.364 -2.584 15.863 1.00 73.40 N ATOM 0 H ARG A 67 6.065 -3.893 8.693 1.00 43.21 H new ATOM 0 HA ARG A 67 5.200 -1.335 9.479 1.00 64.44 H new ATOM 0 HB2 ARG A 67 6.005 -1.944 11.664 1.00 54.12 H new ATOM 0 HB3 ARG A 67 5.409 -3.419 10.929 1.00 54.12 H new ATOM 0 HG2 ARG A 67 7.767 -4.063 10.349 1.00 13.33 H new ATOM 0 HG3 ARG A 67 8.346 -2.604 11.127 1.00 13.33 H new ATOM 0 HD2 ARG A 67 6.877 -4.903 12.482 1.00 71.10 H new ATOM 0 HD3 ARG A 67 8.587 -4.542 12.620 1.00 71.10 H new ATOM 0 HE ARG A 67 6.798 -2.350 13.460 1.00 62.15 H new ATOM 0 HH11 ARG A 67 8.643 -5.213 14.513 1.00 64.51 H new ATOM 0 HH12 ARG A 67 8.677 -4.694 16.202 1.00 64.51 H new ATOM 0 HH21 ARG A 67 6.815 -1.756 15.632 1.00 73.40 H new ATOM 0 HH22 ARG A 67 7.650 -2.754 16.827 1.00 73.40 H new ATOM 1120 N ASP A 68 8.390 -1.543 8.687 1.00 63.02 N ATOM 1121 CA ASP A 68 9.665 -0.831 8.460 1.00 12.02 C ATOM 1122 C ASP A 68 9.477 0.308 7.450 1.00 2.24 C ATOM 1123 O ASP A 68 9.969 1.421 7.650 1.00 30.32 O ATOM 1124 CB ASP A 68 10.717 -1.857 7.961 1.00 71.15 C ATOM 1125 CG ASP A 68 12.094 -1.294 7.605 1.00 62.42 C ATOM 1126 OD1 ASP A 68 12.708 -0.606 8.448 1.00 44.43 O ATOM 1127 OD2 ASP A 68 12.593 -1.575 6.494 1.00 44.11 O ATOM 0 H ASP A 68 8.394 -2.496 8.323 1.00 63.02 H new ATOM 0 HA ASP A 68 10.011 -0.380 9.390 1.00 12.02 H new ATOM 0 HB2 ASP A 68 10.846 -2.617 8.731 1.00 71.15 H new ATOM 0 HB3 ASP A 68 10.315 -2.360 7.082 1.00 71.15 H new ATOM 1132 N ILE A 69 8.739 0.003 6.374 1.00 14.03 N ATOM 1133 CA ILE A 69 8.413 0.972 5.313 1.00 11.22 C ATOM 1134 C ILE A 69 7.342 1.981 5.791 1.00 13.41 C ATOM 1135 O ILE A 69 7.412 3.176 5.466 1.00 50.05 O ATOM 1136 CB ILE A 69 7.903 0.222 4.040 1.00 75.25 C ATOM 1137 CG1 ILE A 69 8.966 -0.810 3.544 1.00 74.34 C ATOM 1138 CG2 ILE A 69 7.532 1.216 2.924 1.00 64.11 C ATOM 1139 CD1 ILE A 69 8.439 -1.794 2.520 1.00 5.53 C ATOM 0 H ILE A 69 8.349 -0.925 6.212 1.00 14.03 H new ATOM 0 HA ILE A 69 9.320 1.524 5.069 1.00 11.22 H new ATOM 0 HB ILE A 69 7.000 -0.326 4.309 1.00 75.25 H new ATOM 0 HG12 ILE A 69 9.809 -0.269 3.113 1.00 74.34 H new ATOM 0 HG13 ILE A 69 9.348 -1.364 4.402 1.00 74.34 H new ATOM 0 HG21 ILE A 69 7.180 0.667 2.050 1.00 64.11 H new ATOM 0 HG22 ILE A 69 6.744 1.881 3.276 1.00 64.11 H new ATOM 0 HG23 ILE A 69 8.409 1.804 2.654 1.00 64.11 H new ATOM 0 HD11 ILE A 69 9.237 -2.476 2.226 1.00 5.53 H new ATOM 0 HD12 ILE A 69 7.616 -2.363 2.952 1.00 5.53 H new ATOM 0 HD13 ILE A 69 8.084 -1.252 1.643 1.00 5.53 H new ATOM 1151 N VAL A 70 6.350 1.469 6.553 1.00 74.32 N ATOM 1152 CA VAL A 70 5.260 2.278 7.121 1.00 21.22 C ATOM 1153 C VAL A 70 5.852 3.381 8.018 1.00 44.51 C ATOM 1154 O VAL A 70 5.630 4.560 7.747 1.00 63.55 O ATOM 1155 CB VAL A 70 4.212 1.383 7.911 1.00 1.24 C ATOM 1156 CG1 VAL A 70 3.212 2.230 8.734 1.00 3.14 C ATOM 1157 CG2 VAL A 70 3.434 0.450 6.941 1.00 41.33 C ATOM 0 H VAL A 70 6.287 0.479 6.789 1.00 74.32 H new ATOM 0 HA VAL A 70 4.712 2.746 6.303 1.00 21.22 H new ATOM 0 HB VAL A 70 4.789 0.778 8.610 1.00 1.24 H new ATOM 0 HG11 VAL A 70 2.518 1.570 9.254 1.00 3.14 H new ATOM 0 HG12 VAL A 70 3.757 2.830 9.462 1.00 3.14 H new ATOM 0 HG13 VAL A 70 2.656 2.887 8.066 1.00 3.14 H new ATOM 0 HG21 VAL A 70 2.723 -0.152 7.507 1.00 41.33 H new ATOM 0 HG22 VAL A 70 2.897 1.053 6.209 1.00 41.33 H new ATOM 0 HG23 VAL A 70 4.136 -0.206 6.426 1.00 41.33 H new ATOM 1167 N GLU A 71 6.678 2.984 9.020 1.00 40.13 N ATOM 1168 CA GLU A 71 7.269 3.932 9.988 1.00 13.53 C ATOM 1169 C GLU A 71 8.233 4.902 9.291 1.00 44.31 C ATOM 1170 O GLU A 71 8.334 6.055 9.697 1.00 35.30 O ATOM 1171 CB GLU A 71 7.952 3.187 11.184 1.00 61.01 C ATOM 1172 CG GLU A 71 9.222 2.342 10.861 1.00 23.44 C ATOM 1173 CD GLU A 71 10.565 3.099 11.000 1.00 3.42 C ATOM 1174 OE1 GLU A 71 11.001 3.343 12.144 1.00 13.24 O ATOM 1175 OE2 GLU A 71 11.201 3.425 9.980 1.00 12.43 O ATOM 0 H GLU A 71 6.947 2.012 9.175 1.00 40.13 H new ATOM 0 HA GLU A 71 6.457 4.525 10.410 1.00 13.53 H new ATOM 0 HB2 GLU A 71 8.221 3.929 11.936 1.00 61.01 H new ATOM 0 HB3 GLU A 71 7.213 2.527 11.638 1.00 61.01 H new ATOM 0 HG2 GLU A 71 9.241 1.475 11.522 1.00 23.44 H new ATOM 0 HG3 GLU A 71 9.139 1.964 9.842 1.00 23.44 H new ATOM 1182 N TYR A 72 8.918 4.417 8.226 1.00 74.01 N ATOM 1183 CA TYR A 72 9.804 5.245 7.384 1.00 62.43 C ATOM 1184 C TYR A 72 9.025 6.440 6.814 1.00 52.22 C ATOM 1185 O TYR A 72 9.416 7.593 7.009 1.00 20.11 O ATOM 1186 CB TYR A 72 10.416 4.384 6.235 1.00 30.02 C ATOM 1187 CG TYR A 72 11.279 5.166 5.222 1.00 41.21 C ATOM 1188 CD1 TYR A 72 12.595 5.533 5.525 1.00 33.32 C ATOM 1189 CD2 TYR A 72 10.777 5.538 3.963 1.00 10.25 C ATOM 1190 CE1 TYR A 72 13.372 6.234 4.620 1.00 52.02 C ATOM 1191 CE2 TYR A 72 11.554 6.241 3.062 1.00 21.10 C ATOM 1192 CZ TYR A 72 12.847 6.586 3.393 1.00 65.34 C ATOM 1193 OH TYR A 72 13.626 7.272 2.486 1.00 32.21 O ATOM 0 H TYR A 72 8.869 3.442 7.931 1.00 74.01 H new ATOM 0 HA TYR A 72 10.620 5.627 7.997 1.00 62.43 H new ATOM 0 HB2 TYR A 72 11.026 3.596 6.677 1.00 30.02 H new ATOM 0 HB3 TYR A 72 9.605 3.895 5.696 1.00 30.02 H new ATOM 0 HD1 TYR A 72 13.012 5.264 6.484 1.00 33.32 H new ATOM 0 HD2 TYR A 72 9.766 5.270 3.695 1.00 10.25 H new ATOM 0 HE1 TYR A 72 14.386 6.505 4.873 1.00 52.02 H new ATOM 0 HE2 TYR A 72 11.149 6.520 2.100 1.00 21.10 H new ATOM 0 HH TYR A 72 13.107 7.442 1.672 1.00 32.21 H new ATOM 1203 N ALA A 73 7.895 6.135 6.153 1.00 21.45 N ATOM 1204 CA ALA A 73 7.040 7.138 5.512 1.00 72.40 C ATOM 1205 C ALA A 73 6.400 8.074 6.558 1.00 30.33 C ATOM 1206 O ALA A 73 6.258 9.269 6.311 1.00 51.24 O ATOM 1207 CB ALA A 73 5.978 6.447 4.648 1.00 25.15 C ATOM 0 H ALA A 73 7.551 5.180 6.050 1.00 21.45 H new ATOM 0 HA ALA A 73 7.656 7.759 4.863 1.00 72.40 H new ATOM 0 HB1 ALA A 73 5.347 7.200 4.176 1.00 25.15 H new ATOM 0 HB2 ALA A 73 6.467 5.849 3.879 1.00 25.15 H new ATOM 0 HB3 ALA A 73 5.364 5.800 5.274 1.00 25.15 H new ATOM 1213 N GLN A 74 6.054 7.520 7.744 1.00 72.33 N ATOM 1214 CA GLN A 74 5.485 8.299 8.870 1.00 71.14 C ATOM 1215 C GLN A 74 6.508 9.326 9.396 1.00 32.23 C ATOM 1216 O GLN A 74 6.150 10.459 9.737 1.00 5.51 O ATOM 1217 CB GLN A 74 5.038 7.362 10.026 1.00 15.22 C ATOM 1218 CG GLN A 74 3.946 6.356 9.637 1.00 54.13 C ATOM 1219 CD GLN A 74 3.503 5.472 10.797 1.00 74.35 C ATOM 1220 OE1 GLN A 74 4.093 4.426 11.065 1.00 33.45 O ATOM 1221 NE2 GLN A 74 2.459 5.870 11.484 1.00 23.33 N ATOM 0 H GLN A 74 6.161 6.526 7.947 1.00 72.33 H new ATOM 0 HA GLN A 74 4.611 8.831 8.495 1.00 71.14 H new ATOM 0 HB2 GLN A 74 5.907 6.814 10.391 1.00 15.22 H new ATOM 0 HB3 GLN A 74 4.676 7.972 10.853 1.00 15.22 H new ATOM 0 HG2 GLN A 74 3.082 6.898 9.251 1.00 54.13 H new ATOM 0 HG3 GLN A 74 4.314 5.725 8.828 1.00 54.13 H new ATOM 0 HE21 GLN A 74 1.990 6.742 11.239 1.00 23.33 H new ATOM 0 HE22 GLN A 74 2.117 5.308 12.263 1.00 23.33 H new ATOM 1230 N LYS A 75 7.784 8.908 9.439 1.00 30.52 N ATOM 1231 CA LYS A 75 8.908 9.758 9.869 1.00 35.15 C ATOM 1232 C LYS A 75 9.243 10.818 8.795 1.00 50.05 C ATOM 1233 O LYS A 75 9.796 11.877 9.117 1.00 12.23 O ATOM 1234 CB LYS A 75 10.136 8.870 10.194 1.00 41.34 C ATOM 1235 CG LYS A 75 9.991 8.001 11.473 1.00 1.54 C ATOM 1236 CD LYS A 75 11.030 6.852 11.534 1.00 63.23 C ATOM 1237 CE LYS A 75 12.492 7.329 11.456 1.00 70.52 C ATOM 1238 NZ LYS A 75 13.441 6.185 11.454 1.00 44.01 N ATOM 0 H LYS A 75 8.067 7.964 9.175 1.00 30.52 H new ATOM 0 HA LYS A 75 8.622 10.297 10.772 1.00 35.15 H new ATOM 0 HB2 LYS A 75 10.327 8.213 9.345 1.00 41.34 H new ATOM 0 HB3 LYS A 75 11.011 9.511 10.304 1.00 41.34 H new ATOM 0 HG2 LYS A 75 10.103 8.635 12.353 1.00 1.54 H new ATOM 0 HG3 LYS A 75 8.986 7.580 11.510 1.00 1.54 H new ATOM 0 HD2 LYS A 75 10.888 6.296 12.461 1.00 63.23 H new ATOM 0 HD3 LYS A 75 10.840 6.159 10.714 1.00 63.23 H new ATOM 0 HE2 LYS A 75 12.634 7.922 10.553 1.00 70.52 H new ATOM 0 HE3 LYS A 75 12.708 7.981 12.303 1.00 70.52 H new ATOM 0 HZ1 LYS A 75 14.416 6.543 11.401 1.00 44.01 H new ATOM 0 HZ2 LYS A 75 13.322 5.634 12.328 1.00 44.01 H new ATOM 0 HZ3 LYS A 75 13.250 5.577 10.632 1.00 44.01 H new ATOM 1252 N GLU A 76 8.905 10.526 7.522 1.00 15.12 N ATOM 1253 CA GLU A 76 8.986 11.509 6.424 1.00 32.33 C ATOM 1254 C GLU A 76 7.807 12.509 6.496 1.00 50.40 C ATOM 1255 O GLU A 76 7.884 13.611 5.942 1.00 53.53 O ATOM 1256 CB GLU A 76 8.993 10.795 5.044 1.00 51.34 C ATOM 1257 CG GLU A 76 10.158 9.812 4.811 1.00 62.11 C ATOM 1258 CD GLU A 76 11.542 10.458 4.959 1.00 34.13 C ATOM 1259 OE1 GLU A 76 11.957 11.213 4.055 1.00 1.42 O ATOM 1260 OE2 GLU A 76 12.222 10.222 5.978 1.00 63.31 O ATOM 0 H GLU A 76 8.570 9.608 7.228 1.00 15.12 H new ATOM 0 HA GLU A 76 9.920 12.060 6.536 1.00 32.33 H new ATOM 0 HB2 GLU A 76 8.055 10.252 4.931 1.00 51.34 H new ATOM 0 HB3 GLU A 76 9.019 11.554 4.262 1.00 51.34 H new ATOM 0 HG2 GLU A 76 10.073 8.987 5.518 1.00 62.11 H new ATOM 0 HG3 GLU A 76 10.069 9.386 3.812 1.00 62.11 H new ATOM 1267 N GLY A 77 6.717 12.104 7.176 1.00 33.32 N ATOM 1268 CA GLY A 77 5.513 12.937 7.315 1.00 70.04 C ATOM 1269 C GLY A 77 4.508 12.681 6.207 1.00 52.34 C ATOM 1270 O GLY A 77 3.821 13.598 5.748 1.00 21.32 O ATOM 0 H GLY A 77 6.649 11.198 7.640 1.00 33.32 H new ATOM 0 HA2 GLY A 77 5.046 12.739 8.280 1.00 70.04 H new ATOM 0 HA3 GLY A 77 5.798 13.989 7.309 1.00 70.04 H new ATOM 1274 N LEU A 78 4.428 11.415 5.786 1.00 4.45 N ATOM 1275 CA LEU A 78 3.599 10.973 4.652 1.00 44.05 C ATOM 1276 C LEU A 78 2.452 10.092 5.172 1.00 30.03 C ATOM 1277 O LEU A 78 2.665 9.250 6.057 1.00 20.44 O ATOM 1278 CB LEU A 78 4.480 10.195 3.629 1.00 11.21 C ATOM 1279 CG LEU A 78 5.791 10.918 3.168 1.00 40.44 C ATOM 1280 CD1 LEU A 78 6.599 10.051 2.188 1.00 1.34 C ATOM 1281 CD2 LEU A 78 5.501 12.305 2.566 1.00 11.14 C ATOM 0 H LEU A 78 4.944 10.654 6.228 1.00 4.45 H new ATOM 0 HA LEU A 78 3.171 11.838 4.146 1.00 44.05 H new ATOM 0 HB2 LEU A 78 4.752 9.236 4.069 1.00 11.21 H new ATOM 0 HB3 LEU A 78 3.876 9.981 2.747 1.00 11.21 H new ATOM 0 HG LEU A 78 6.399 11.069 4.060 1.00 40.44 H new ATOM 0 HD11 LEU A 78 7.502 10.584 1.889 1.00 1.34 H new ATOM 0 HD12 LEU A 78 6.874 9.114 2.673 1.00 1.34 H new ATOM 0 HD13 LEU A 78 5.994 9.839 1.306 1.00 1.34 H new ATOM 0 HD21 LEU A 78 6.437 12.772 2.259 1.00 11.14 H new ATOM 0 HD22 LEU A 78 4.849 12.196 1.699 1.00 11.14 H new ATOM 0 HD23 LEU A 78 5.011 12.930 3.312 1.00 11.14 H new ATOM 1293 N ARG A 79 1.240 10.301 4.627 1.00 34.12 N ATOM 1294 CA ARG A 79 0.043 9.543 5.012 1.00 70.02 C ATOM 1295 C ARG A 79 0.120 8.109 4.460 1.00 13.54 C ATOM 1296 O ARG A 79 0.114 7.901 3.243 1.00 52.13 O ATOM 1297 CB ARG A 79 -1.231 10.261 4.499 1.00 23.34 C ATOM 1298 CG ARG A 79 -2.575 9.517 4.724 1.00 62.44 C ATOM 1299 CD ARG A 79 -2.936 9.268 6.210 1.00 2.15 C ATOM 1300 NE ARG A 79 -2.266 8.084 6.798 1.00 22.32 N ATOM 1301 CZ ARG A 79 -1.655 8.040 7.999 1.00 13.33 C ATOM 1302 NH1 ARG A 79 -1.604 9.112 8.783 1.00 73.02 N ATOM 1303 NH2 ARG A 79 -1.097 6.910 8.401 1.00 53.03 N ATOM 0 H ARG A 79 1.066 11.002 3.907 1.00 34.12 H new ATOM 0 HA ARG A 79 -0.006 9.489 6.100 1.00 70.02 H new ATOM 0 HB2 ARG A 79 -1.294 11.235 4.983 1.00 23.34 H new ATOM 0 HB3 ARG A 79 -1.115 10.443 3.431 1.00 23.34 H new ATOM 0 HG2 ARG A 79 -3.376 10.094 4.261 1.00 62.44 H new ATOM 0 HG3 ARG A 79 -2.534 8.558 4.208 1.00 62.44 H new ATOM 0 HD2 ARG A 79 -2.670 10.151 6.792 1.00 2.15 H new ATOM 0 HD3 ARG A 79 -4.015 9.143 6.296 1.00 2.15 H new ATOM 0 HE ARG A 79 -2.267 7.227 6.245 1.00 22.32 H new ATOM 0 HH11 ARG A 79 -2.032 9.987 8.479 1.00 73.02 H new ATOM 0 HH12 ARG A 79 -1.137 9.060 9.689 1.00 73.02 H new ATOM 0 HH21 ARG A 79 -1.132 6.084 7.804 1.00 53.03 H new ATOM 0 HH22 ARG A 79 -0.632 6.865 9.308 1.00 53.03 H new ATOM 1317 N VAL A 80 0.193 7.135 5.379 1.00 43.51 N ATOM 1318 CA VAL A 80 0.306 5.709 5.041 1.00 14.52 C ATOM 1319 C VAL A 80 -1.076 5.032 5.128 1.00 64.01 C ATOM 1320 O VAL A 80 -1.755 5.118 6.161 1.00 73.31 O ATOM 1321 CB VAL A 80 1.323 4.969 5.983 1.00 61.22 C ATOM 1322 CG1 VAL A 80 1.574 3.521 5.496 1.00 51.45 C ATOM 1323 CG2 VAL A 80 2.652 5.753 6.095 1.00 53.43 C ATOM 0 H VAL A 80 0.175 7.316 6.383 1.00 43.51 H new ATOM 0 HA VAL A 80 0.682 5.640 4.020 1.00 14.52 H new ATOM 0 HB VAL A 80 0.881 4.919 6.978 1.00 61.22 H new ATOM 0 HG11 VAL A 80 2.281 3.030 6.164 1.00 51.45 H new ATOM 0 HG12 VAL A 80 0.634 2.970 5.494 1.00 51.45 H new ATOM 0 HG13 VAL A 80 1.984 3.543 4.486 1.00 51.45 H new ATOM 0 HG21 VAL A 80 3.336 5.217 6.753 1.00 53.43 H new ATOM 0 HG22 VAL A 80 3.101 5.851 5.107 1.00 53.43 H new ATOM 0 HG23 VAL A 80 2.456 6.744 6.504 1.00 53.43 H new ATOM 1333 N LEU A 81 -1.492 4.403 4.016 1.00 12.42 N ATOM 1334 CA LEU A 81 -2.744 3.619 3.927 1.00 30.32 C ATOM 1335 C LEU A 81 -2.355 2.177 3.553 1.00 73.42 C ATOM 1336 O LEU A 81 -1.805 1.964 2.481 1.00 64.01 O ATOM 1337 CB LEU A 81 -3.713 4.180 2.833 1.00 51.44 C ATOM 1338 CG LEU A 81 -4.147 5.685 2.878 1.00 50.04 C ATOM 1339 CD1 LEU A 81 -4.743 6.086 4.227 1.00 60.12 C ATOM 1340 CD2 LEU A 81 -3.007 6.622 2.476 1.00 33.42 C ATOM 0 H LEU A 81 -0.966 4.422 3.142 1.00 12.42 H new ATOM 0 HA LEU A 81 -3.264 3.672 4.883 1.00 30.32 H new ATOM 0 HB2 LEU A 81 -3.246 4.005 1.864 1.00 51.44 H new ATOM 0 HB3 LEU A 81 -4.621 3.578 2.863 1.00 51.44 H new ATOM 0 HG LEU A 81 -4.939 5.792 2.137 1.00 50.04 H new ATOM 0 HD11 LEU A 81 -5.026 7.138 4.201 1.00 60.12 H new ATOM 0 HD12 LEU A 81 -5.625 5.478 4.430 1.00 60.12 H new ATOM 0 HD13 LEU A 81 -4.004 5.928 5.013 1.00 60.12 H new ATOM 0 HD21 LEU A 81 -3.352 7.655 2.521 1.00 33.42 H new ATOM 0 HD22 LEU A 81 -2.169 6.489 3.160 1.00 33.42 H new ATOM 0 HD23 LEU A 81 -2.687 6.391 1.460 1.00 33.42 H new ATOM 1352 N VAL A 82 -2.626 1.192 4.411 1.00 20.41 N ATOM 1353 CA VAL A 82 -2.154 -0.191 4.200 1.00 35.52 C ATOM 1354 C VAL A 82 -3.329 -1.126 3.861 1.00 23.03 C ATOM 1355 O VAL A 82 -4.297 -1.238 4.625 1.00 3.34 O ATOM 1356 CB VAL A 82 -1.372 -0.736 5.449 1.00 43.12 C ATOM 1357 CG1 VAL A 82 -0.765 -2.138 5.174 1.00 62.44 C ATOM 1358 CG2 VAL A 82 -0.279 0.262 5.903 1.00 1.00 C ATOM 0 H VAL A 82 -3.171 1.320 5.263 1.00 20.41 H new ATOM 0 HA VAL A 82 -1.465 -0.170 3.355 1.00 35.52 H new ATOM 0 HB VAL A 82 -2.090 -0.842 6.262 1.00 43.12 H new ATOM 0 HG11 VAL A 82 -0.231 -2.484 6.059 1.00 62.44 H new ATOM 0 HG12 VAL A 82 -1.564 -2.840 4.935 1.00 62.44 H new ATOM 0 HG13 VAL A 82 -0.073 -2.076 4.334 1.00 62.44 H new ATOM 0 HG21 VAL A 82 0.245 -0.142 6.769 1.00 1.00 H new ATOM 0 HG22 VAL A 82 0.430 0.420 5.090 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -0.742 1.212 6.170 1.00 1.00 H new ATOM 1368 N ILE A 83 -3.237 -1.783 2.690 1.00 72.05 N ATOM 1369 CA ILE A 83 -4.198 -2.802 2.242 1.00 35.11 C ATOM 1370 C ILE A 83 -3.486 -4.168 2.207 1.00 25.05 C ATOM 1371 O ILE A 83 -2.640 -4.414 1.346 1.00 60.21 O ATOM 1372 CB ILE A 83 -4.784 -2.468 0.817 1.00 14.25 C ATOM 1373 CG1 ILE A 83 -5.426 -1.053 0.804 1.00 1.21 C ATOM 1374 CG2 ILE A 83 -5.809 -3.540 0.363 1.00 32.22 C ATOM 1375 CD1 ILE A 83 -6.063 -0.652 -0.514 1.00 11.41 C ATOM 0 H ILE A 83 -2.484 -1.618 2.022 1.00 72.05 H new ATOM 0 HA ILE A 83 -5.034 -2.822 2.941 1.00 35.11 H new ATOM 0 HB ILE A 83 -3.957 -2.477 0.107 1.00 14.25 H new ATOM 0 HG12 ILE A 83 -6.184 -1.007 1.586 1.00 1.21 H new ATOM 0 HG13 ILE A 83 -4.660 -0.320 1.058 1.00 1.21 H new ATOM 0 HG21 ILE A 83 -6.194 -3.280 -0.623 1.00 32.22 H new ATOM 0 HG22 ILE A 83 -5.321 -4.514 0.317 1.00 32.22 H new ATOM 0 HG23 ILE A 83 -6.633 -3.580 1.075 1.00 32.22 H new ATOM 0 HD11 ILE A 83 -6.484 0.350 -0.425 1.00 11.41 H new ATOM 0 HD12 ILE A 83 -5.308 -0.660 -1.300 1.00 11.41 H new ATOM 0 HD13 ILE A 83 -6.855 -1.357 -0.765 1.00 11.41 H new ATOM 1387 N MET A 84 -3.829 -5.046 3.153 1.00 2.02 N ATOM 1388 CA MET A 84 -3.265 -6.401 3.255 1.00 31.42 C ATOM 1389 C MET A 84 -4.313 -7.395 2.737 1.00 54.24 C ATOM 1390 O MET A 84 -5.411 -7.497 3.288 1.00 22.14 O ATOM 1391 CB MET A 84 -2.876 -6.686 4.731 1.00 64.55 C ATOM 1392 CG MET A 84 -1.662 -5.886 5.236 1.00 13.24 C ATOM 1393 SD MET A 84 -1.643 -5.691 7.027 1.00 32.41 S ATOM 1394 CE MET A 84 -2.972 -4.510 7.264 1.00 72.25 C ATOM 0 H MET A 84 -4.514 -4.837 3.880 1.00 2.02 H new ATOM 0 HA MET A 84 -2.362 -6.500 2.653 1.00 31.42 H new ATOM 0 HB2 MET A 84 -3.732 -6.465 5.368 1.00 64.55 H new ATOM 0 HB3 MET A 84 -2.665 -7.750 4.839 1.00 64.55 H new ATOM 0 HG2 MET A 84 -0.747 -6.387 4.921 1.00 13.24 H new ATOM 0 HG3 MET A 84 -1.663 -4.901 4.769 1.00 13.24 H new ATOM 0 HE1 MET A 84 -2.732 -3.855 8.102 1.00 72.25 H new ATOM 0 HE2 MET A 84 -3.094 -3.913 6.360 1.00 72.25 H new ATOM 0 HE3 MET A 84 -3.899 -5.043 7.474 1.00 72.25 H new ATOM 1404 N VAL A 85 -3.978 -8.087 1.641 1.00 34.25 N ATOM 1405 CA VAL A 85 -4.880 -9.005 0.932 1.00 3.12 C ATOM 1406 C VAL A 85 -4.122 -10.299 0.611 1.00 72.31 C ATOM 1407 O VAL A 85 -3.153 -10.264 -0.149 1.00 32.23 O ATOM 1408 CB VAL A 85 -5.417 -8.365 -0.406 1.00 63.54 C ATOM 1409 CG1 VAL A 85 -6.289 -9.361 -1.201 1.00 61.24 C ATOM 1410 CG2 VAL A 85 -6.192 -7.056 -0.136 1.00 13.50 C ATOM 0 H VAL A 85 -3.054 -8.024 1.213 1.00 34.25 H new ATOM 0 HA VAL A 85 -5.736 -9.213 1.573 1.00 3.12 H new ATOM 0 HB VAL A 85 -4.547 -8.121 -1.015 1.00 63.54 H new ATOM 0 HG11 VAL A 85 -6.641 -8.886 -2.116 1.00 61.24 H new ATOM 0 HG12 VAL A 85 -5.698 -10.241 -1.453 1.00 61.24 H new ATOM 0 HG13 VAL A 85 -7.144 -9.660 -0.595 1.00 61.24 H new ATOM 0 HG21 VAL A 85 -6.548 -6.642 -1.080 1.00 13.50 H new ATOM 0 HG22 VAL A 85 -7.043 -7.264 0.512 1.00 13.50 H new ATOM 0 HG23 VAL A 85 -5.533 -6.337 0.350 1.00 13.50 H new ATOM 1420 N ASP A 86 -4.570 -11.423 1.188 1.00 65.02 N ATOM 1421 CA ASP A 86 -3.970 -12.755 0.957 1.00 33.10 C ATOM 1422 C ASP A 86 -4.842 -13.825 1.636 1.00 42.43 C ATOM 1423 O ASP A 86 -5.589 -13.514 2.567 1.00 2.41 O ATOM 1424 CB ASP A 86 -2.503 -12.820 1.487 1.00 41.32 C ATOM 1425 CG ASP A 86 -1.739 -14.060 0.992 1.00 3.44 C ATOM 1426 OD1 ASP A 86 -1.284 -14.050 -0.175 1.00 31.15 O ATOM 1427 OD2 ASP A 86 -1.611 -15.058 1.746 1.00 2.35 O ATOM 0 H ASP A 86 -5.361 -11.439 1.831 1.00 65.02 H new ATOM 0 HA ASP A 86 -3.932 -12.942 -0.116 1.00 33.10 H new ATOM 0 HB2 ASP A 86 -1.969 -11.923 1.174 1.00 41.32 H new ATOM 0 HB3 ASP A 86 -2.516 -12.819 2.577 1.00 41.32 H new ATOM 1432 N GLN A 87 -4.737 -15.084 1.164 1.00 5.14 N ATOM 1433 CA GLN A 87 -5.539 -16.217 1.676 1.00 4.14 C ATOM 1434 C GLN A 87 -5.172 -16.587 3.125 1.00 12.13 C ATOM 1435 O GLN A 87 -5.988 -17.194 3.833 1.00 73.04 O ATOM 1436 CB GLN A 87 -5.383 -17.451 0.749 1.00 2.34 C ATOM 1437 CG GLN A 87 -5.898 -17.241 -0.687 1.00 42.21 C ATOM 1438 CD GLN A 87 -7.386 -16.895 -0.755 1.00 1.31 C ATOM 1439 OE1 GLN A 87 -8.237 -17.781 -0.835 1.00 42.44 O ATOM 1440 NE2 GLN A 87 -7.712 -15.607 -0.736 1.00 14.25 N ATOM 0 H GLN A 87 -4.094 -15.345 0.417 1.00 5.14 H new ATOM 0 HA GLN A 87 -6.581 -15.898 1.679 1.00 4.14 H new ATOM 0 HB2 GLN A 87 -4.329 -17.727 0.707 1.00 2.34 H new ATOM 0 HB3 GLN A 87 -5.915 -18.292 1.193 1.00 2.34 H new ATOM 0 HG2 GLN A 87 -5.325 -16.442 -1.157 1.00 42.21 H new ATOM 0 HG3 GLN A 87 -5.716 -18.146 -1.266 1.00 42.21 H new ATOM 0 HE21 GLN A 87 -6.983 -14.897 -0.669 1.00 14.25 H new ATOM 0 HE22 GLN A 87 -8.692 -15.328 -0.788 1.00 14.25 H new ATOM 1449 N ASP A 88 -3.944 -16.242 3.561 1.00 11.20 N ATOM 1450 CA ASP A 88 -3.532 -16.445 4.956 1.00 45.31 C ATOM 1451 C ASP A 88 -4.052 -15.256 5.770 1.00 21.53 C ATOM 1452 O ASP A 88 -3.443 -14.182 5.798 1.00 34.54 O ATOM 1453 CB ASP A 88 -1.991 -16.604 5.103 1.00 5.24 C ATOM 1454 CG ASP A 88 -1.566 -17.159 6.492 1.00 62.12 C ATOM 1455 OD1 ASP A 88 -0.954 -18.251 6.556 1.00 62.55 O ATOM 1456 OD2 ASP A 88 -1.852 -16.516 7.528 1.00 13.44 O ATOM 0 H ASP A 88 -3.227 -15.824 2.968 1.00 11.20 H new ATOM 0 HA ASP A 88 -3.957 -17.377 5.328 1.00 45.31 H new ATOM 0 HB2 ASP A 88 -1.624 -17.272 4.324 1.00 5.24 H new ATOM 0 HB3 ASP A 88 -1.515 -15.637 4.944 1.00 5.24 H new ATOM 1461 N GLN A 89 -5.212 -15.468 6.393 1.00 4.51 N ATOM 1462 CA GLN A 89 -5.919 -14.444 7.165 1.00 65.12 C ATOM 1463 C GLN A 89 -5.146 -14.076 8.446 1.00 13.55 C ATOM 1464 O GLN A 89 -5.162 -12.920 8.850 1.00 34.25 O ATOM 1465 CB GLN A 89 -7.362 -14.953 7.468 1.00 3.41 C ATOM 1466 CG GLN A 89 -8.264 -14.016 8.317 1.00 43.52 C ATOM 1467 CD GLN A 89 -8.387 -12.582 7.782 1.00 42.24 C ATOM 1468 OE1 GLN A 89 -8.241 -12.322 6.586 1.00 44.14 O ATOM 1469 NE2 GLN A 89 -8.704 -11.647 8.668 1.00 31.40 N ATOM 0 H GLN A 89 -5.693 -16.367 6.376 1.00 4.51 H new ATOM 0 HA GLN A 89 -5.988 -13.525 6.583 1.00 65.12 H new ATOM 0 HB2 GLN A 89 -7.864 -15.141 6.519 1.00 3.41 H new ATOM 0 HB3 GLN A 89 -7.285 -15.911 7.983 1.00 3.41 H new ATOM 0 HG2 GLN A 89 -9.261 -14.453 8.379 1.00 43.52 H new ATOM 0 HG3 GLN A 89 -7.870 -13.977 9.332 1.00 43.52 H new ATOM 0 HE21 GLN A 89 -8.818 -11.894 9.651 1.00 31.40 H new ATOM 0 HE22 GLN A 89 -8.834 -10.681 8.366 1.00 31.40 H new ATOM 1478 N GLU A 90 -4.432 -15.054 9.042 1.00 13.31 N ATOM 1479 CA GLU A 90 -3.750 -14.875 10.343 1.00 51.34 C ATOM 1480 C GLU A 90 -2.600 -13.850 10.277 1.00 24.11 C ATOM 1481 O GLU A 90 -2.452 -13.029 11.193 1.00 75.44 O ATOM 1482 CB GLU A 90 -3.234 -16.228 10.898 1.00 74.33 C ATOM 1483 CG GLU A 90 -4.341 -17.254 11.214 1.00 62.11 C ATOM 1484 CD GLU A 90 -3.847 -18.410 12.097 1.00 23.12 C ATOM 1485 OE1 GLU A 90 -3.976 -18.314 13.336 1.00 44.22 O ATOM 1486 OE2 GLU A 90 -3.313 -19.406 11.567 1.00 22.01 O ATOM 0 H GLU A 90 -4.312 -15.983 8.639 1.00 13.31 H new ATOM 0 HA GLU A 90 -4.499 -14.476 11.027 1.00 51.34 H new ATOM 0 HB2 GLU A 90 -2.547 -16.665 10.173 1.00 74.33 H new ATOM 0 HB3 GLU A 90 -2.661 -16.039 11.806 1.00 74.33 H new ATOM 0 HG2 GLU A 90 -5.167 -16.748 11.714 1.00 62.11 H new ATOM 0 HG3 GLU A 90 -4.733 -17.658 10.281 1.00 62.11 H new ATOM 1493 N GLU A 91 -1.794 -13.894 9.194 1.00 21.13 N ATOM 1494 CA GLU A 91 -0.663 -12.957 9.018 1.00 64.14 C ATOM 1495 C GLU A 91 -1.185 -11.554 8.683 1.00 42.22 C ATOM 1496 O GLU A 91 -0.575 -10.553 9.071 1.00 62.44 O ATOM 1497 CB GLU A 91 0.319 -13.443 7.925 1.00 41.42 C ATOM 1498 CG GLU A 91 -0.266 -13.503 6.504 1.00 3.30 C ATOM 1499 CD GLU A 91 0.718 -14.066 5.474 1.00 43.42 C ATOM 1500 OE1 GLU A 91 1.062 -13.369 4.491 1.00 45.22 O ATOM 1501 OE2 GLU A 91 1.169 -15.220 5.654 1.00 42.13 O ATOM 0 H GLU A 91 -1.904 -14.564 8.433 1.00 21.13 H new ATOM 0 HA GLU A 91 -0.114 -12.919 9.959 1.00 64.14 H new ATOM 0 HB2 GLU A 91 1.186 -12.782 7.917 1.00 41.42 H new ATOM 0 HB3 GLU A 91 0.678 -14.436 8.196 1.00 41.42 H new ATOM 0 HG2 GLU A 91 -1.165 -14.119 6.513 1.00 3.30 H new ATOM 0 HG3 GLU A 91 -0.569 -12.501 6.199 1.00 3.30 H new ATOM 1508 N LEU A 92 -2.327 -11.502 7.961 1.00 3.44 N ATOM 1509 CA LEU A 92 -3.048 -10.254 7.680 1.00 51.02 C ATOM 1510 C LEU A 92 -3.453 -9.583 9.002 1.00 54.11 C ATOM 1511 O LEU A 92 -3.168 -8.410 9.203 1.00 23.53 O ATOM 1512 CB LEU A 92 -4.293 -10.529 6.773 1.00 63.23 C ATOM 1513 CG LEU A 92 -4.085 -10.356 5.236 1.00 60.12 C ATOM 1514 CD1 LEU A 92 -2.861 -11.134 4.716 1.00 44.43 C ATOM 1515 CD2 LEU A 92 -5.368 -10.743 4.469 1.00 13.51 C ATOM 0 H LEU A 92 -2.770 -12.329 7.559 1.00 3.44 H new ATOM 0 HA LEU A 92 -2.392 -9.574 7.136 1.00 51.02 H new ATOM 0 HB2 LEU A 92 -4.633 -11.548 6.959 1.00 63.23 H new ATOM 0 HB3 LEU A 92 -5.097 -9.863 7.086 1.00 63.23 H new ATOM 0 HG LEU A 92 -3.878 -9.302 5.053 1.00 60.12 H new ATOM 0 HD11 LEU A 92 -2.761 -10.980 3.642 1.00 44.43 H new ATOM 0 HD12 LEU A 92 -1.962 -10.777 5.219 1.00 44.43 H new ATOM 0 HD13 LEU A 92 -2.992 -12.197 4.919 1.00 44.43 H new ATOM 0 HD21 LEU A 92 -5.204 -10.616 3.399 1.00 13.51 H new ATOM 0 HD22 LEU A 92 -5.616 -11.784 4.677 1.00 13.51 H new ATOM 0 HD23 LEU A 92 -6.190 -10.103 4.789 1.00 13.51 H new ATOM 1527 N GLU A 93 -4.069 -10.376 9.901 1.00 41.15 N ATOM 1528 CA GLU A 93 -4.524 -9.924 11.234 1.00 13.42 C ATOM 1529 C GLU A 93 -3.344 -9.457 12.103 1.00 31.32 C ATOM 1530 O GLU A 93 -3.458 -8.474 12.837 1.00 5.11 O ATOM 1531 CB GLU A 93 -5.274 -11.074 11.955 1.00 12.14 C ATOM 1532 CG GLU A 93 -6.552 -11.546 11.246 1.00 54.10 C ATOM 1533 CD GLU A 93 -7.202 -12.756 11.933 1.00 33.31 C ATOM 1534 OE1 GLU A 93 -7.999 -12.558 12.868 1.00 45.22 O ATOM 1535 OE2 GLU A 93 -6.906 -13.910 11.552 1.00 63.53 O ATOM 0 H GLU A 93 -4.268 -11.360 9.721 1.00 41.15 H new ATOM 0 HA GLU A 93 -5.196 -9.079 11.088 1.00 13.42 H new ATOM 0 HB2 GLU A 93 -4.598 -11.922 12.059 1.00 12.14 H new ATOM 0 HB3 GLU A 93 -5.532 -10.747 12.962 1.00 12.14 H new ATOM 0 HG2 GLU A 93 -7.268 -10.725 11.213 1.00 54.10 H new ATOM 0 HG3 GLU A 93 -6.315 -11.804 10.214 1.00 54.10 H new ATOM 1542 N ARG A 94 -2.219 -10.185 11.996 1.00 51.33 N ATOM 1543 CA ARG A 94 -1.004 -9.946 12.792 1.00 52.43 C ATOM 1544 C ARG A 94 -0.400 -8.556 12.485 1.00 2.30 C ATOM 1545 O ARG A 94 -0.173 -7.751 13.401 1.00 10.11 O ATOM 1546 CB ARG A 94 0.026 -11.070 12.495 1.00 32.32 C ATOM 1547 CG ARG A 94 1.366 -10.950 13.245 1.00 62.04 C ATOM 1548 CD ARG A 94 1.219 -11.050 14.771 1.00 4.44 C ATOM 1549 NE ARG A 94 2.522 -10.986 15.455 1.00 41.12 N ATOM 1550 CZ ARG A 94 2.694 -10.834 16.780 1.00 35.43 C ATOM 1551 NH1 ARG A 94 1.649 -10.723 17.599 1.00 43.12 N ATOM 1552 NH2 ARG A 94 3.919 -10.806 17.279 1.00 63.44 N ATOM 0 H ARG A 94 -2.128 -10.966 11.346 1.00 51.33 H new ATOM 0 HA ARG A 94 -1.264 -9.961 13.850 1.00 52.43 H new ATOM 0 HB2 ARG A 94 -0.426 -12.030 12.744 1.00 32.32 H new ATOM 0 HB3 ARG A 94 0.228 -11.081 11.424 1.00 32.32 H new ATOM 0 HG2 ARG A 94 2.039 -11.734 12.900 1.00 62.04 H new ATOM 0 HG3 ARG A 94 1.831 -9.997 12.993 1.00 62.04 H new ATOM 0 HD2 ARG A 94 0.582 -10.241 15.128 1.00 4.44 H new ATOM 0 HD3 ARG A 94 0.720 -11.985 15.027 1.00 4.44 H new ATOM 0 HE ARG A 94 3.360 -11.063 14.878 1.00 41.12 H new ATOM 0 HH11 ARG A 94 0.701 -10.753 17.223 1.00 43.12 H new ATOM 0 HH12 ARG A 94 1.797 -10.608 18.602 1.00 43.12 H new ATOM 0 HH21 ARG A 94 4.724 -10.899 16.660 1.00 63.44 H new ATOM 0 HH22 ARG A 94 4.058 -10.691 18.283 1.00 63.44 H new ATOM 1566 N ILE A 95 -0.155 -8.299 11.185 1.00 0.42 N ATOM 1567 CA ILE A 95 0.420 -7.030 10.700 1.00 33.31 C ATOM 1568 C ILE A 95 -0.575 -5.871 10.953 1.00 31.22 C ATOM 1569 O ILE A 95 -0.190 -4.804 11.433 1.00 2.41 O ATOM 1570 CB ILE A 95 0.789 -7.138 9.164 1.00 1.02 C ATOM 1571 CG1 ILE A 95 1.755 -8.347 8.906 1.00 21.13 C ATOM 1572 CG2 ILE A 95 1.405 -5.820 8.646 1.00 63.34 C ATOM 1573 CD1 ILE A 95 2.076 -8.626 7.438 1.00 33.50 C ATOM 0 H ILE A 95 -0.351 -8.968 10.440 1.00 0.42 H new ATOM 0 HA ILE A 95 1.339 -6.823 11.249 1.00 33.31 H new ATOM 0 HB ILE A 95 -0.132 -7.316 8.610 1.00 1.02 H new ATOM 0 HG12 ILE A 95 2.689 -8.164 9.436 1.00 21.13 H new ATOM 0 HG13 ILE A 95 1.312 -9.243 9.341 1.00 21.13 H new ATOM 0 HG21 ILE A 95 1.649 -5.923 7.589 1.00 63.34 H new ATOM 0 HG22 ILE A 95 0.689 -5.008 8.776 1.00 63.34 H new ATOM 0 HG23 ILE A 95 2.312 -5.597 9.207 1.00 63.34 H new ATOM 0 HD11 ILE A 95 2.750 -9.480 7.369 1.00 33.50 H new ATOM 0 HD12 ILE A 95 1.154 -8.847 6.900 1.00 33.50 H new ATOM 0 HD13 ILE A 95 2.553 -7.751 6.997 1.00 33.50 H new ATOM 1585 N TYR A 96 -1.862 -6.142 10.665 1.00 63.53 N ATOM 1586 CA TYR A 96 -3.004 -5.234 10.929 1.00 4.43 C ATOM 1587 C TYR A 96 -3.036 -4.762 12.390 1.00 3.44 C ATOM 1588 O TYR A 96 -3.274 -3.582 12.652 1.00 24.34 O ATOM 1589 CB TYR A 96 -4.322 -5.980 10.538 1.00 52.02 C ATOM 1590 CG TYR A 96 -5.650 -5.448 11.109 1.00 71.30 C ATOM 1591 CD1 TYR A 96 -6.364 -4.437 10.472 1.00 11.51 C ATOM 1592 CD2 TYR A 96 -6.190 -5.988 12.283 1.00 42.21 C ATOM 1593 CE1 TYR A 96 -7.568 -3.979 10.984 1.00 2.42 C ATOM 1594 CE2 TYR A 96 -7.383 -5.535 12.796 1.00 65.42 C ATOM 1595 CZ TYR A 96 -8.070 -4.529 12.148 1.00 75.23 C ATOM 1596 OH TYR A 96 -9.261 -4.074 12.675 1.00 42.00 O ATOM 0 H TYR A 96 -2.148 -7.020 10.231 1.00 63.53 H new ATOM 0 HA TYR A 96 -2.897 -4.333 10.326 1.00 4.43 H new ATOM 0 HB2 TYR A 96 -4.399 -5.974 9.451 1.00 52.02 H new ATOM 0 HB3 TYR A 96 -4.220 -7.021 10.844 1.00 52.02 H new ATOM 0 HD1 TYR A 96 -5.973 -4.002 9.564 1.00 11.51 H new ATOM 0 HD2 TYR A 96 -5.659 -6.776 12.796 1.00 42.21 H new ATOM 0 HE1 TYR A 96 -8.111 -3.196 10.476 1.00 2.42 H new ATOM 0 HE2 TYR A 96 -7.781 -5.965 13.703 1.00 65.42 H new ATOM 0 HH TYR A 96 -9.467 -4.570 13.494 1.00 42.00 H new ATOM 1606 N GLU A 97 -2.793 -5.701 13.322 1.00 71.33 N ATOM 1607 CA GLU A 97 -2.815 -5.430 14.770 1.00 53.35 C ATOM 1608 C GLU A 97 -1.673 -4.464 15.133 1.00 61.10 C ATOM 1609 O GLU A 97 -1.891 -3.497 15.855 1.00 51.32 O ATOM 1610 CB GLU A 97 -2.719 -6.774 15.559 1.00 44.13 C ATOM 1611 CG GLU A 97 -3.085 -6.717 17.071 1.00 34.34 C ATOM 1612 CD GLU A 97 -2.016 -6.062 17.975 1.00 0.14 C ATOM 1613 OE1 GLU A 97 -2.246 -4.955 18.504 1.00 4.01 O ATOM 1614 OE2 GLU A 97 -0.936 -6.656 18.154 1.00 41.15 O ATOM 0 H GLU A 97 -2.576 -6.671 13.091 1.00 71.33 H new ATOM 0 HA GLU A 97 -3.754 -4.951 15.047 1.00 53.35 H new ATOM 0 HB2 GLU A 97 -3.373 -7.501 15.077 1.00 44.13 H new ATOM 0 HB3 GLU A 97 -1.701 -7.151 15.468 1.00 44.13 H new ATOM 0 HG2 GLU A 97 -4.020 -6.168 17.183 1.00 34.34 H new ATOM 0 HG3 GLU A 97 -3.266 -7.732 17.425 1.00 34.34 H new ATOM 1621 N GLN A 98 -0.471 -4.734 14.578 1.00 41.25 N ATOM 1622 CA GLN A 98 0.752 -3.943 14.840 1.00 65.22 C ATOM 1623 C GLN A 98 0.623 -2.492 14.329 1.00 61.53 C ATOM 1624 O GLN A 98 1.077 -1.548 14.987 1.00 21.42 O ATOM 1625 CB GLN A 98 1.994 -4.631 14.185 1.00 14.33 C ATOM 1626 CG GLN A 98 3.328 -3.854 14.330 1.00 61.22 C ATOM 1627 CD GLN A 98 3.755 -3.608 15.789 1.00 13.33 C ATOM 1628 OE1 GLN A 98 3.518 -4.428 16.673 1.00 42.33 O ATOM 1629 NE2 GLN A 98 4.367 -2.462 16.051 1.00 11.11 N ATOM 0 H GLN A 98 -0.321 -5.510 13.933 1.00 41.25 H new ATOM 0 HA GLN A 98 0.887 -3.903 15.921 1.00 65.22 H new ATOM 0 HB2 GLN A 98 2.117 -5.620 14.627 1.00 14.33 H new ATOM 0 HB3 GLN A 98 1.791 -4.779 13.124 1.00 14.33 H new ATOM 0 HG2 GLN A 98 4.116 -4.408 13.820 1.00 61.22 H new ATOM 0 HG3 GLN A 98 3.234 -2.894 13.823 1.00 61.22 H new ATOM 0 HE21 GLN A 98 4.552 -1.799 15.298 1.00 11.11 H new ATOM 0 HE22 GLN A 98 4.653 -2.243 17.005 1.00 11.11 H new ATOM 1638 N LEU A 99 0.008 -2.328 13.152 1.00 51.02 N ATOM 1639 CA LEU A 99 -0.110 -1.018 12.495 1.00 23.23 C ATOM 1640 C LEU A 99 -1.248 -0.190 13.118 1.00 62.23 C ATOM 1641 O LEU A 99 -1.093 1.009 13.338 1.00 40.42 O ATOM 1642 CB LEU A 99 -0.330 -1.209 10.979 1.00 51.44 C ATOM 1643 CG LEU A 99 0.757 -2.036 10.224 1.00 22.23 C ATOM 1644 CD1 LEU A 99 0.401 -2.200 8.739 1.00 52.34 C ATOM 1645 CD2 LEU A 99 2.158 -1.428 10.402 1.00 1.32 C ATOM 0 H LEU A 99 -0.420 -3.093 12.630 1.00 51.02 H new ATOM 0 HA LEU A 99 0.818 -0.466 12.646 1.00 23.23 H new ATOM 0 HB2 LEU A 99 -1.294 -1.695 10.831 1.00 51.44 H new ATOM 0 HB3 LEU A 99 -0.395 -0.225 10.515 1.00 51.44 H new ATOM 0 HG LEU A 99 0.778 -3.030 10.670 1.00 22.23 H new ATOM 0 HD11 LEU A 99 1.177 -2.780 8.241 1.00 52.34 H new ATOM 0 HD12 LEU A 99 -0.554 -2.718 8.649 1.00 52.34 H new ATOM 0 HD13 LEU A 99 0.326 -1.218 8.272 1.00 52.34 H new ATOM 0 HD21 LEU A 99 2.888 -2.031 9.862 1.00 1.32 H new ATOM 0 HD22 LEU A 99 2.166 -0.411 10.009 1.00 1.32 H new ATOM 0 HD23 LEU A 99 2.415 -1.410 11.461 1.00 1.32 H new ATOM 1657 N LYS A 100 -2.381 -0.853 13.422 1.00 3.11 N ATOM 1658 CA LYS A 100 -3.553 -0.203 14.053 1.00 33.04 C ATOM 1659 C LYS A 100 -3.283 0.063 15.556 1.00 22.22 C ATOM 1660 O LYS A 100 -3.973 0.871 16.190 1.00 74.35 O ATOM 1661 CB LYS A 100 -4.830 -1.064 13.849 1.00 21.21 C ATOM 1662 CG LYS A 100 -6.154 -0.335 14.173 1.00 3.01 C ATOM 1663 CD LYS A 100 -7.398 -1.205 13.904 1.00 33.31 C ATOM 1664 CE LYS A 100 -8.712 -0.504 14.298 1.00 44.00 C ATOM 1665 NZ LYS A 100 -8.734 -0.129 15.741 1.00 74.42 N ATOM 0 H LYS A 100 -2.512 -1.848 13.240 1.00 3.11 H new ATOM 0 HA LYS A 100 -3.721 0.759 13.570 1.00 33.04 H new ATOM 0 HB2 LYS A 100 -4.862 -1.405 12.814 1.00 21.21 H new ATOM 0 HB3 LYS A 100 -4.757 -1.953 14.475 1.00 21.21 H new ATOM 0 HG2 LYS A 100 -6.149 -0.031 15.220 1.00 3.01 H new ATOM 0 HG3 LYS A 100 -6.217 0.575 13.577 1.00 3.01 H new ATOM 0 HD2 LYS A 100 -7.433 -1.464 12.846 1.00 33.31 H new ATOM 0 HD3 LYS A 100 -7.309 -2.139 14.458 1.00 33.31 H new ATOM 0 HE2 LYS A 100 -8.842 0.390 13.689 1.00 44.00 H new ATOM 0 HE3 LYS A 100 -9.553 -1.162 14.082 1.00 44.00 H new ATOM 0 HZ1 LYS A 100 -9.698 0.151 16.012 1.00 74.42 H new ATOM 0 HZ2 LYS A 100 -8.435 -0.943 16.316 1.00 74.42 H new ATOM 0 HZ3 LYS A 100 -8.084 0.667 15.903 1.00 74.42 H new ATOM 1679 N LYS A 101 -2.271 -0.644 16.107 1.00 72.41 N ATOM 1680 CA LYS A 101 -1.680 -0.339 17.428 1.00 62.50 C ATOM 1681 C LYS A 101 -1.143 1.104 17.434 1.00 62.50 C ATOM 1682 O LYS A 101 -1.396 1.870 18.372 1.00 71.45 O ATOM 1683 CB LYS A 101 -0.536 -1.340 17.738 1.00 52.42 C ATOM 1684 CG LYS A 101 0.094 -1.232 19.147 1.00 45.34 C ATOM 1685 CD LYS A 101 1.387 -2.077 19.296 1.00 55.32 C ATOM 1686 CE LYS A 101 1.202 -3.559 18.909 1.00 52.24 C ATOM 1687 NZ LYS A 101 0.169 -4.230 19.732 1.00 42.33 N ATOM 0 H LYS A 101 -1.840 -1.445 15.646 1.00 72.41 H new ATOM 0 HA LYS A 101 -2.446 -0.435 18.197 1.00 62.50 H new ATOM 0 HB2 LYS A 101 -0.920 -2.352 17.610 1.00 52.42 H new ATOM 0 HB3 LYS A 101 0.252 -1.202 16.997 1.00 52.42 H new ATOM 0 HG2 LYS A 101 0.322 -0.187 19.358 1.00 45.34 H new ATOM 0 HG3 LYS A 101 -0.634 -1.556 19.891 1.00 45.34 H new ATOM 0 HD2 LYS A 101 2.169 -1.642 18.674 1.00 55.32 H new ATOM 0 HD3 LYS A 101 1.732 -2.020 20.328 1.00 55.32 H new ATOM 0 HE2 LYS A 101 0.925 -3.626 17.857 1.00 52.24 H new ATOM 0 HE3 LYS A 101 2.151 -4.083 19.023 1.00 52.24 H new ATOM 0 HZ1 LYS A 101 0.533 -5.144 20.068 1.00 42.33 H new ATOM 0 HZ2 LYS A 101 -0.068 -3.630 20.548 1.00 42.33 H new ATOM 0 HZ3 LYS A 101 -0.684 -4.387 19.158 1.00 42.33 H new ATOM 1701 N ASP A 102 -0.413 1.468 16.356 1.00 22.42 N ATOM 1702 CA ASP A 102 0.058 2.848 16.145 1.00 24.41 C ATOM 1703 C ASP A 102 -1.127 3.754 15.730 1.00 4.34 C ATOM 1704 O ASP A 102 -1.159 4.939 16.070 1.00 15.32 O ATOM 1705 CB ASP A 102 1.172 2.863 15.053 1.00 14.21 C ATOM 1706 CG ASP A 102 1.661 4.283 14.673 1.00 62.31 C ATOM 1707 OD1 ASP A 102 2.685 4.746 15.225 1.00 34.43 O ATOM 1708 OD2 ASP A 102 1.007 4.954 13.838 1.00 62.15 O ATOM 0 H ASP A 102 -0.138 0.820 15.618 1.00 22.42 H new ATOM 0 HA ASP A 102 0.476 3.233 17.075 1.00 24.41 H new ATOM 0 HB2 ASP A 102 2.022 2.280 15.407 1.00 14.21 H new ATOM 0 HB3 ASP A 102 0.796 2.367 14.158 1.00 14.21 H new ATOM 1713 N GLY A 103 -2.118 3.157 15.043 1.00 64.42 N ATOM 1714 CA GLY A 103 -3.305 3.876 14.555 1.00 71.12 C ATOM 1715 C GLY A 103 -3.211 4.253 13.078 1.00 50.34 C ATOM 1716 O GLY A 103 -3.810 5.244 12.649 1.00 62.25 O ATOM 0 H GLY A 103 -2.117 2.164 14.812 1.00 64.42 H new ATOM 0 HA2 GLY A 103 -4.188 3.256 14.710 1.00 71.12 H new ATOM 0 HA3 GLY A 103 -3.443 4.781 15.147 1.00 71.12 H new ATOM 1720 N VAL A 104 -2.448 3.460 12.305 1.00 35.41 N ATOM 1721 CA VAL A 104 -2.364 3.593 10.833 1.00 42.13 C ATOM 1722 C VAL A 104 -3.692 3.124 10.189 1.00 10.53 C ATOM 1723 O VAL A 104 -4.367 2.242 10.737 1.00 64.20 O ATOM 1724 CB VAL A 104 -1.154 2.746 10.261 1.00 42.33 C ATOM 1725 CG1 VAL A 104 -1.001 2.899 8.726 1.00 65.24 C ATOM 1726 CG2 VAL A 104 0.171 3.106 10.981 1.00 50.05 C ATOM 0 H VAL A 104 -1.871 2.707 12.680 1.00 35.41 H new ATOM 0 HA VAL A 104 -2.194 4.641 10.587 1.00 42.13 H new ATOM 0 HB VAL A 104 -1.383 1.699 10.460 1.00 42.33 H new ATOM 0 HG11 VAL A 104 -0.158 2.299 8.383 1.00 65.24 H new ATOM 0 HG12 VAL A 104 -1.912 2.559 8.234 1.00 65.24 H new ATOM 0 HG13 VAL A 104 -0.825 3.946 8.481 1.00 65.24 H new ATOM 0 HG21 VAL A 104 0.984 2.509 10.567 1.00 50.05 H new ATOM 0 HG22 VAL A 104 0.388 4.164 10.836 1.00 50.05 H new ATOM 0 HG23 VAL A 104 0.074 2.898 12.047 1.00 50.05 H new ATOM 1736 N ASP A 105 -4.068 3.728 9.037 1.00 73.14 N ATOM 1737 CA ASP A 105 -5.240 3.288 8.256 1.00 41.03 C ATOM 1738 C ASP A 105 -4.936 1.911 7.659 1.00 32.41 C ATOM 1739 O ASP A 105 -4.038 1.789 6.832 1.00 74.21 O ATOM 1740 CB ASP A 105 -5.569 4.281 7.117 1.00 11.44 C ATOM 1741 CG ASP A 105 -6.805 3.859 6.283 1.00 54.42 C ATOM 1742 OD1 ASP A 105 -6.646 3.210 5.218 1.00 52.31 O ATOM 1743 OD2 ASP A 105 -7.950 4.165 6.690 1.00 61.13 O ATOM 0 H ASP A 105 -3.573 4.522 8.631 1.00 73.14 H new ATOM 0 HA ASP A 105 -6.105 3.242 8.918 1.00 41.03 H new ATOM 0 HB2 ASP A 105 -5.745 5.269 7.543 1.00 11.44 H new ATOM 0 HB3 ASP A 105 -4.705 4.368 6.458 1.00 11.44 H new ATOM 1748 N VAL A 106 -5.643 0.886 8.130 1.00 51.45 N ATOM 1749 CA VAL A 106 -5.419 -0.515 7.718 1.00 51.33 C ATOM 1750 C VAL A 106 -6.740 -1.219 7.393 1.00 43.32 C ATOM 1751 O VAL A 106 -7.798 -0.861 7.920 1.00 34.31 O ATOM 1752 CB VAL A 106 -4.640 -1.320 8.826 1.00 24.04 C ATOM 1753 CG1 VAL A 106 -3.161 -0.888 8.896 1.00 1.22 C ATOM 1754 CG2 VAL A 106 -5.318 -1.155 10.205 1.00 24.30 C ATOM 0 H VAL A 106 -6.393 0.995 8.812 1.00 51.45 H new ATOM 0 HA VAL A 106 -4.809 -0.489 6.815 1.00 51.33 H new ATOM 0 HB VAL A 106 -4.670 -2.374 8.551 1.00 24.04 H new ATOM 0 HG11 VAL A 106 -2.651 -1.462 9.670 1.00 1.22 H new ATOM 0 HG12 VAL A 106 -2.683 -1.071 7.934 1.00 1.22 H new ATOM 0 HG13 VAL A 106 -3.103 0.174 9.134 1.00 1.22 H new ATOM 0 HG21 VAL A 106 -4.762 -1.720 10.954 1.00 24.30 H new ATOM 0 HG22 VAL A 106 -5.330 -0.101 10.481 1.00 24.30 H new ATOM 0 HG23 VAL A 106 -6.341 -1.528 10.155 1.00 24.30 H new ATOM 1764 N ARG A 107 -6.651 -2.214 6.498 1.00 1.24 N ATOM 1765 CA ARG A 107 -7.787 -3.055 6.092 1.00 3.12 C ATOM 1766 C ARG A 107 -7.267 -4.400 5.567 1.00 24.35 C ATOM 1767 O ARG A 107 -6.235 -4.452 4.886 1.00 13.55 O ATOM 1768 CB ARG A 107 -8.641 -2.314 5.025 1.00 44.22 C ATOM 1769 CG ARG A 107 -7.882 -1.909 3.729 1.00 72.21 C ATOM 1770 CD ARG A 107 -8.576 -0.764 2.970 1.00 13.15 C ATOM 1771 NE ARG A 107 -8.577 0.482 3.767 1.00 34.31 N ATOM 1772 CZ ARG A 107 -9.661 1.197 4.101 1.00 13.42 C ATOM 1773 NH1 ARG A 107 -10.882 0.820 3.722 1.00 64.43 N ATOM 1774 NH2 ARG A 107 -9.508 2.295 4.815 1.00 75.12 N ATOM 0 H ARG A 107 -5.778 -2.460 6.031 1.00 1.24 H new ATOM 0 HA ARG A 107 -8.429 -3.251 6.951 1.00 3.12 H new ATOM 0 HB2 ARG A 107 -9.481 -2.951 4.750 1.00 44.22 H new ATOM 0 HB3 ARG A 107 -9.058 -1.415 5.478 1.00 44.22 H new ATOM 0 HG2 ARG A 107 -6.867 -1.607 3.986 1.00 72.21 H new ATOM 0 HG3 ARG A 107 -7.800 -2.777 3.074 1.00 72.21 H new ATOM 0 HD2 ARG A 107 -8.067 -0.592 2.022 1.00 13.15 H new ATOM 0 HD3 ARG A 107 -9.601 -1.049 2.734 1.00 13.15 H new ATOM 0 HE ARG A 107 -7.674 0.828 4.091 1.00 34.31 H new ATOM 0 HH11 ARG A 107 -11.005 -0.027 3.167 1.00 64.43 H new ATOM 0 HH12 ARG A 107 -11.693 1.378 3.987 1.00 64.43 H new ATOM 0 HH21 ARG A 107 -8.575 2.589 5.105 1.00 75.12 H new ATOM 0 HH22 ARG A 107 -10.322 2.850 5.077 1.00 75.12 H new ATOM 1788 N VAL A 108 -7.967 -5.489 5.927 1.00 43.34 N ATOM 1789 CA VAL A 108 -7.602 -6.860 5.524 1.00 44.45 C ATOM 1790 C VAL A 108 -8.818 -7.565 4.895 1.00 50.05 C ATOM 1791 O VAL A 108 -9.954 -7.359 5.342 1.00 71.14 O ATOM 1792 CB VAL A 108 -7.045 -7.700 6.739 1.00 64.41 C ATOM 1793 CG1 VAL A 108 -5.746 -7.080 7.291 1.00 3.33 C ATOM 1794 CG2 VAL A 108 -8.093 -7.871 7.872 1.00 15.33 C ATOM 0 H VAL A 108 -8.805 -5.444 6.507 1.00 43.34 H new ATOM 0 HA VAL A 108 -6.804 -6.790 4.784 1.00 44.45 H new ATOM 0 HB VAL A 108 -6.821 -8.695 6.355 1.00 64.41 H new ATOM 0 HG11 VAL A 108 -5.384 -7.678 8.127 1.00 3.33 H new ATOM 0 HG12 VAL A 108 -4.990 -7.059 6.506 1.00 3.33 H new ATOM 0 HG13 VAL A 108 -5.944 -6.064 7.631 1.00 3.33 H new ATOM 0 HG21 VAL A 108 -7.660 -8.456 8.683 1.00 15.33 H new ATOM 0 HG22 VAL A 108 -8.386 -6.891 8.248 1.00 15.33 H new ATOM 0 HG23 VAL A 108 -8.970 -8.387 7.481 1.00 15.33 H new ATOM 1804 N THR A 109 -8.574 -8.362 3.839 1.00 54.32 N ATOM 1805 CA THR A 109 -9.602 -9.210 3.212 1.00 20.55 C ATOM 1806 C THR A 109 -8.921 -10.309 2.372 1.00 10.31 C ATOM 1807 O THR A 109 -7.929 -10.050 1.685 1.00 12.01 O ATOM 1808 CB THR A 109 -10.629 -8.378 2.350 1.00 22.02 C ATOM 1809 OG1 THR A 109 -11.712 -9.219 1.920 1.00 53.10 O ATOM 1810 CG2 THR A 109 -9.986 -7.703 1.121 1.00 63.43 C ATOM 0 H THR A 109 -7.658 -8.436 3.397 1.00 54.32 H new ATOM 0 HA THR A 109 -10.185 -9.676 4.006 1.00 20.55 H new ATOM 0 HB THR A 109 -10.999 -7.583 2.997 1.00 22.02 H new ATOM 0 HG1 THR A 109 -12.481 -8.663 1.676 1.00 53.10 H new ATOM 0 HG21 THR A 109 -10.746 -7.147 0.572 1.00 63.43 H new ATOM 0 HG22 THR A 109 -9.203 -7.019 1.449 1.00 63.43 H new ATOM 0 HG23 THR A 109 -9.554 -8.465 0.472 1.00 63.43 H new ATOM 1818 N ASP A 110 -9.426 -11.556 2.471 1.00 24.03 N ATOM 1819 CA ASP A 110 -8.890 -12.697 1.699 1.00 32.21 C ATOM 1820 C ASP A 110 -9.796 -12.977 0.480 1.00 15.45 C ATOM 1821 O ASP A 110 -10.799 -13.688 0.574 1.00 71.44 O ATOM 1822 CB ASP A 110 -8.710 -13.960 2.602 1.00 74.24 C ATOM 1823 CG ASP A 110 -10.016 -14.542 3.183 1.00 1.40 C ATOM 1824 OD1 ASP A 110 -10.415 -15.673 2.800 1.00 63.25 O ATOM 1825 OD2 ASP A 110 -10.654 -13.870 4.015 1.00 52.20 O ATOM 0 H ASP A 110 -10.207 -11.799 3.080 1.00 24.03 H new ATOM 0 HA ASP A 110 -7.898 -12.438 1.329 1.00 32.21 H new ATOM 0 HB2 ASP A 110 -8.212 -14.736 2.020 1.00 74.24 H new ATOM 0 HB3 ASP A 110 -8.045 -13.705 3.428 1.00 74.24 H new ATOM 1830 N ASN A 111 -9.471 -12.311 -0.638 1.00 23.41 N ATOM 1831 CA ASN A 111 -10.061 -12.567 -1.973 1.00 21.21 C ATOM 1832 C ASN A 111 -9.398 -11.635 -3.005 1.00 14.21 C ATOM 1833 O ASN A 111 -8.386 -11.003 -2.716 1.00 30.00 O ATOM 1834 CB ASN A 111 -11.605 -12.359 -1.980 1.00 64.34 C ATOM 1835 CG ASN A 111 -12.020 -10.950 -1.568 1.00 15.22 C ATOM 1836 OD1 ASN A 111 -12.086 -10.050 -2.395 1.00 64.55 O ATOM 1837 ND2 ASN A 111 -12.307 -10.757 -0.291 1.00 21.21 N ATOM 0 H ASN A 111 -8.777 -11.563 -0.646 1.00 23.41 H new ATOM 0 HA ASN A 111 -9.875 -13.609 -2.232 1.00 21.21 H new ATOM 0 HB2 ASN A 111 -11.989 -12.567 -2.978 1.00 64.34 H new ATOM 0 HB3 ASN A 111 -12.066 -13.079 -1.304 1.00 64.34 H new ATOM 0 HD21 ASN A 111 -12.595 -9.834 0.033 1.00 21.21 H new ATOM 0 HD22 ASN A 111 -12.241 -11.532 0.369 1.00 21.21 H new ATOM 1844 N GLU A 112 -9.972 -11.571 -4.212 1.00 24.14 N ATOM 1845 CA GLU A 112 -9.531 -10.651 -5.270 1.00 35.43 C ATOM 1846 C GLU A 112 -10.539 -9.494 -5.437 1.00 62.13 C ATOM 1847 O GLU A 112 -10.155 -8.326 -5.410 1.00 13.40 O ATOM 1848 CB GLU A 112 -9.369 -11.444 -6.581 1.00 72.51 C ATOM 1849 CG GLU A 112 -8.855 -10.636 -7.782 1.00 30.42 C ATOM 1850 CD GLU A 112 -8.747 -11.496 -9.049 1.00 12.21 C ATOM 1851 OE1 GLU A 112 -9.628 -11.410 -9.923 1.00 45.33 O ATOM 1852 OE2 GLU A 112 -7.795 -12.294 -9.148 1.00 11.13 O ATOM 0 H GLU A 112 -10.760 -12.159 -4.485 1.00 24.14 H new ATOM 0 HA GLU A 112 -8.572 -10.209 -4.999 1.00 35.43 H new ATOM 0 HB2 GLU A 112 -8.683 -12.272 -6.402 1.00 72.51 H new ATOM 0 HB3 GLU A 112 -10.333 -11.879 -6.844 1.00 72.51 H new ATOM 0 HG2 GLU A 112 -9.526 -9.798 -7.969 1.00 30.42 H new ATOM 0 HG3 GLU A 112 -7.878 -10.215 -7.545 1.00 30.42 H new ATOM 1859 N ASP A 113 -11.837 -9.846 -5.566 1.00 24.20 N ATOM 1860 CA ASP A 113 -12.916 -8.905 -5.969 1.00 73.10 C ATOM 1861 C ASP A 113 -13.089 -7.740 -4.969 1.00 34.45 C ATOM 1862 O ASP A 113 -12.854 -6.582 -5.324 1.00 42.42 O ATOM 1863 CB ASP A 113 -14.249 -9.686 -6.140 1.00 43.45 C ATOM 1864 CG ASP A 113 -15.460 -8.777 -6.432 1.00 44.14 C ATOM 1865 OD1 ASP A 113 -15.651 -8.370 -7.597 1.00 51.13 O ATOM 1866 OD2 ASP A 113 -16.221 -8.446 -5.494 1.00 14.31 O ATOM 0 H ASP A 113 -12.172 -10.794 -5.394 1.00 24.20 H new ATOM 0 HA ASP A 113 -12.629 -8.457 -6.920 1.00 73.10 H new ATOM 0 HB2 ASP A 113 -14.139 -10.404 -6.953 1.00 43.45 H new ATOM 0 HB3 ASP A 113 -14.445 -10.259 -5.233 1.00 43.45 H new ATOM 1871 N GLU A 114 -13.477 -8.077 -3.724 1.00 65.35 N ATOM 1872 CA GLU A 114 -13.752 -7.101 -2.637 1.00 65.12 C ATOM 1873 C GLU A 114 -12.534 -6.176 -2.426 1.00 2.53 C ATOM 1874 O GLU A 114 -12.678 -4.967 -2.228 1.00 75.41 O ATOM 1875 CB GLU A 114 -14.105 -7.878 -1.322 1.00 43.22 C ATOM 1876 CG GLU A 114 -15.216 -7.274 -0.442 1.00 34.24 C ATOM 1877 CD GLU A 114 -14.944 -5.861 0.102 1.00 1.32 C ATOM 1878 OE1 GLU A 114 -15.463 -4.874 -0.471 1.00 71.21 O ATOM 1879 OE2 GLU A 114 -14.224 -5.730 1.119 1.00 25.43 O ATOM 0 H GLU A 114 -13.612 -9.046 -3.435 1.00 65.35 H new ATOM 0 HA GLU A 114 -14.600 -6.475 -2.914 1.00 65.12 H new ATOM 0 HB2 GLU A 114 -14.399 -8.892 -1.594 1.00 43.22 H new ATOM 0 HB3 GLU A 114 -13.200 -7.959 -0.720 1.00 43.22 H new ATOM 0 HG2 GLU A 114 -16.139 -7.249 -1.021 1.00 34.24 H new ATOM 0 HG3 GLU A 114 -15.388 -7.941 0.403 1.00 34.24 H new ATOM 1886 N ALA A 115 -11.341 -6.789 -2.526 1.00 65.35 N ATOM 1887 CA ALA A 115 -10.046 -6.114 -2.393 1.00 2.01 C ATOM 1888 C ALA A 115 -9.868 -4.988 -3.429 1.00 35.24 C ATOM 1889 O ALA A 115 -9.396 -3.894 -3.092 1.00 11.30 O ATOM 1890 CB ALA A 115 -8.927 -7.155 -2.534 1.00 33.12 C ATOM 0 H ALA A 115 -11.253 -7.789 -2.705 1.00 65.35 H new ATOM 0 HA ALA A 115 -10.002 -5.645 -1.410 1.00 2.01 H new ATOM 0 HB1 ALA A 115 -7.959 -6.664 -2.437 1.00 33.12 H new ATOM 0 HB2 ALA A 115 -9.031 -7.909 -1.754 1.00 33.12 H new ATOM 0 HB3 ALA A 115 -8.995 -7.632 -3.512 1.00 33.12 H new ATOM 1896 N LYS A 116 -10.239 -5.281 -4.695 1.00 53.22 N ATOM 1897 CA LYS A 116 -10.130 -4.325 -5.818 1.00 14.14 C ATOM 1898 C LYS A 116 -11.053 -3.110 -5.618 1.00 52.34 C ATOM 1899 O LYS A 116 -10.726 -1.991 -6.031 1.00 3.35 O ATOM 1900 CB LYS A 116 -10.425 -5.045 -7.167 1.00 11.15 C ATOM 1901 CG LYS A 116 -9.388 -6.134 -7.516 1.00 63.25 C ATOM 1902 CD LYS A 116 -9.732 -6.946 -8.787 1.00 62.33 C ATOM 1903 CE LYS A 116 -9.628 -6.134 -10.089 1.00 62.11 C ATOM 1904 NZ LYS A 116 -9.671 -7.013 -11.290 1.00 73.52 N ATOM 0 H LYS A 116 -10.622 -6.187 -4.966 1.00 53.22 H new ATOM 0 HA LYS A 116 -9.108 -3.947 -5.845 1.00 14.14 H new ATOM 0 HB2 LYS A 116 -11.416 -5.498 -7.121 1.00 11.15 H new ATOM 0 HB3 LYS A 116 -10.449 -4.306 -7.968 1.00 11.15 H new ATOM 0 HG2 LYS A 116 -8.414 -5.664 -7.650 1.00 63.25 H new ATOM 0 HG3 LYS A 116 -9.298 -6.819 -6.673 1.00 63.25 H new ATOM 0 HD2 LYS A 116 -9.063 -7.804 -8.851 1.00 62.33 H new ATOM 0 HD3 LYS A 116 -10.745 -7.337 -8.694 1.00 62.33 H new ATOM 0 HE2 LYS A 116 -10.445 -5.414 -10.135 1.00 62.11 H new ATOM 0 HE3 LYS A 116 -8.700 -5.563 -10.089 1.00 62.11 H new ATOM 0 HZ1 LYS A 116 -9.332 -6.485 -12.119 1.00 73.52 H new ATOM 0 HZ2 LYS A 116 -9.062 -7.842 -11.135 1.00 73.52 H new ATOM 0 HZ3 LYS A 116 -10.648 -7.327 -11.455 1.00 73.52 H new ATOM 1918 N LYS A 117 -12.202 -3.340 -4.972 1.00 1.05 N ATOM 1919 CA LYS A 117 -13.161 -2.273 -4.634 1.00 13.12 C ATOM 1920 C LYS A 117 -12.633 -1.422 -3.455 1.00 72.22 C ATOM 1921 O LYS A 117 -12.870 -0.209 -3.407 1.00 74.31 O ATOM 1922 CB LYS A 117 -14.576 -2.883 -4.337 1.00 52.24 C ATOM 1923 CG LYS A 117 -15.607 -2.736 -5.487 1.00 25.21 C ATOM 1924 CD LYS A 117 -15.166 -3.382 -6.821 1.00 23.31 C ATOM 1925 CE LYS A 117 -15.059 -4.909 -6.754 1.00 73.22 C ATOM 1926 NZ LYS A 117 -16.349 -5.549 -6.385 1.00 21.34 N ATOM 0 H LYS A 117 -12.496 -4.268 -4.668 1.00 1.05 H new ATOM 0 HA LYS A 117 -13.268 -1.606 -5.490 1.00 13.12 H new ATOM 0 HB2 LYS A 117 -14.458 -3.942 -4.108 1.00 52.24 H new ATOM 0 HB3 LYS A 117 -14.980 -2.407 -3.444 1.00 52.24 H new ATOM 0 HG2 LYS A 117 -16.550 -3.184 -5.174 1.00 25.21 H new ATOM 0 HG3 LYS A 117 -15.798 -1.676 -5.655 1.00 25.21 H new ATOM 0 HD2 LYS A 117 -15.878 -3.109 -7.600 1.00 23.31 H new ATOM 0 HD3 LYS A 117 -14.200 -2.970 -7.113 1.00 23.31 H new ATOM 0 HE2 LYS A 117 -14.730 -5.291 -7.720 1.00 73.22 H new ATOM 0 HE3 LYS A 117 -14.297 -5.186 -6.026 1.00 73.22 H new ATOM 0 HZ1 LYS A 117 -16.332 -5.809 -5.378 1.00 21.34 H new ATOM 0 HZ2 LYS A 117 -17.129 -4.883 -6.557 1.00 21.34 H new ATOM 0 HZ3 LYS A 117 -16.490 -6.403 -6.961 1.00 21.34 H new ATOM 1940 N ARG A 118 -11.896 -2.064 -2.524 1.00 0.01 N ATOM 1941 CA ARG A 118 -11.279 -1.370 -1.367 1.00 74.01 C ATOM 1942 C ARG A 118 -9.977 -0.653 -1.757 1.00 2.02 C ATOM 1943 O ARG A 118 -9.482 0.199 -1.007 1.00 3.41 O ATOM 1944 CB ARG A 118 -11.044 -2.355 -0.197 1.00 32.22 C ATOM 1945 CG ARG A 118 -12.340 -2.990 0.344 1.00 72.13 C ATOM 1946 CD ARG A 118 -13.381 -1.948 0.804 1.00 5.43 C ATOM 1947 NE ARG A 118 -14.655 -2.582 1.181 1.00 52.25 N ATOM 1948 CZ ARG A 118 -15.824 -1.942 1.336 1.00 3.52 C ATOM 1949 NH1 ARG A 118 -15.919 -0.625 1.162 1.00 20.31 N ATOM 1950 NH2 ARG A 118 -16.905 -2.635 1.648 1.00 40.31 N ATOM 0 H ARG A 118 -11.712 -3.067 -2.549 1.00 0.01 H new ATOM 0 HA ARG A 118 -11.979 -0.604 -1.034 1.00 74.01 H new ATOM 0 HB2 ARG A 118 -10.372 -3.147 -0.529 1.00 32.22 H new ATOM 0 HB3 ARG A 118 -10.541 -1.829 0.614 1.00 32.22 H new ATOM 0 HG2 ARG A 118 -12.781 -3.617 -0.431 1.00 72.13 H new ATOM 0 HG3 ARG A 118 -12.095 -3.643 1.181 1.00 72.13 H new ATOM 0 HD2 ARG A 118 -12.987 -1.390 1.653 1.00 5.43 H new ATOM 0 HD3 ARG A 118 -13.555 -1.229 0.003 1.00 5.43 H new ATOM 0 HE ARG A 118 -14.648 -3.590 1.337 1.00 52.25 H new ATOM 0 HH11 ARG A 118 -15.093 -0.084 0.906 1.00 20.31 H new ATOM 0 HH12 ARG A 118 -16.817 -0.158 1.285 1.00 20.31 H new ATOM 0 HH21 ARG A 118 -16.845 -3.646 1.769 1.00 40.31 H new ATOM 0 HH22 ARG A 118 -17.799 -2.159 1.768 1.00 40.31 H new ATOM 1964 N LEU A 119 -9.427 -1.018 -2.922 1.00 43.23 N ATOM 1965 CA LEU A 119 -8.305 -0.299 -3.534 1.00 65.30 C ATOM 1966 C LEU A 119 -8.820 1.091 -3.991 1.00 63.12 C ATOM 1967 O LEU A 119 -8.192 2.121 -3.715 1.00 33.34 O ATOM 1968 CB LEU A 119 -7.709 -1.141 -4.714 1.00 12.35 C ATOM 1969 CG LEU A 119 -6.190 -0.942 -5.060 1.00 40.22 C ATOM 1970 CD1 LEU A 119 -5.860 0.488 -5.508 1.00 54.12 C ATOM 1971 CD2 LEU A 119 -5.283 -1.376 -3.893 1.00 24.23 C ATOM 0 H LEU A 119 -9.748 -1.819 -3.466 1.00 43.23 H new ATOM 0 HA LEU A 119 -7.494 -0.150 -2.821 1.00 65.30 H new ATOM 0 HB2 LEU A 119 -7.865 -2.195 -4.486 1.00 12.35 H new ATOM 0 HB3 LEU A 119 -8.289 -0.919 -5.610 1.00 12.35 H new ATOM 0 HG LEU A 119 -5.987 -1.592 -5.911 1.00 40.22 H new ATOM 0 HD11 LEU A 119 -4.796 0.562 -5.733 1.00 54.12 H new ATOM 0 HD12 LEU A 119 -6.437 0.732 -6.400 1.00 54.12 H new ATOM 0 HD13 LEU A 119 -6.112 1.187 -4.710 1.00 54.12 H new ATOM 0 HD21 LEU A 119 -4.239 -1.224 -4.168 1.00 24.23 H new ATOM 0 HD22 LEU A 119 -5.516 -0.781 -3.010 1.00 24.23 H new ATOM 0 HD23 LEU A 119 -5.451 -2.430 -3.674 1.00 24.23 H new ATOM 1983 N LYS A 120 -10.004 1.094 -4.651 1.00 63.14 N ATOM 1984 CA LYS A 120 -10.672 2.331 -5.106 1.00 63.51 C ATOM 1985 C LYS A 120 -11.143 3.185 -3.914 1.00 61.32 C ATOM 1986 O LYS A 120 -11.079 4.414 -3.974 1.00 51.51 O ATOM 1987 CB LYS A 120 -11.871 2.007 -6.034 1.00 14.34 C ATOM 1988 CG LYS A 120 -12.651 3.261 -6.512 1.00 12.23 C ATOM 1989 CD LYS A 120 -13.801 2.948 -7.490 1.00 1.32 C ATOM 1990 CE LYS A 120 -13.306 2.401 -8.835 1.00 31.13 C ATOM 1991 NZ LYS A 120 -14.417 2.189 -9.793 1.00 4.33 N ATOM 0 H LYS A 120 -10.517 0.243 -4.880 1.00 63.14 H new ATOM 0 HA LYS A 120 -9.939 2.906 -5.671 1.00 63.51 H new ATOM 0 HB2 LYS A 120 -11.507 1.463 -6.906 1.00 14.34 H new ATOM 0 HB3 LYS A 120 -12.557 1.343 -5.508 1.00 14.34 H new ATOM 0 HG2 LYS A 120 -13.058 3.777 -5.642 1.00 12.23 H new ATOM 0 HG3 LYS A 120 -11.955 3.948 -6.993 1.00 12.23 H new ATOM 0 HD2 LYS A 120 -14.473 2.222 -7.033 1.00 1.32 H new ATOM 0 HD3 LYS A 120 -14.381 3.854 -7.663 1.00 1.32 H new ATOM 0 HE2 LYS A 120 -12.585 3.096 -9.265 1.00 31.13 H new ATOM 0 HE3 LYS A 120 -12.783 1.459 -8.672 1.00 31.13 H new ATOM 0 HZ1 LYS A 120 -14.038 1.819 -10.688 1.00 4.33 H new ATOM 0 HZ2 LYS A 120 -15.093 1.506 -9.395 1.00 4.33 H new ATOM 0 HZ3 LYS A 120 -14.901 3.093 -9.969 1.00 4.33 H new ATOM 2005 N GLU A 121 -11.603 2.502 -2.842 1.00 24.52 N ATOM 2006 CA GLU A 121 -12.076 3.133 -1.585 1.00 15.15 C ATOM 2007 C GLU A 121 -11.102 4.223 -1.092 1.00 64.45 C ATOM 2008 O GLU A 121 -11.522 5.302 -0.663 1.00 21.11 O ATOM 2009 CB GLU A 121 -12.222 2.028 -0.496 1.00 22.50 C ATOM 2010 CG GLU A 121 -12.626 2.499 0.920 1.00 5.34 C ATOM 2011 CD GLU A 121 -14.095 2.941 1.023 1.00 64.40 C ATOM 2012 OE1 GLU A 121 -14.984 2.064 1.054 1.00 20.20 O ATOM 2013 OE2 GLU A 121 -14.372 4.156 1.073 1.00 64.54 O ATOM 0 H GLU A 121 -11.658 1.484 -2.823 1.00 24.52 H new ATOM 0 HA GLU A 121 -13.036 3.612 -1.777 1.00 15.15 H new ATOM 0 HB2 GLU A 121 -12.964 1.307 -0.840 1.00 22.50 H new ATOM 0 HB3 GLU A 121 -11.273 1.497 -0.420 1.00 22.50 H new ATOM 0 HG2 GLU A 121 -12.448 1.690 1.628 1.00 5.34 H new ATOM 0 HG3 GLU A 121 -11.984 3.328 1.216 1.00 5.34 H new ATOM 2020 N LEU A 122 -9.796 3.917 -1.174 1.00 1.11 N ATOM 2021 CA LEU A 122 -8.728 4.828 -0.745 1.00 53.22 C ATOM 2022 C LEU A 122 -8.377 5.826 -1.848 1.00 33.23 C ATOM 2023 O LEU A 122 -8.169 7.008 -1.557 1.00 43.31 O ATOM 2024 CB LEU A 122 -7.480 4.024 -0.313 1.00 34.33 C ATOM 2025 CG LEU A 122 -7.712 3.055 0.880 1.00 10.41 C ATOM 2026 CD1 LEU A 122 -6.412 2.374 1.299 1.00 30.24 C ATOM 2027 CD2 LEU A 122 -8.364 3.783 2.070 1.00 21.14 C ATOM 0 H LEU A 122 -9.454 3.029 -1.541 1.00 1.11 H new ATOM 0 HA LEU A 122 -9.089 5.397 0.112 1.00 53.22 H new ATOM 0 HB2 LEU A 122 -7.122 3.448 -1.167 1.00 34.33 H new ATOM 0 HB3 LEU A 122 -6.688 4.724 -0.046 1.00 34.33 H new ATOM 0 HG LEU A 122 -8.401 2.279 0.546 1.00 10.41 H new ATOM 0 HD11 LEU A 122 -6.606 1.702 2.135 1.00 30.24 H new ATOM 0 HD12 LEU A 122 -6.014 1.803 0.460 1.00 30.24 H new ATOM 0 HD13 LEU A 122 -5.687 3.129 1.601 1.00 30.24 H new ATOM 0 HD21 LEU A 122 -8.514 3.080 2.889 1.00 21.14 H new ATOM 0 HD22 LEU A 122 -7.714 4.593 2.401 1.00 21.14 H new ATOM 0 HD23 LEU A 122 -9.326 4.193 1.763 1.00 21.14 H new ATOM 2039 N LEU A 123 -8.332 5.334 -3.113 1.00 62.43 N ATOM 2040 CA LEU A 123 -7.993 6.148 -4.305 1.00 55.44 C ATOM 2041 C LEU A 123 -8.825 7.443 -4.353 1.00 43.45 C ATOM 2042 O LEU A 123 -8.269 8.523 -4.519 1.00 62.41 O ATOM 2043 CB LEU A 123 -8.166 5.307 -5.627 1.00 1.33 C ATOM 2044 CG LEU A 123 -6.848 4.859 -6.347 1.00 5.13 C ATOM 2045 CD1 LEU A 123 -6.108 6.063 -6.973 1.00 13.34 C ATOM 2046 CD2 LEU A 123 -5.922 4.085 -5.380 1.00 43.41 C ATOM 0 H LEU A 123 -8.531 4.358 -3.333 1.00 62.43 H new ATOM 0 HA LEU A 123 -6.945 6.436 -4.226 1.00 55.44 H new ATOM 0 HB2 LEU A 123 -8.746 4.415 -5.391 1.00 1.33 H new ATOM 0 HB3 LEU A 123 -8.757 5.894 -6.330 1.00 1.33 H new ATOM 0 HG LEU A 123 -7.130 4.186 -7.157 1.00 5.13 H new ATOM 0 HD11 LEU A 123 -5.199 5.716 -7.464 1.00 13.34 H new ATOM 0 HD12 LEU A 123 -6.754 6.546 -7.706 1.00 13.34 H new ATOM 0 HD13 LEU A 123 -5.848 6.777 -6.191 1.00 13.34 H new ATOM 0 HD21 LEU A 123 -5.015 3.786 -5.906 1.00 43.41 H new ATOM 0 HD22 LEU A 123 -5.659 4.725 -4.538 1.00 43.41 H new ATOM 0 HD23 LEU A 123 -6.438 3.198 -5.014 1.00 43.41 H new ATOM 2058 N GLU A 124 -10.149 7.307 -4.148 1.00 40.41 N ATOM 2059 CA GLU A 124 -11.100 8.433 -4.178 1.00 71.52 C ATOM 2060 C GLU A 124 -10.731 9.502 -3.133 1.00 64.14 C ATOM 2061 O GLU A 124 -10.638 10.682 -3.457 1.00 35.02 O ATOM 2062 CB GLU A 124 -12.538 7.910 -3.931 1.00 31.13 C ATOM 2063 CG GLU A 124 -13.019 6.865 -4.958 1.00 74.12 C ATOM 2064 CD GLU A 124 -14.441 6.355 -4.676 1.00 72.34 C ATOM 2065 OE1 GLU A 124 -15.418 7.062 -5.009 1.00 14.04 O ATOM 2066 OE2 GLU A 124 -14.584 5.253 -4.111 1.00 65.44 O ATOM 0 H GLU A 124 -10.591 6.408 -3.956 1.00 40.41 H new ATOM 0 HA GLU A 124 -11.051 8.900 -5.162 1.00 71.52 H new ATOM 0 HB2 GLU A 124 -12.586 7.471 -2.934 1.00 31.13 H new ATOM 0 HB3 GLU A 124 -13.226 8.755 -3.941 1.00 31.13 H new ATOM 0 HG2 GLU A 124 -12.987 7.303 -5.956 1.00 74.12 H new ATOM 0 HG3 GLU A 124 -12.330 6.021 -4.959 1.00 74.12 H new ATOM 2073 N LYS A 125 -10.469 9.052 -1.894 1.00 14.32 N ATOM 2074 CA LYS A 125 -10.178 9.943 -0.751 1.00 45.32 C ATOM 2075 C LYS A 125 -8.843 10.697 -0.934 1.00 65.13 C ATOM 2076 O LYS A 125 -8.701 11.839 -0.482 1.00 72.41 O ATOM 2077 CB LYS A 125 -10.139 9.118 0.564 1.00 35.24 C ATOM 2078 CG LYS A 125 -11.420 8.311 0.838 1.00 62.23 C ATOM 2079 CD LYS A 125 -11.337 7.460 2.129 1.00 34.24 C ATOM 2080 CE LYS A 125 -12.591 6.600 2.329 1.00 65.55 C ATOM 2081 NZ LYS A 125 -12.530 5.766 3.557 1.00 40.22 N ATOM 0 H LYS A 125 -10.452 8.061 -1.654 1.00 14.32 H new ATOM 0 HA LYS A 125 -10.974 10.685 -0.699 1.00 45.32 H new ATOM 0 HB2 LYS A 125 -9.292 8.433 0.525 1.00 35.24 H new ATOM 0 HB3 LYS A 125 -9.963 9.795 1.400 1.00 35.24 H new ATOM 0 HG2 LYS A 125 -12.264 8.996 0.915 1.00 62.23 H new ATOM 0 HG3 LYS A 125 -11.618 7.655 -0.010 1.00 62.23 H new ATOM 0 HD2 LYS A 125 -10.459 6.816 2.083 1.00 34.24 H new ATOM 0 HD3 LYS A 125 -11.206 8.117 2.989 1.00 34.24 H new ATOM 0 HE2 LYS A 125 -13.466 7.248 2.379 1.00 65.55 H new ATOM 0 HE3 LYS A 125 -12.723 5.952 1.462 1.00 65.55 H new ATOM 0 HZ1 LYS A 125 -13.403 5.207 3.641 1.00 40.22 H new ATOM 0 HZ2 LYS A 125 -11.712 5.126 3.501 1.00 40.22 H new ATOM 0 HZ3 LYS A 125 -12.432 6.381 4.390 1.00 40.22 H new ATOM 2095 N VAL A 126 -7.874 10.032 -1.589 1.00 44.34 N ATOM 2096 CA VAL A 126 -6.546 10.597 -1.873 1.00 34.34 C ATOM 2097 C VAL A 126 -6.644 11.671 -2.983 1.00 20.01 C ATOM 2098 O VAL A 126 -6.134 12.782 -2.823 1.00 43.10 O ATOM 2099 CB VAL A 126 -5.533 9.458 -2.283 1.00 71.03 C ATOM 2100 CG1 VAL A 126 -4.161 10.028 -2.713 1.00 2.34 C ATOM 2101 CG2 VAL A 126 -5.361 8.428 -1.132 1.00 51.33 C ATOM 0 H VAL A 126 -7.993 9.081 -1.938 1.00 44.34 H new ATOM 0 HA VAL A 126 -6.171 11.073 -0.967 1.00 34.34 H new ATOM 0 HB VAL A 126 -5.959 8.947 -3.147 1.00 71.03 H new ATOM 0 HG11 VAL A 126 -3.496 9.209 -2.986 1.00 2.34 H new ATOM 0 HG12 VAL A 126 -4.294 10.689 -3.570 1.00 2.34 H new ATOM 0 HG13 VAL A 126 -3.725 10.589 -1.886 1.00 2.34 H new ATOM 0 HG21 VAL A 126 -4.658 7.653 -1.439 1.00 51.33 H new ATOM 0 HG22 VAL A 126 -4.979 8.934 -0.245 1.00 51.33 H new ATOM 0 HG23 VAL A 126 -6.325 7.973 -0.903 1.00 51.33 H new