USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1077 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 Single : A 3 THR OG1 : rot 130:sc= -0.634 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.0478 X(o=-0.048,f=-0.048) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 90:sc= 0.959 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 46:sc= 0.332 USER MOD Single : A 34 THR OG1 : rot 150:sc= 0.0921 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 153:sc= 0.714 (180deg=0.0347) USER MOD Single : A 41 LYS NZ :NH3+ -158:sc= 0.293 (180deg=0.0829) USER MOD Single : A 46 LYS NZ :NH3+ 152:sc= 0.718 (180deg=0.0196) USER MOD Single : A 49 LYS NZ :NH3+ -158:sc= 0.746 (180deg=0.505) USER MOD Single : A 50 GLN : amide:sc= -0.0268 X(o=-0.027,f=-0.18) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot -116:sc= -0.442 USER MOD Single : A 74 GLN : amide:sc= -0.267 K(o=-0.27,f=-2.2) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ 136:sc= -0.377 (180deg=-2.38) USER MOD Single : A 87 GLN : amide:sc= -1.01 K(o=-1,f=-3.6!) USER MOD Single : A 89 GLN : amide:sc= -0.11 K(o=-0.11,f=-7.8!) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0.113 X(o=0.11,f=-0.0017) USER MOD Single : A 100 LYS NZ :NH3+ 142:sc= -0.0182 (180deg=-0.32) USER MOD Single : A 101 LYS NZ :NH3+ -147:sc= -2.01 (180deg=-4.21!) USER MOD Single : A 109 THR OG1 : rot -64:sc= 0.47 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0.39) USER MOD Single : A 116 LYS NZ :NH3+ -125:sc= 0.919 (180deg=0.0321) USER MOD Single : A 117 LYS NZ :NH3+ -140:sc= 0.578 (180deg=-1.93!) 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 -2.230 -13.456 -0.379 1.00 72.33 N ATOM 21 CA GLY A 2 -0.893 -13.335 -0.964 1.00 11.43 C ATOM 22 C GLY A 2 -0.729 -12.015 -1.700 1.00 32.41 C ATOM 23 O GLY A 2 -0.018 -11.934 -2.706 1.00 15.54 O ATOM 0 HA2 GLY A 2 -0.142 -13.411 -0.178 1.00 11.43 H new ATOM 0 HA3 GLY A 2 -0.719 -14.162 -1.653 1.00 11.43 H new ATOM 27 N THR A 3 -1.427 -10.979 -1.195 1.00 65.25 N ATOM 28 CA THR A 3 -1.408 -9.631 -1.771 1.00 14.43 C ATOM 29 C THR A 3 -0.685 -8.659 -0.834 1.00 14.15 C ATOM 30 O THR A 3 -0.602 -8.891 0.384 1.00 24.24 O ATOM 31 CB THR A 3 -2.854 -9.105 -2.044 1.00 10.30 C ATOM 32 OG1 THR A 3 -3.569 -8.986 -0.810 1.00 20.33 O ATOM 33 CG2 THR A 3 -3.633 -10.031 -2.995 1.00 60.55 C ATOM 0 H THR A 3 -2.022 -11.060 -0.371 1.00 65.25 H new ATOM 0 HA THR A 3 -0.875 -9.690 -2.720 1.00 14.43 H new ATOM 0 HB THR A 3 -2.762 -8.130 -2.522 1.00 10.30 H new ATOM 0 HG1 THR A 3 -3.979 -8.098 -0.754 1.00 20.33 H new ATOM 0 HG21 THR A 3 -4.633 -9.628 -3.157 1.00 60.55 H new ATOM 0 HG22 THR A 3 -3.109 -10.097 -3.949 1.00 60.55 H new ATOM 0 HG23 THR A 3 -3.710 -11.025 -2.553 1.00 60.55 H new ATOM 41 N VAL A 4 -0.189 -7.550 -1.411 1.00 73.03 N ATOM 42 CA VAL A 4 0.495 -6.485 -0.668 1.00 70.41 C ATOM 43 C VAL A 4 -0.181 -5.175 -1.064 1.00 72.53 C ATOM 44 O VAL A 4 -0.101 -4.769 -2.227 1.00 74.11 O ATOM 45 CB VAL A 4 2.042 -6.426 -1.010 1.00 53.14 C ATOM 46 CG1 VAL A 4 2.768 -5.334 -0.189 1.00 70.45 C ATOM 47 CG2 VAL A 4 2.717 -7.799 -0.800 1.00 72.30 C ATOM 0 H VAL A 4 -0.254 -7.370 -2.413 1.00 73.03 H new ATOM 0 HA VAL A 4 0.422 -6.670 0.404 1.00 70.41 H new ATOM 0 HB VAL A 4 2.125 -6.163 -2.064 1.00 53.14 H new ATOM 0 HG11 VAL A 4 3.826 -5.325 -0.451 1.00 70.45 H new ATOM 0 HG12 VAL A 4 2.330 -4.361 -0.411 1.00 70.45 H new ATOM 0 HG13 VAL A 4 2.660 -5.546 0.875 1.00 70.45 H new ATOM 0 HG21 VAL A 4 3.777 -7.724 -1.043 1.00 72.30 H new ATOM 0 HG22 VAL A 4 2.604 -8.105 0.240 1.00 72.30 H new ATOM 0 HG23 VAL A 4 2.247 -8.538 -1.449 1.00 72.30 H new ATOM 57 N VAL A 5 -0.858 -4.531 -0.109 1.00 61.22 N ATOM 58 CA VAL A 5 -1.576 -3.270 -0.347 1.00 71.14 C ATOM 59 C VAL A 5 -0.860 -2.138 0.396 1.00 64.00 C ATOM 60 O VAL A 5 -0.588 -2.238 1.585 1.00 52.22 O ATOM 61 CB VAL A 5 -3.111 -3.361 0.037 1.00 42.52 C ATOM 62 CG1 VAL A 5 -3.879 -4.257 -0.971 1.00 33.42 C ATOM 63 CG2 VAL A 5 -3.327 -3.864 1.483 1.00 75.31 C ATOM 0 H VAL A 5 -0.925 -4.867 0.852 1.00 61.22 H new ATOM 0 HA VAL A 5 -1.561 -3.058 -1.416 1.00 71.14 H new ATOM 0 HB VAL A 5 -3.511 -2.348 -0.015 1.00 42.52 H new ATOM 0 HG11 VAL A 5 -4.930 -4.305 -0.688 1.00 33.42 H new ATOM 0 HG12 VAL A 5 -3.792 -3.835 -1.972 1.00 33.42 H new ATOM 0 HG13 VAL A 5 -3.455 -5.261 -0.962 1.00 33.42 H new ATOM 0 HG21 VAL A 5 -4.395 -3.909 1.697 1.00 75.31 H new ATOM 0 HG22 VAL A 5 -2.893 -4.858 1.591 1.00 75.31 H new ATOM 0 HG23 VAL A 5 -2.845 -3.180 2.182 1.00 75.31 H new ATOM 73 N ILE A 6 -0.496 -1.083 -0.340 1.00 41.04 N ATOM 74 CA ILE A 6 0.230 0.066 0.216 1.00 3.32 C ATOM 75 C ILE A 6 -0.670 1.291 0.095 1.00 50.44 C ATOM 76 O ILE A 6 -1.105 1.634 -1.009 1.00 10.22 O ATOM 77 CB ILE A 6 1.616 0.358 -0.507 1.00 41.12 C ATOM 78 CG1 ILE A 6 2.621 -0.849 -0.412 1.00 14.13 C ATOM 79 CG2 ILE A 6 2.268 1.641 0.071 1.00 2.14 C ATOM 80 CD1 ILE A 6 2.363 -1.997 -1.377 1.00 72.53 C ATOM 0 H ILE A 6 -0.696 -1.000 -1.337 1.00 41.04 H new ATOM 0 HA ILE A 6 0.472 -0.166 1.253 1.00 3.32 H new ATOM 0 HB ILE A 6 1.393 0.505 -1.564 1.00 41.12 H new ATOM 0 HG12 ILE A 6 3.630 -0.473 -0.584 1.00 14.13 H new ATOM 0 HG13 ILE A 6 2.596 -1.240 0.605 1.00 14.13 H new ATOM 0 HG21 ILE A 6 3.216 1.827 -0.434 1.00 2.14 H new ATOM 0 HG22 ILE A 6 1.601 2.489 -0.084 1.00 2.14 H new ATOM 0 HG23 ILE A 6 2.446 1.510 1.138 1.00 2.14 H new ATOM 0 HD11 ILE A 6 3.113 -2.774 -1.227 1.00 72.53 H new ATOM 0 HD12 ILE A 6 1.371 -2.410 -1.195 1.00 72.53 H new ATOM 0 HD13 ILE A 6 2.421 -1.631 -2.402 1.00 72.53 H new ATOM 92 N VAL A 7 -0.935 1.942 1.227 1.00 4.13 N ATOM 93 CA VAL A 7 -1.714 3.170 1.268 1.00 71.53 C ATOM 94 C VAL A 7 -0.755 4.342 1.033 1.00 11.34 C ATOM 95 O VAL A 7 0.081 4.675 1.888 1.00 21.20 O ATOM 96 CB VAL A 7 -2.457 3.341 2.642 1.00 70.11 C ATOM 97 CG1 VAL A 7 -3.443 4.533 2.604 1.00 62.03 C ATOM 98 CG2 VAL A 7 -3.168 2.035 3.043 1.00 43.12 C ATOM 0 H VAL A 7 -0.612 1.628 2.142 1.00 4.13 H new ATOM 0 HA VAL A 7 -2.482 3.137 0.495 1.00 71.53 H new ATOM 0 HB VAL A 7 -1.710 3.564 3.404 1.00 70.11 H new ATOM 0 HG11 VAL A 7 -3.941 4.624 3.569 1.00 62.03 H new ATOM 0 HG12 VAL A 7 -2.896 5.451 2.390 1.00 62.03 H new ATOM 0 HG13 VAL A 7 -4.188 4.364 1.826 1.00 62.03 H new ATOM 0 HG21 VAL A 7 -3.676 2.175 3.997 1.00 43.12 H new ATOM 0 HG22 VAL A 7 -3.898 1.769 2.279 1.00 43.12 H new ATOM 0 HG23 VAL A 7 -2.434 1.235 3.137 1.00 43.12 H new ATOM 108 N VAL A 8 -0.850 4.902 -0.169 1.00 11.53 N ATOM 109 CA VAL A 8 -0.063 6.050 -0.611 1.00 61.43 C ATOM 110 C VAL A 8 -0.937 7.306 -0.521 1.00 10.10 C ATOM 111 O VAL A 8 -1.988 7.385 -1.165 1.00 40.04 O ATOM 112 CB VAL A 8 0.445 5.846 -2.087 1.00 31.24 C ATOM 113 CG1 VAL A 8 1.124 7.121 -2.626 1.00 14.43 C ATOM 114 CG2 VAL A 8 1.380 4.613 -2.198 1.00 62.23 C ATOM 0 H VAL A 8 -1.494 4.561 -0.883 1.00 11.53 H new ATOM 0 HA VAL A 8 0.812 6.157 0.030 1.00 61.43 H new ATOM 0 HB VAL A 8 -0.426 5.650 -2.712 1.00 31.24 H new ATOM 0 HG11 VAL A 8 1.464 6.948 -3.647 1.00 14.43 H new ATOM 0 HG12 VAL A 8 0.411 7.945 -2.615 1.00 14.43 H new ATOM 0 HG13 VAL A 8 1.978 7.372 -1.997 1.00 14.43 H new ATOM 0 HG21 VAL A 8 1.713 4.501 -3.230 1.00 62.23 H new ATOM 0 HG22 VAL A 8 2.246 4.753 -1.551 1.00 62.23 H new ATOM 0 HG23 VAL A 8 0.839 3.718 -1.892 1.00 62.23 H new ATOM 124 N SER A 9 -0.517 8.265 0.307 1.00 53.24 N ATOM 125 CA SER A 9 -1.220 9.539 0.489 1.00 31.12 C ATOM 126 C SER A 9 -0.173 10.641 0.698 1.00 24.00 C ATOM 127 O SER A 9 0.779 10.450 1.457 1.00 71.42 O ATOM 128 CB SER A 9 -2.170 9.462 1.709 1.00 53.41 C ATOM 129 OG SER A 9 -2.971 8.288 1.709 1.00 31.41 O ATOM 0 H SER A 9 0.326 8.180 0.874 1.00 53.24 H new ATOM 0 HA SER A 9 -1.823 9.759 -0.392 1.00 31.12 H new ATOM 0 HB2 SER A 9 -1.581 9.494 2.625 1.00 53.41 H new ATOM 0 HB3 SER A 9 -2.818 10.339 1.715 1.00 53.41 H new ATOM 0 HG SER A 9 -3.551 8.287 2.499 1.00 31.41 H new ATOM 135 N ASN A 10 -0.352 11.779 0.020 1.00 74.22 N ATOM 136 CA ASN A 10 0.580 12.929 0.092 1.00 21.41 C ATOM 137 C ASN A 10 0.411 13.702 1.425 1.00 4.52 C ATOM 138 O ASN A 10 1.349 14.358 1.900 1.00 60.52 O ATOM 139 CB ASN A 10 0.359 13.839 -1.146 1.00 45.41 C ATOM 140 CG ASN A 10 1.304 15.045 -1.213 1.00 11.14 C ATOM 141 OD1 ASN A 10 0.970 16.139 -0.755 1.00 14.22 O ATOM 142 ND2 ASN A 10 2.489 14.857 -1.771 1.00 75.53 N ATOM 0 H ASN A 10 -1.147 11.938 -0.599 1.00 74.22 H new ATOM 0 HA ASN A 10 1.608 12.568 0.076 1.00 21.41 H new ATOM 0 HB2 ASN A 10 0.484 13.242 -2.049 1.00 45.41 H new ATOM 0 HB3 ASN A 10 -0.670 14.197 -1.141 1.00 45.41 H new ATOM 0 HD21 ASN A 10 3.153 15.629 -1.830 1.00 75.53 H new ATOM 0 HD22 ASN A 10 2.738 13.940 -2.142 1.00 75.53 H new ATOM 149 N ASP A 11 -0.793 13.599 2.021 1.00 42.20 N ATOM 150 CA ASP A 11 -1.109 14.174 3.349 1.00 54.50 C ATOM 151 C ASP A 11 -1.041 13.069 4.432 1.00 55.05 C ATOM 152 O ASP A 11 -1.348 11.902 4.158 1.00 13.12 O ATOM 153 CB ASP A 11 -2.508 14.835 3.322 1.00 11.32 C ATOM 154 CG ASP A 11 -2.878 15.538 4.646 1.00 62.21 C ATOM 155 OD1 ASP A 11 -2.523 16.721 4.822 1.00 62.35 O ATOM 156 OD2 ASP A 11 -3.498 14.901 5.531 1.00 44.11 O ATOM 0 H ASP A 11 -1.581 13.112 1.594 1.00 42.20 H new ATOM 0 HA ASP A 11 -0.374 14.941 3.593 1.00 54.50 H new ATOM 0 HB2 ASP A 11 -2.543 15.562 2.511 1.00 11.32 H new ATOM 0 HB3 ASP A 11 -3.257 14.075 3.101 1.00 11.32 H new ATOM 161 N GLU A 12 -0.662 13.463 5.663 1.00 2.24 N ATOM 162 CA GLU A 12 -0.379 12.532 6.777 1.00 40.01 C ATOM 163 C GLU A 12 -1.656 12.160 7.552 1.00 33.33 C ATOM 164 O GLU A 12 -1.844 11.000 7.931 1.00 31.11 O ATOM 165 CB GLU A 12 0.651 13.178 7.734 1.00 12.41 C ATOM 166 CG GLU A 12 1.172 12.252 8.845 1.00 5.11 C ATOM 167 CD GLU A 12 2.140 12.966 9.789 1.00 13.25 C ATOM 168 OE1 GLU A 12 1.674 13.602 10.755 1.00 64.24 O ATOM 169 OE2 GLU A 12 3.369 12.910 9.564 1.00 41.21 O ATOM 0 H GLU A 12 -0.542 14.444 5.916 1.00 2.24 H new ATOM 0 HA GLU A 12 0.027 11.612 6.356 1.00 40.01 H new ATOM 0 HB2 GLU A 12 1.499 13.530 7.147 1.00 12.41 H new ATOM 0 HB3 GLU A 12 0.196 14.055 8.195 1.00 12.41 H new ATOM 0 HG2 GLU A 12 0.329 11.865 9.417 1.00 5.11 H new ATOM 0 HG3 GLU A 12 1.673 11.395 8.395 1.00 5.11 H new ATOM 176 N ARG A 13 -2.530 13.161 7.785 1.00 73.24 N ATOM 177 CA ARG A 13 -3.801 12.961 8.510 1.00 52.45 C ATOM 178 C ARG A 13 -4.760 12.082 7.705 1.00 54.34 C ATOM 179 O ARG A 13 -5.642 11.448 8.282 1.00 65.32 O ATOM 180 CB ARG A 13 -4.486 14.299 8.853 1.00 32.30 C ATOM 181 CG ARG A 13 -3.724 15.177 9.862 1.00 1.32 C ATOM 182 CD ARG A 13 -4.515 16.433 10.269 1.00 30.24 C ATOM 183 NE ARG A 13 -3.787 17.233 11.264 1.00 41.23 N ATOM 184 CZ ARG A 13 -3.845 17.057 12.593 1.00 22.45 C ATOM 185 NH1 ARG A 13 -4.614 16.110 13.132 1.00 32.01 N ATOM 186 NH2 ARG A 13 -3.121 17.831 13.378 1.00 72.02 N ATOM 0 H ARG A 13 -2.377 14.122 7.479 1.00 73.24 H new ATOM 0 HA ARG A 13 -3.553 12.457 9.444 1.00 52.45 H new ATOM 0 HB2 ARG A 13 -4.625 14.866 7.932 1.00 32.30 H new ATOM 0 HB3 ARG A 13 -5.479 14.091 9.252 1.00 32.30 H new ATOM 0 HG2 ARG A 13 -3.499 14.589 10.752 1.00 1.32 H new ATOM 0 HG3 ARG A 13 -2.770 15.477 9.429 1.00 1.32 H new ATOM 0 HD2 ARG A 13 -4.712 17.041 9.386 1.00 30.24 H new ATOM 0 HD3 ARG A 13 -5.482 16.138 10.676 1.00 30.24 H new ATOM 0 HE ARG A 13 -3.189 17.983 10.916 1.00 41.23 H new ATOM 0 HH11 ARG A 13 -5.172 15.503 12.531 1.00 32.01 H new ATOM 0 HH12 ARG A 13 -4.644 15.993 14.145 1.00 32.01 H new ATOM 0 HH21 ARG A 13 -2.526 18.554 12.973 1.00 72.02 H new ATOM 0 HH22 ARG A 13 -3.157 17.707 14.390 1.00 72.02 H new ATOM 200 N ILE A 14 -4.600 12.090 6.367 1.00 24.32 N ATOM 201 CA ILE A 14 -5.316 11.164 5.484 1.00 74.53 C ATOM 202 C ILE A 14 -4.916 9.720 5.830 1.00 45.32 C ATOM 203 O ILE A 14 -5.777 8.900 6.068 1.00 11.51 O ATOM 204 CB ILE A 14 -5.067 11.491 3.961 1.00 45.55 C ATOM 205 CG1 ILE A 14 -5.565 12.933 3.634 1.00 24.04 C ATOM 206 CG2 ILE A 14 -5.739 10.461 3.025 1.00 43.31 C ATOM 207 CD1 ILE A 14 -7.012 13.224 4.016 1.00 62.13 C ATOM 0 H ILE A 14 -3.977 12.733 5.878 1.00 24.32 H new ATOM 0 HA ILE A 14 -6.387 11.282 5.647 1.00 74.53 H new ATOM 0 HB ILE A 14 -3.993 11.432 3.784 1.00 45.55 H new ATOM 0 HG12 ILE A 14 -4.920 13.647 4.146 1.00 24.04 H new ATOM 0 HG13 ILE A 14 -5.447 13.107 2.564 1.00 24.04 H new ATOM 0 HG21 ILE A 14 -5.540 10.728 1.987 1.00 43.31 H new ATOM 0 HG22 ILE A 14 -5.337 9.468 3.228 1.00 43.31 H new ATOM 0 HG23 ILE A 14 -6.815 10.459 3.199 1.00 43.31 H new ATOM 0 HD11 ILE A 14 -7.260 14.251 3.748 1.00 62.13 H new ATOM 0 HD12 ILE A 14 -7.673 12.540 3.484 1.00 62.13 H new ATOM 0 HD13 ILE A 14 -7.139 13.089 5.090 1.00 62.13 H new ATOM 219 N LEU A 15 -3.603 9.460 5.955 1.00 21.34 N ATOM 220 CA LEU A 15 -3.075 8.136 6.367 1.00 2.03 C ATOM 221 C LEU A 15 -3.584 7.716 7.766 1.00 42.33 C ATOM 222 O LEU A 15 -3.790 6.530 8.014 1.00 14.31 O ATOM 223 CB LEU A 15 -1.531 8.159 6.375 1.00 62.42 C ATOM 224 CG LEU A 15 -0.823 8.232 4.998 1.00 21.21 C ATOM 225 CD1 LEU A 15 0.681 8.484 5.186 1.00 63.05 C ATOM 226 CD2 LEU A 15 -1.078 6.948 4.174 1.00 54.24 C ATOM 0 H LEU A 15 -2.877 10.154 5.776 1.00 21.34 H new ATOM 0 HA LEU A 15 -3.436 7.407 5.642 1.00 2.03 H new ATOM 0 HB2 LEU A 15 -1.208 9.014 6.968 1.00 62.42 H new ATOM 0 HB3 LEU A 15 -1.181 7.264 6.889 1.00 62.42 H new ATOM 0 HG LEU A 15 -1.242 9.068 4.438 1.00 21.21 H new ATOM 0 HD11 LEU A 15 1.166 8.533 4.211 1.00 63.05 H new ATOM 0 HD12 LEU A 15 0.829 9.427 5.713 1.00 63.05 H new ATOM 0 HD13 LEU A 15 1.116 7.671 5.767 1.00 63.05 H new ATOM 0 HD21 LEU A 15 -0.570 7.026 3.213 1.00 54.24 H new ATOM 0 HD22 LEU A 15 -0.695 6.085 4.718 1.00 54.24 H new ATOM 0 HD23 LEU A 15 -2.149 6.828 4.010 1.00 54.24 H new ATOM 238 N GLU A 16 -3.770 8.701 8.669 1.00 64.14 N ATOM 239 CA GLU A 16 -4.235 8.456 10.049 1.00 15.34 C ATOM 240 C GLU A 16 -5.723 8.055 10.061 1.00 53.13 C ATOM 241 O GLU A 16 -6.114 7.077 10.707 1.00 62.41 O ATOM 242 CB GLU A 16 -4.020 9.725 10.907 1.00 1.12 C ATOM 243 CG GLU A 16 -4.316 9.548 12.409 1.00 25.25 C ATOM 244 CD GLU A 16 -3.303 8.630 13.120 1.00 42.23 C ATOM 245 OE1 GLU A 16 -2.226 9.123 13.533 1.00 60.14 O ATOM 246 OE2 GLU A 16 -3.553 7.415 13.242 1.00 32.13 O ATOM 0 H GLU A 16 -3.602 9.686 8.462 1.00 64.14 H new ATOM 0 HA GLU A 16 -3.656 7.634 10.470 1.00 15.34 H new ATOM 0 HB2 GLU A 16 -2.987 10.054 10.791 1.00 1.12 H new ATOM 0 HB3 GLU A 16 -4.654 10.521 10.518 1.00 1.12 H new ATOM 0 HG2 GLU A 16 -4.313 10.525 12.892 1.00 25.25 H new ATOM 0 HG3 GLU A 16 -5.318 9.136 12.530 1.00 25.25 H new ATOM 253 N GLU A 17 -6.530 8.842 9.334 1.00 45.34 N ATOM 254 CA GLU A 17 -7.966 8.593 9.116 1.00 4.20 C ATOM 255 C GLU A 17 -8.186 7.205 8.475 1.00 20.52 C ATOM 256 O GLU A 17 -9.020 6.407 8.917 1.00 14.11 O ATOM 257 CB GLU A 17 -8.514 9.723 8.197 1.00 33.31 C ATOM 258 CG GLU A 17 -9.992 9.596 7.779 1.00 63.33 C ATOM 259 CD GLU A 17 -10.959 9.523 8.969 1.00 63.31 C ATOM 260 OE1 GLU A 17 -11.031 10.501 9.745 1.00 63.23 O ATOM 261 OE2 GLU A 17 -11.668 8.510 9.118 1.00 3.45 O ATOM 0 H GLU A 17 -6.197 9.688 8.871 1.00 45.34 H new ATOM 0 HA GLU A 17 -8.498 8.597 10.067 1.00 4.20 H new ATOM 0 HB2 GLU A 17 -8.382 10.676 8.709 1.00 33.31 H new ATOM 0 HB3 GLU A 17 -7.903 9.759 7.295 1.00 33.31 H new ATOM 0 HG2 GLU A 17 -10.260 10.449 7.155 1.00 63.33 H new ATOM 0 HG3 GLU A 17 -10.113 8.702 7.167 1.00 63.33 H new ATOM 268 N LEU A 18 -7.372 6.946 7.449 1.00 41.43 N ATOM 269 CA LEU A 18 -7.383 5.719 6.649 1.00 23.34 C ATOM 270 C LEU A 18 -6.871 4.510 7.466 1.00 61.22 C ATOM 271 O LEU A 18 -7.287 3.374 7.209 1.00 43.54 O ATOM 272 CB LEU A 18 -6.537 5.953 5.353 1.00 50.13 C ATOM 273 CG LEU A 18 -7.289 6.555 4.101 1.00 4.35 C ATOM 274 CD1 LEU A 18 -8.117 7.821 4.418 1.00 63.32 C ATOM 275 CD2 LEU A 18 -6.289 6.813 2.952 1.00 44.04 C ATOM 0 H LEU A 18 -6.661 7.609 7.141 1.00 41.43 H new ATOM 0 HA LEU A 18 -8.407 5.480 6.362 1.00 23.34 H new ATOM 0 HB2 LEU A 18 -5.711 6.619 5.604 1.00 50.13 H new ATOM 0 HB3 LEU A 18 -6.099 4.999 5.058 1.00 50.13 H new ATOM 0 HG LEU A 18 -8.016 5.806 3.787 1.00 4.35 H new ATOM 0 HD11 LEU A 18 -8.603 8.175 3.509 1.00 63.32 H new ATOM 0 HD12 LEU A 18 -8.874 7.583 5.165 1.00 63.32 H new ATOM 0 HD13 LEU A 18 -7.459 8.599 4.804 1.00 63.32 H new ATOM 0 HD21 LEU A 18 -6.819 7.228 2.095 1.00 44.04 H new ATOM 0 HD22 LEU A 18 -5.527 7.519 3.284 1.00 44.04 H new ATOM 0 HD23 LEU A 18 -5.814 5.875 2.666 1.00 44.04 H new ATOM 287 N LEU A 19 -5.975 4.778 8.452 1.00 60.30 N ATOM 288 CA LEU A 19 -5.386 3.737 9.329 1.00 71.33 C ATOM 289 C LEU A 19 -6.475 2.982 10.077 1.00 63.45 C ATOM 290 O LEU A 19 -6.569 1.756 10.004 1.00 53.23 O ATOM 291 CB LEU A 19 -4.409 4.352 10.369 1.00 52.20 C ATOM 292 CG LEU A 19 -3.671 3.318 11.302 1.00 71.20 C ATOM 293 CD1 LEU A 19 -2.416 2.731 10.627 1.00 53.10 C ATOM 294 CD2 LEU A 19 -3.353 3.915 12.688 1.00 3.44 C ATOM 0 H LEU A 19 -5.643 5.720 8.659 1.00 60.30 H new ATOM 0 HA LEU A 19 -4.836 3.054 8.682 1.00 71.33 H new ATOM 0 HB2 LEU A 19 -3.658 4.934 9.836 1.00 52.20 H new ATOM 0 HB3 LEU A 19 -4.965 5.048 10.997 1.00 52.20 H new ATOM 0 HG LEU A 19 -4.361 2.490 11.466 1.00 71.20 H new ATOM 0 HD11 LEU A 19 -1.937 2.023 11.303 1.00 53.10 H new ATOM 0 HD12 LEU A 19 -2.703 2.218 9.709 1.00 53.10 H new ATOM 0 HD13 LEU A 19 -1.720 3.536 10.391 1.00 53.10 H new ATOM 0 HD21 LEU A 19 -2.845 3.168 13.298 1.00 3.44 H new ATOM 0 HD22 LEU A 19 -2.709 4.786 12.570 1.00 3.44 H new ATOM 0 HD23 LEU A 19 -4.280 4.213 13.177 1.00 3.44 H new ATOM 306 N GLU A 20 -7.316 3.771 10.750 1.00 10.34 N ATOM 307 CA GLU A 20 -8.353 3.285 11.660 1.00 71.45 C ATOM 308 C GLU A 20 -9.421 2.487 10.895 1.00 52.32 C ATOM 309 O GLU A 20 -10.010 1.553 11.437 1.00 50.13 O ATOM 310 CB GLU A 20 -8.975 4.493 12.390 1.00 12.21 C ATOM 311 CG GLU A 20 -7.941 5.483 12.985 1.00 62.11 C ATOM 312 CD GLU A 20 -8.588 6.760 13.535 1.00 63.04 C ATOM 313 OE1 GLU A 20 -9.176 7.522 12.737 1.00 14.05 O ATOM 314 OE2 GLU A 20 -8.555 6.995 14.767 1.00 24.02 O ATOM 0 H GLU A 20 -7.293 4.788 10.675 1.00 10.34 H new ATOM 0 HA GLU A 20 -7.912 2.609 12.393 1.00 71.45 H new ATOM 0 HB2 GLU A 20 -9.617 5.032 11.693 1.00 12.21 H new ATOM 0 HB3 GLU A 20 -9.614 4.127 13.194 1.00 12.21 H new ATOM 0 HG2 GLU A 20 -7.389 4.988 13.784 1.00 62.11 H new ATOM 0 HG3 GLU A 20 -7.217 5.751 12.216 1.00 62.11 H new ATOM 321 N VAL A 21 -9.630 2.866 9.619 1.00 71.45 N ATOM 322 CA VAL A 21 -10.576 2.194 8.717 1.00 44.10 C ATOM 323 C VAL A 21 -10.079 0.779 8.347 1.00 44.32 C ATOM 324 O VAL A 21 -10.873 -0.164 8.299 1.00 5.11 O ATOM 325 CB VAL A 21 -10.843 3.059 7.429 1.00 52.31 C ATOM 326 CG1 VAL A 21 -11.777 2.336 6.427 1.00 73.13 C ATOM 327 CG2 VAL A 21 -11.425 4.439 7.820 1.00 11.53 C ATOM 0 H VAL A 21 -9.143 3.651 9.186 1.00 71.45 H new ATOM 0 HA VAL A 21 -11.523 2.086 9.245 1.00 44.10 H new ATOM 0 HB VAL A 21 -9.886 3.206 6.928 1.00 52.31 H new ATOM 0 HG11 VAL A 21 -11.934 2.969 5.554 1.00 73.13 H new ATOM 0 HG12 VAL A 21 -11.320 1.396 6.117 1.00 73.13 H new ATOM 0 HG13 VAL A 21 -12.736 2.133 6.905 1.00 73.13 H new ATOM 0 HG21 VAL A 21 -11.605 5.026 6.920 1.00 11.53 H new ATOM 0 HG22 VAL A 21 -12.364 4.299 8.356 1.00 11.53 H new ATOM 0 HG23 VAL A 21 -10.717 4.964 8.461 1.00 11.53 H new ATOM 337 N VAL A 22 -8.760 0.629 8.128 1.00 31.21 N ATOM 338 CA VAL A 22 -8.150 -0.683 7.836 1.00 31.30 C ATOM 339 C VAL A 22 -8.142 -1.560 9.105 1.00 73.22 C ATOM 340 O VAL A 22 -8.432 -2.757 9.041 1.00 41.02 O ATOM 341 CB VAL A 22 -6.690 -0.536 7.263 1.00 12.13 C ATOM 342 CG1 VAL A 22 -6.052 -1.911 6.967 1.00 24.32 C ATOM 343 CG2 VAL A 22 -6.688 0.339 5.992 1.00 70.22 C ATOM 0 H VAL A 22 -8.094 1.401 8.148 1.00 31.21 H new ATOM 0 HA VAL A 22 -8.756 -1.166 7.069 1.00 31.30 H new ATOM 0 HB VAL A 22 -6.088 -0.047 8.029 1.00 12.13 H new ATOM 0 HG11 VAL A 22 -5.046 -1.768 6.573 1.00 24.32 H new ATOM 0 HG12 VAL A 22 -6.003 -2.495 7.886 1.00 24.32 H new ATOM 0 HG13 VAL A 22 -6.657 -2.442 6.232 1.00 24.32 H new ATOM 0 HG21 VAL A 22 -5.670 0.428 5.613 1.00 70.22 H new ATOM 0 HG22 VAL A 22 -7.319 -0.122 5.232 1.00 70.22 H new ATOM 0 HG23 VAL A 22 -7.073 1.330 6.232 1.00 70.22 H new ATOM 353 N LEU A 23 -7.837 -0.917 10.259 1.00 31.34 N ATOM 354 CA LEU A 23 -7.811 -1.567 11.588 1.00 62.54 C ATOM 355 C LEU A 23 -9.170 -2.208 11.938 1.00 63.31 C ATOM 356 O LEU A 23 -9.233 -3.376 12.341 1.00 50.11 O ATOM 357 CB LEU A 23 -7.429 -0.535 12.694 1.00 73.03 C ATOM 358 CG LEU A 23 -5.965 0.013 12.685 1.00 44.23 C ATOM 359 CD1 LEU A 23 -5.774 1.097 13.777 1.00 14.35 C ATOM 360 CD2 LEU A 23 -4.943 -1.133 12.851 1.00 41.51 C ATOM 0 H LEU A 23 -7.601 0.075 10.291 1.00 31.34 H new ATOM 0 HA LEU A 23 -7.059 -2.355 11.545 1.00 62.54 H new ATOM 0 HB2 LEU A 23 -8.108 0.314 12.613 1.00 73.03 H new ATOM 0 HB3 LEU A 23 -7.611 -0.997 13.664 1.00 73.03 H new ATOM 0 HG LEU A 23 -5.785 0.479 11.716 1.00 44.23 H new ATOM 0 HD11 LEU A 23 -4.748 1.463 13.751 1.00 14.35 H new ATOM 0 HD12 LEU A 23 -6.459 1.924 13.592 1.00 14.35 H new ATOM 0 HD13 LEU A 23 -5.981 0.667 14.757 1.00 14.35 H new ATOM 0 HD21 LEU A 23 -3.933 -0.724 12.841 1.00 41.51 H new ATOM 0 HD22 LEU A 23 -5.119 -1.643 13.798 1.00 41.51 H new ATOM 0 HD23 LEU A 23 -5.055 -1.842 12.031 1.00 41.51 H new ATOM 372 N LYS A 24 -10.253 -1.420 11.774 1.00 63.14 N ATOM 373 CA LYS A 24 -11.611 -1.825 12.184 1.00 40.55 C ATOM 374 C LYS A 24 -12.156 -2.932 11.267 1.00 31.43 C ATOM 375 O LYS A 24 -12.807 -3.865 11.745 1.00 13.12 O ATOM 376 CB LYS A 24 -12.571 -0.599 12.223 1.00 35.51 C ATOM 377 CG LYS A 24 -12.866 0.071 10.860 1.00 71.21 C ATOM 378 CD LYS A 24 -13.591 1.435 10.986 1.00 55.22 C ATOM 379 CE LYS A 24 -15.002 1.329 11.591 1.00 61.13 C ATOM 380 NZ LYS A 24 -15.572 2.675 11.890 1.00 44.43 N ATOM 0 H LYS A 24 -10.210 -0.491 11.356 1.00 63.14 H new ATOM 0 HA LYS A 24 -11.551 -2.231 13.194 1.00 40.55 H new ATOM 0 HB2 LYS A 24 -13.517 -0.916 12.662 1.00 35.51 H new ATOM 0 HB3 LYS A 24 -12.145 0.151 12.890 1.00 35.51 H new ATOM 0 HG2 LYS A 24 -11.928 0.215 10.324 1.00 71.21 H new ATOM 0 HG3 LYS A 24 -13.477 -0.602 10.258 1.00 71.21 H new ATOM 0 HD2 LYS A 24 -12.989 2.101 11.604 1.00 55.22 H new ATOM 0 HD3 LYS A 24 -13.661 1.892 9.999 1.00 55.22 H new ATOM 0 HE2 LYS A 24 -15.657 0.801 10.898 1.00 61.13 H new ATOM 0 HE3 LYS A 24 -14.963 0.738 12.506 1.00 61.13 H new ATOM 0 HZ1 LYS A 24 -16.523 2.567 12.296 1.00 44.43 H new ATOM 0 HZ2 LYS A 24 -14.959 3.168 12.570 1.00 44.43 H new ATOM 0 HZ3 LYS A 24 -15.632 3.230 11.012 1.00 44.43 H new ATOM 394 N SER A 25 -11.839 -2.836 9.961 1.00 30.45 N ATOM 395 CA SER A 25 -12.298 -3.801 8.948 1.00 12.52 C ATOM 396 C SER A 25 -11.567 -5.148 9.100 1.00 42.23 C ATOM 397 O SER A 25 -12.196 -6.216 9.023 1.00 71.14 O ATOM 398 CB SER A 25 -12.099 -3.211 7.539 1.00 54.30 C ATOM 399 OG SER A 25 -12.818 -1.997 7.402 1.00 1.40 O ATOM 0 H SER A 25 -11.259 -2.088 9.581 1.00 30.45 H new ATOM 0 HA SER A 25 -13.361 -3.991 9.097 1.00 12.52 H new ATOM 0 HB2 SER A 25 -11.039 -3.035 7.359 1.00 54.30 H new ATOM 0 HB3 SER A 25 -12.435 -3.926 6.788 1.00 54.30 H new ATOM 0 HG SER A 25 -12.248 -1.247 7.671 1.00 1.40 H new ATOM 405 N ASP A 26 -10.244 -5.095 9.347 1.00 43.02 N ATOM 406 CA ASP A 26 -9.428 -6.302 9.578 1.00 24.12 C ATOM 407 C ASP A 26 -8.268 -5.975 10.551 1.00 62.34 C ATOM 408 O ASP A 26 -7.384 -5.180 10.211 1.00 52.53 O ATOM 409 CB ASP A 26 -8.875 -6.880 8.242 1.00 40.53 C ATOM 410 CG ASP A 26 -8.414 -8.349 8.371 1.00 24.53 C ATOM 411 OD1 ASP A 26 -7.380 -8.613 9.007 1.00 75.22 O ATOM 412 OD2 ASP A 26 -9.090 -9.247 7.832 1.00 15.54 O ATOM 0 H ASP A 26 -9.715 -4.224 9.392 1.00 43.02 H new ATOM 0 HA ASP A 26 -10.066 -7.064 10.025 1.00 24.12 H new ATOM 0 HB2 ASP A 26 -9.646 -6.812 7.475 1.00 40.53 H new ATOM 0 HB3 ASP A 26 -8.037 -6.269 7.906 1.00 40.53 H new ATOM 417 N PRO A 27 -8.265 -6.570 11.787 1.00 75.32 N ATOM 418 CA PRO A 27 -7.170 -6.372 12.771 1.00 60.44 C ATOM 419 C PRO A 27 -5.974 -7.340 12.578 1.00 31.04 C ATOM 420 O PRO A 27 -4.911 -7.143 13.187 1.00 1.04 O ATOM 421 CB PRO A 27 -7.899 -6.636 14.107 1.00 15.03 C ATOM 422 CG PRO A 27 -8.905 -7.706 13.778 1.00 54.43 C ATOM 423 CD PRO A 27 -9.346 -7.441 12.347 1.00 33.30 C ATOM 0 HA PRO A 27 -6.706 -5.389 12.688 1.00 60.44 H new ATOM 0 HB2 PRO A 27 -7.205 -6.967 14.880 1.00 15.03 H new ATOM 0 HB3 PRO A 27 -8.385 -5.734 14.480 1.00 15.03 H new ATOM 0 HG2 PRO A 27 -8.464 -8.698 13.873 1.00 54.43 H new ATOM 0 HG3 PRO A 27 -9.753 -7.667 14.461 1.00 54.43 H new ATOM 0 HD2 PRO A 27 -9.444 -8.368 11.782 1.00 33.30 H new ATOM 0 HD3 PRO A 27 -10.315 -6.944 12.314 1.00 33.30 H new ATOM 431 N ASN A 28 -6.157 -8.378 11.737 1.00 54.32 N ATOM 432 CA ASN A 28 -5.175 -9.477 11.567 1.00 35.32 C ATOM 433 C ASN A 28 -4.080 -9.098 10.552 1.00 54.45 C ATOM 434 O ASN A 28 -2.957 -9.624 10.613 1.00 32.40 O ATOM 435 CB ASN A 28 -5.878 -10.781 11.102 1.00 13.13 C ATOM 436 CG ASN A 28 -7.028 -11.243 12.006 1.00 1.14 C ATOM 437 OD1 ASN A 28 -7.033 -11.004 13.218 1.00 4.21 O ATOM 438 ND2 ASN A 28 -8.008 -11.920 11.425 1.00 41.22 N ATOM 0 H ASN A 28 -6.988 -8.481 11.155 1.00 54.32 H new ATOM 0 HA ASN A 28 -4.710 -9.646 12.538 1.00 35.32 H new ATOM 0 HB2 ASN A 28 -6.264 -10.631 10.094 1.00 13.13 H new ATOM 0 HB3 ASN A 28 -5.136 -11.577 11.044 1.00 13.13 H new ATOM 0 HD21 ASN A 28 -8.793 -12.259 11.981 1.00 41.22 H new ATOM 0 HD22 ASN A 28 -7.977 -12.102 10.422 1.00 41.22 H new ATOM 445 N VAL A 29 -4.429 -8.205 9.606 1.00 45.05 N ATOM 446 CA VAL A 29 -3.486 -7.711 8.580 1.00 71.14 C ATOM 447 C VAL A 29 -2.385 -6.843 9.223 1.00 63.12 C ATOM 448 O VAL A 29 -2.627 -6.154 10.227 1.00 53.14 O ATOM 449 CB VAL A 29 -4.215 -6.901 7.440 1.00 42.44 C ATOM 450 CG1 VAL A 29 -5.171 -7.806 6.644 1.00 63.32 C ATOM 451 CG2 VAL A 29 -4.973 -5.679 7.996 1.00 21.23 C ATOM 0 H VAL A 29 -5.365 -7.807 9.530 1.00 45.05 H new ATOM 0 HA VAL A 29 -3.030 -8.588 8.121 1.00 71.14 H new ATOM 0 HB VAL A 29 -3.441 -6.533 6.767 1.00 42.44 H new ATOM 0 HG11 VAL A 29 -5.660 -7.222 5.865 1.00 63.32 H new ATOM 0 HG12 VAL A 29 -4.607 -8.619 6.188 1.00 63.32 H new ATOM 0 HG13 VAL A 29 -5.924 -8.219 7.315 1.00 63.32 H new ATOM 0 HG21 VAL A 29 -5.460 -5.150 7.177 1.00 21.23 H new ATOM 0 HG22 VAL A 29 -5.725 -6.012 8.711 1.00 21.23 H new ATOM 0 HG23 VAL A 29 -4.270 -5.010 8.493 1.00 21.23 H new ATOM 461 N LYS A 30 -1.174 -6.903 8.643 1.00 72.02 N ATOM 462 CA LYS A 30 0.001 -6.164 9.144 1.00 22.21 C ATOM 463 C LYS A 30 -0.064 -4.680 8.742 1.00 1.21 C ATOM 464 O LYS A 30 0.522 -4.266 7.737 1.00 53.31 O ATOM 465 CB LYS A 30 1.319 -6.842 8.656 1.00 13.32 C ATOM 466 CG LYS A 30 1.638 -8.180 9.357 1.00 62.43 C ATOM 467 CD LYS A 30 1.884 -7.995 10.874 1.00 50.33 C ATOM 468 CE LYS A 30 2.117 -9.318 11.614 1.00 35.24 C ATOM 469 NZ LYS A 30 2.414 -9.092 13.057 1.00 40.03 N ATOM 0 H LYS A 30 -0.981 -7.465 7.814 1.00 72.02 H new ATOM 0 HA LYS A 30 -0.006 -6.199 10.233 1.00 22.21 H new ATOM 0 HB2 LYS A 30 1.250 -7.015 7.582 1.00 13.32 H new ATOM 0 HB3 LYS A 30 2.149 -6.154 8.815 1.00 13.32 H new ATOM 0 HG2 LYS A 30 0.812 -8.875 9.206 1.00 62.43 H new ATOM 0 HG3 LYS A 30 2.519 -8.628 8.899 1.00 62.43 H new ATOM 0 HD2 LYS A 30 2.749 -7.348 11.019 1.00 50.33 H new ATOM 0 HD3 LYS A 30 1.027 -7.485 11.315 1.00 50.33 H new ATOM 0 HE2 LYS A 30 1.234 -9.950 11.518 1.00 35.24 H new ATOM 0 HE3 LYS A 30 2.945 -9.854 11.151 1.00 35.24 H new ATOM 0 HZ1 LYS A 30 2.566 -10.007 13.528 1.00 40.03 H new ATOM 0 HZ2 LYS A 30 3.270 -8.509 13.148 1.00 40.03 H new ATOM 0 HZ3 LYS A 30 1.613 -8.602 13.504 1.00 40.03 H new ATOM 483 N THR A 31 -0.827 -3.905 9.523 1.00 60.11 N ATOM 484 CA THR A 31 -0.926 -2.451 9.379 1.00 1.00 C ATOM 485 C THR A 31 0.339 -1.787 9.955 1.00 21.12 C ATOM 486 O THR A 31 0.428 -1.514 11.159 1.00 41.45 O ATOM 487 CB THR A 31 -2.212 -1.907 10.081 1.00 52.32 C ATOM 488 OG1 THR A 31 -2.267 -2.370 11.444 1.00 25.21 O ATOM 489 CG2 THR A 31 -3.492 -2.349 9.358 1.00 33.31 C ATOM 0 H THR A 31 -1.399 -4.277 10.281 1.00 60.11 H new ATOM 0 HA THR A 31 -1.002 -2.205 8.320 1.00 1.00 H new ATOM 0 HB THR A 31 -2.156 -0.819 10.051 1.00 52.32 H new ATOM 0 HG1 THR A 31 -1.392 -2.246 11.867 1.00 25.21 H new ATOM 0 HG21 THR A 31 -4.361 -1.949 9.880 1.00 33.31 H new ATOM 0 HG22 THR A 31 -3.479 -1.975 8.334 1.00 33.31 H new ATOM 0 HG23 THR A 31 -3.546 -3.438 9.346 1.00 33.31 H new ATOM 497 N VAL A 32 1.332 -1.582 9.083 1.00 11.14 N ATOM 498 CA VAL A 32 2.650 -1.068 9.466 1.00 62.31 C ATOM 499 C VAL A 32 2.868 0.304 8.812 1.00 60.04 C ATOM 500 O VAL A 32 2.901 0.413 7.583 1.00 71.20 O ATOM 501 CB VAL A 32 3.794 -2.057 9.015 1.00 33.13 C ATOM 502 CG1 VAL A 32 5.188 -1.583 9.499 1.00 61.21 C ATOM 503 CG2 VAL A 32 3.509 -3.507 9.474 1.00 62.22 C ATOM 0 H VAL A 32 1.242 -1.770 8.084 1.00 11.14 H new ATOM 0 HA VAL A 32 2.686 -0.974 10.551 1.00 62.31 H new ATOM 0 HB VAL A 32 3.806 -2.051 7.925 1.00 33.13 H new ATOM 0 HG11 VAL A 32 5.948 -2.291 9.168 1.00 61.21 H new ATOM 0 HG12 VAL A 32 5.403 -0.599 9.082 1.00 61.21 H new ATOM 0 HG13 VAL A 32 5.195 -1.525 10.587 1.00 61.21 H new ATOM 0 HG21 VAL A 32 4.319 -4.159 9.145 1.00 62.22 H new ATOM 0 HG22 VAL A 32 3.438 -3.537 10.561 1.00 62.22 H new ATOM 0 HG23 VAL A 32 2.569 -3.848 9.040 1.00 62.22 H new ATOM 513 N ARG A 33 2.970 1.351 9.642 1.00 23.40 N ATOM 514 CA ARG A 33 3.411 2.683 9.199 1.00 20.32 C ATOM 515 C ARG A 33 4.879 2.868 9.627 1.00 64.34 C ATOM 516 O ARG A 33 5.221 2.725 10.811 1.00 2.20 O ATOM 517 CB ARG A 33 2.507 3.815 9.771 1.00 31.03 C ATOM 518 CG ARG A 33 2.341 3.821 11.305 1.00 55.34 C ATOM 519 CD ARG A 33 1.724 5.121 11.838 1.00 71.10 C ATOM 520 NE ARG A 33 0.386 5.394 11.280 1.00 23.13 N ATOM 521 CZ ARG A 33 -0.565 6.165 11.838 1.00 25.22 C ATOM 522 NH1 ARG A 33 -0.383 6.772 13.010 1.00 61.31 N ATOM 523 NH2 ARG A 33 -1.698 6.359 11.180 1.00 5.15 N ATOM 0 H ARG A 33 2.750 1.300 10.637 1.00 23.40 H new ATOM 0 HA ARG A 33 3.327 2.750 8.114 1.00 20.32 H new ATOM 0 HB2 ARG A 33 2.920 4.776 9.464 1.00 31.03 H new ATOM 0 HB3 ARG A 33 1.520 3.732 9.316 1.00 31.03 H new ATOM 0 HG2 ARG A 33 1.713 2.980 11.600 1.00 55.34 H new ATOM 0 HG3 ARG A 33 3.315 3.670 11.771 1.00 55.34 H new ATOM 0 HD2 ARG A 33 1.654 5.065 12.924 1.00 71.10 H new ATOM 0 HD3 ARG A 33 2.387 5.954 11.604 1.00 71.10 H new ATOM 0 HE ARG A 33 0.160 4.957 10.386 1.00 23.13 H new ATOM 0 HH11 ARG A 33 0.498 6.659 13.512 1.00 61.31 H new ATOM 0 HH12 ARG A 33 -1.125 7.350 13.406 1.00 61.31 H new ATOM 0 HH21 ARG A 33 -1.838 5.927 10.267 1.00 5.15 H new ATOM 0 HH22 ARG A 33 -2.431 6.940 11.587 1.00 5.15 H new ATOM 537 N THR A 34 5.734 3.149 8.645 1.00 2.02 N ATOM 538 CA THR A 34 7.186 3.273 8.838 1.00 62.25 C ATOM 539 C THR A 34 7.838 3.832 7.563 1.00 12.31 C ATOM 540 O THR A 34 7.444 3.481 6.450 1.00 32.15 O ATOM 541 CB THR A 34 7.872 1.902 9.236 1.00 54.12 C ATOM 542 OG1 THR A 34 9.256 2.119 9.540 1.00 11.14 O ATOM 543 CG2 THR A 34 7.755 0.814 8.137 1.00 21.34 C ATOM 0 H THR A 34 5.439 3.299 7.680 1.00 2.02 H new ATOM 0 HA THR A 34 7.339 3.961 9.670 1.00 62.25 H new ATOM 0 HB THR A 34 7.337 1.533 10.111 1.00 54.12 H new ATOM 0 HG1 THR A 34 9.551 1.463 10.206 1.00 11.14 H new ATOM 0 HG21 THR A 34 8.246 -0.099 8.475 1.00 21.34 H new ATOM 0 HG22 THR A 34 6.703 0.608 7.939 1.00 21.34 H new ATOM 0 HG23 THR A 34 8.234 1.167 7.224 1.00 21.34 H new ATOM 551 N ASP A 35 8.829 4.710 7.746 1.00 21.05 N ATOM 552 CA ASP A 35 9.636 5.270 6.642 1.00 3.22 C ATOM 553 C ASP A 35 10.962 4.498 6.501 1.00 0.14 C ATOM 554 O ASP A 35 11.802 4.866 5.678 1.00 3.13 O ATOM 555 CB ASP A 35 9.930 6.770 6.907 1.00 34.21 C ATOM 556 CG ASP A 35 10.885 7.005 8.095 1.00 54.52 C ATOM 557 OD1 ASP A 35 10.457 6.815 9.254 1.00 13.53 O ATOM 558 OD2 ASP A 35 12.065 7.377 7.876 1.00 32.13 O ATOM 0 H ASP A 35 9.100 5.058 8.666 1.00 21.05 H new ATOM 0 HA ASP A 35 9.071 5.173 5.715 1.00 3.22 H new ATOM 0 HB2 ASP A 35 10.362 7.212 6.009 1.00 34.21 H new ATOM 0 HB3 ASP A 35 8.991 7.289 7.097 1.00 34.21 H new ATOM 563 N ASP A 36 11.116 3.412 7.284 1.00 4.31 N ATOM 564 CA ASP A 36 12.401 2.707 7.467 1.00 14.43 C ATOM 565 C ASP A 36 12.865 2.008 6.164 1.00 3.41 C ATOM 566 O ASP A 36 14.051 1.680 6.021 1.00 21.50 O ATOM 567 CB ASP A 36 12.260 1.693 8.633 1.00 12.20 C ATOM 568 CG ASP A 36 13.605 1.086 9.073 1.00 44.13 C ATOM 569 OD1 ASP A 36 14.289 1.688 9.927 1.00 31.11 O ATOM 570 OD2 ASP A 36 13.984 0.013 8.561 1.00 75.22 O ATOM 0 H ASP A 36 10.348 2.996 7.811 1.00 4.31 H new ATOM 0 HA ASP A 36 13.171 3.437 7.715 1.00 14.43 H new ATOM 0 HB2 ASP A 36 11.797 2.191 9.485 1.00 12.20 H new ATOM 0 HB3 ASP A 36 11.588 0.890 8.329 1.00 12.20 H new ATOM 575 N LYS A 37 11.899 1.802 5.225 1.00 3.11 N ATOM 576 CA LYS A 37 12.130 1.259 3.868 1.00 71.24 C ATOM 577 C LYS A 37 12.427 -0.253 3.916 1.00 2.31 C ATOM 578 O LYS A 37 11.575 -1.063 3.539 1.00 23.34 O ATOM 579 CB LYS A 37 13.258 2.024 3.105 1.00 24.40 C ATOM 580 CG LYS A 37 13.063 3.556 2.970 1.00 45.34 C ATOM 581 CD LYS A 37 14.289 4.245 2.316 1.00 64.21 C ATOM 582 CE LYS A 37 14.614 3.668 0.927 1.00 53.52 C ATOM 583 NZ LYS A 37 15.864 4.225 0.360 1.00 71.52 N ATOM 0 H LYS A 37 10.917 2.016 5.401 1.00 3.11 H new ATOM 0 HA LYS A 37 11.207 1.410 3.309 1.00 71.24 H new ATOM 0 HB2 LYS A 37 14.204 1.841 3.615 1.00 24.40 H new ATOM 0 HB3 LYS A 37 13.347 1.599 2.105 1.00 24.40 H new ATOM 0 HG2 LYS A 37 12.174 3.756 2.373 1.00 45.34 H new ATOM 0 HG3 LYS A 37 12.889 3.987 3.956 1.00 45.34 H new ATOM 0 HD2 LYS A 37 14.097 5.314 2.226 1.00 64.21 H new ATOM 0 HD3 LYS A 37 15.156 4.131 2.966 1.00 64.21 H new ATOM 0 HE2 LYS A 37 14.703 2.584 0.999 1.00 53.52 H new ATOM 0 HE3 LYS A 37 13.787 3.876 0.248 1.00 53.52 H new ATOM 0 HZ1 LYS A 37 16.038 3.805 -0.575 1.00 71.52 H new ATOM 0 HZ2 LYS A 37 15.772 5.257 0.265 1.00 71.52 H new ATOM 0 HZ3 LYS A 37 16.660 4.005 0.992 1.00 71.52 H new ATOM 597 N GLU A 38 13.633 -0.620 4.397 1.00 63.34 N ATOM 598 CA GLU A 38 14.088 -2.023 4.483 1.00 11.21 C ATOM 599 C GLU A 38 13.173 -2.861 5.393 1.00 35.22 C ATOM 600 O GLU A 38 12.903 -4.026 5.080 1.00 42.32 O ATOM 601 CB GLU A 38 15.565 -2.103 4.961 1.00 31.24 C ATOM 602 CG GLU A 38 15.847 -1.422 6.316 1.00 33.42 C ATOM 603 CD GLU A 38 17.284 -1.620 6.819 1.00 2.41 C ATOM 604 OE1 GLU A 38 18.190 -0.894 6.359 1.00 1.43 O ATOM 605 OE2 GLU A 38 17.519 -2.506 7.673 1.00 35.30 O ATOM 0 H GLU A 38 14.321 0.051 4.738 1.00 63.34 H new ATOM 0 HA GLU A 38 14.031 -2.445 3.480 1.00 11.21 H new ATOM 0 HB2 GLU A 38 15.852 -3.152 5.031 1.00 31.24 H new ATOM 0 HB3 GLU A 38 16.202 -1.648 4.203 1.00 31.24 H new ATOM 0 HG2 GLU A 38 15.647 -0.354 6.225 1.00 33.42 H new ATOM 0 HG3 GLU A 38 15.154 -1.813 7.061 1.00 33.42 H new ATOM 612 N LYS A 39 12.654 -2.237 6.482 1.00 15.41 N ATOM 613 CA LYS A 39 11.721 -2.899 7.413 1.00 3.22 C ATOM 614 C LYS A 39 10.463 -3.402 6.685 1.00 72.24 C ATOM 615 O LYS A 39 9.967 -4.479 7.006 1.00 21.41 O ATOM 616 CB LYS A 39 11.302 -1.961 8.578 1.00 11.14 C ATOM 617 CG LYS A 39 10.264 -2.595 9.533 1.00 53.33 C ATOM 618 CD LYS A 39 9.847 -1.695 10.707 1.00 35.42 C ATOM 619 CE LYS A 39 8.773 -2.375 11.576 1.00 51.54 C ATOM 620 NZ LYS A 39 9.234 -3.682 12.127 1.00 41.52 N ATOM 0 H LYS A 39 12.871 -1.272 6.732 1.00 15.41 H new ATOM 0 HA LYS A 39 12.256 -3.752 7.830 1.00 3.22 H new ATOM 0 HB2 LYS A 39 12.188 -1.684 9.149 1.00 11.14 H new ATOM 0 HB3 LYS A 39 10.889 -1.041 8.164 1.00 11.14 H new ATOM 0 HG2 LYS A 39 9.375 -2.859 8.960 1.00 53.33 H new ATOM 0 HG3 LYS A 39 10.674 -3.523 9.931 1.00 53.33 H new ATOM 0 HD2 LYS A 39 10.719 -1.462 11.318 1.00 35.42 H new ATOM 0 HD3 LYS A 39 9.464 -0.749 10.325 1.00 35.42 H new ATOM 0 HE2 LYS A 39 8.501 -1.713 12.398 1.00 51.54 H new ATOM 0 HE3 LYS A 39 7.873 -2.531 10.981 1.00 51.54 H new ATOM 0 HZ1 LYS A 39 8.731 -3.881 13.015 1.00 41.52 H new ATOM 0 HZ2 LYS A 39 9.036 -4.438 11.440 1.00 41.52 H new ATOM 0 HZ3 LYS A 39 10.257 -3.640 12.310 1.00 41.52 H new ATOM 634 N VAL A 40 9.972 -2.617 5.695 1.00 52.13 N ATOM 635 CA VAL A 40 8.789 -2.989 4.889 1.00 64.23 C ATOM 636 C VAL A 40 8.981 -4.380 4.232 1.00 44.11 C ATOM 637 O VAL A 40 8.059 -5.189 4.209 1.00 21.11 O ATOM 638 CB VAL A 40 8.460 -1.911 3.783 1.00 65.54 C ATOM 639 CG1 VAL A 40 7.246 -2.336 2.927 1.00 60.11 C ATOM 640 CG2 VAL A 40 8.237 -0.513 4.421 1.00 32.24 C ATOM 0 H VAL A 40 10.381 -1.719 5.437 1.00 52.13 H new ATOM 0 HA VAL A 40 7.943 -3.033 5.574 1.00 64.23 H new ATOM 0 HB VAL A 40 9.321 -1.842 3.118 1.00 65.54 H new ATOM 0 HG11 VAL A 40 7.046 -1.573 2.175 1.00 60.11 H new ATOM 0 HG12 VAL A 40 7.463 -3.283 2.433 1.00 60.11 H new ATOM 0 HG13 VAL A 40 6.372 -2.452 3.568 1.00 60.11 H new ATOM 0 HG21 VAL A 40 8.012 0.212 3.639 1.00 32.24 H new ATOM 0 HG22 VAL A 40 7.403 -0.562 5.122 1.00 32.24 H new ATOM 0 HG23 VAL A 40 9.139 -0.207 4.951 1.00 32.24 H new ATOM 650 N LYS A 41 10.219 -4.644 3.765 1.00 14.51 N ATOM 651 CA LYS A 41 10.601 -5.928 3.130 1.00 11.51 C ATOM 652 C LYS A 41 10.529 -7.080 4.150 1.00 0.40 C ATOM 653 O LYS A 41 10.022 -8.164 3.837 1.00 70.43 O ATOM 654 CB LYS A 41 12.031 -5.854 2.503 1.00 51.23 C ATOM 655 CG LYS A 41 12.162 -4.969 1.235 1.00 53.25 C ATOM 656 CD LYS A 41 12.003 -3.459 1.491 1.00 13.30 C ATOM 657 CE LYS A 41 12.059 -2.622 0.205 1.00 21.31 C ATOM 658 NZ LYS A 41 13.323 -2.807 -0.546 1.00 43.40 N ATOM 0 H LYS A 41 10.985 -3.973 3.817 1.00 14.51 H new ATOM 0 HA LYS A 41 9.890 -6.121 2.327 1.00 11.51 H new ATOM 0 HB2 LYS A 41 12.721 -5.479 3.259 1.00 51.23 H new ATOM 0 HB3 LYS A 41 12.351 -6.865 2.253 1.00 51.23 H new ATOM 0 HG2 LYS A 41 13.137 -5.147 0.782 1.00 53.25 H new ATOM 0 HG3 LYS A 41 11.412 -5.283 0.509 1.00 53.25 H new ATOM 0 HD2 LYS A 41 11.052 -3.280 1.993 1.00 13.30 H new ATOM 0 HD3 LYS A 41 12.789 -3.126 2.169 1.00 13.30 H new ATOM 0 HE2 LYS A 41 11.219 -2.891 -0.435 1.00 21.31 H new ATOM 0 HE3 LYS A 41 11.943 -1.568 0.458 1.00 21.31 H new ATOM 0 HZ1 LYS A 41 13.481 -1.988 -1.167 1.00 43.40 H new ATOM 0 HZ2 LYS A 41 14.115 -2.892 0.123 1.00 43.40 H new ATOM 0 HZ3 LYS A 41 13.262 -3.671 -1.122 1.00 43.40 H new ATOM 672 N GLU A 42 11.036 -6.818 5.368 1.00 70.20 N ATOM 673 CA GLU A 42 10.966 -7.765 6.491 1.00 72.23 C ATOM 674 C GLU A 42 9.505 -8.094 6.842 1.00 61.44 C ATOM 675 O GLU A 42 9.153 -9.266 6.970 1.00 13.01 O ATOM 676 CB GLU A 42 11.737 -7.212 7.732 1.00 73.31 C ATOM 677 CG GLU A 42 13.269 -7.447 7.710 1.00 4.33 C ATOM 678 CD GLU A 42 14.009 -6.766 6.543 1.00 63.01 C ATOM 679 OE1 GLU A 42 14.040 -7.328 5.422 1.00 63.54 O ATOM 680 OE2 GLU A 42 14.588 -5.677 6.744 1.00 2.41 O ATOM 0 H GLU A 42 11.506 -5.943 5.600 1.00 70.20 H new ATOM 0 HA GLU A 42 11.450 -8.693 6.185 1.00 72.23 H new ATOM 0 HB2 GLU A 42 11.550 -6.141 7.809 1.00 73.31 H new ATOM 0 HB3 GLU A 42 11.327 -7.673 8.631 1.00 73.31 H new ATOM 0 HG2 GLU A 42 13.691 -7.088 8.649 1.00 4.33 H new ATOM 0 HG3 GLU A 42 13.458 -8.520 7.665 1.00 4.33 H new ATOM 687 N GLU A 43 8.662 -7.051 6.930 1.00 4.23 N ATOM 688 CA GLU A 43 7.250 -7.198 7.312 1.00 23.24 C ATOM 689 C GLU A 43 6.435 -7.920 6.210 1.00 32.15 C ATOM 690 O GLU A 43 5.469 -8.622 6.526 1.00 13.34 O ATOM 691 CB GLU A 43 6.616 -5.817 7.636 1.00 73.45 C ATOM 692 CG GLU A 43 7.282 -5.032 8.782 1.00 71.11 C ATOM 693 CD GLU A 43 7.354 -5.804 10.113 1.00 33.25 C ATOM 694 OE1 GLU A 43 6.294 -6.157 10.672 1.00 4.34 O ATOM 695 OE2 GLU A 43 8.473 -6.064 10.610 1.00 11.14 O ATOM 0 H GLU A 43 8.940 -6.088 6.739 1.00 4.23 H new ATOM 0 HA GLU A 43 7.219 -7.814 8.211 1.00 23.24 H new ATOM 0 HB2 GLU A 43 6.644 -5.204 6.735 1.00 73.45 H new ATOM 0 HB3 GLU A 43 5.566 -5.969 7.886 1.00 73.45 H new ATOM 0 HG2 GLU A 43 8.292 -4.755 8.480 1.00 71.11 H new ATOM 0 HG3 GLU A 43 6.731 -4.105 8.941 1.00 71.11 H new ATOM 702 N ILE A 44 6.826 -7.716 4.920 1.00 60.51 N ATOM 703 CA ILE A 44 6.245 -8.450 3.768 1.00 12.03 C ATOM 704 C ILE A 44 6.518 -9.956 3.929 1.00 34.32 C ATOM 705 O ILE A 44 5.594 -10.771 3.851 1.00 32.44 O ATOM 706 CB ILE A 44 6.817 -7.948 2.368 1.00 74.10 C ATOM 707 CG1 ILE A 44 6.253 -6.542 1.979 1.00 61.22 C ATOM 708 CG2 ILE A 44 6.548 -8.969 1.225 1.00 63.32 C ATOM 709 CD1 ILE A 44 6.763 -6.008 0.646 1.00 34.22 C ATOM 0 H ILE A 44 7.546 -7.044 4.656 1.00 60.51 H new ATOM 0 HA ILE A 44 5.173 -8.255 3.766 1.00 12.03 H new ATOM 0 HB ILE A 44 7.896 -7.861 2.495 1.00 74.10 H new ATOM 0 HG12 ILE A 44 5.165 -6.597 1.942 1.00 61.22 H new ATOM 0 HG13 ILE A 44 6.510 -5.831 2.764 1.00 61.22 H new ATOM 0 HG21 ILE A 44 6.955 -8.584 0.290 1.00 63.32 H new ATOM 0 HG22 ILE A 44 7.026 -9.919 1.466 1.00 63.32 H new ATOM 0 HG23 ILE A 44 5.474 -9.120 1.118 1.00 63.32 H new ATOM 0 HD11 ILE A 44 6.323 -5.030 0.454 1.00 34.22 H new ATOM 0 HD12 ILE A 44 7.849 -5.917 0.682 1.00 34.22 H new ATOM 0 HD13 ILE A 44 6.483 -6.695 -0.152 1.00 34.22 H new ATOM 721 N GLU A 45 7.803 -10.282 4.183 1.00 51.12 N ATOM 722 CA GLU A 45 8.300 -11.661 4.337 1.00 24.45 C ATOM 723 C GLU A 45 7.529 -12.379 5.464 1.00 74.31 C ATOM 724 O GLU A 45 7.001 -13.476 5.269 1.00 55.22 O ATOM 725 CB GLU A 45 9.834 -11.612 4.620 1.00 50.33 C ATOM 726 CG GLU A 45 10.602 -12.958 4.528 1.00 24.13 C ATOM 727 CD GLU A 45 10.312 -13.970 5.658 1.00 44.40 C ATOM 728 OE1 GLU A 45 10.489 -13.619 6.848 1.00 12.34 O ATOM 729 OE2 GLU A 45 9.926 -15.126 5.367 1.00 23.32 O ATOM 0 H GLU A 45 8.535 -9.580 4.288 1.00 51.12 H new ATOM 0 HA GLU A 45 8.135 -12.230 3.422 1.00 24.45 H new ATOM 0 HB2 GLU A 45 10.288 -10.912 3.918 1.00 50.33 H new ATOM 0 HB3 GLU A 45 9.983 -11.203 5.619 1.00 50.33 H new ATOM 0 HG2 GLU A 45 10.363 -13.428 3.574 1.00 24.13 H new ATOM 0 HG3 GLU A 45 11.671 -12.746 4.520 1.00 24.13 H new ATOM 736 N LYS A 46 7.457 -11.700 6.620 1.00 35.43 N ATOM 737 CA LYS A 46 6.784 -12.192 7.833 1.00 3.33 C ATOM 738 C LYS A 46 5.288 -12.447 7.584 1.00 34.42 C ATOM 739 O LYS A 46 4.749 -13.480 8.013 1.00 64.41 O ATOM 740 CB LYS A 46 6.965 -11.157 8.970 1.00 20.21 C ATOM 741 CG LYS A 46 8.425 -10.992 9.469 1.00 20.44 C ATOM 742 CD LYS A 46 8.618 -9.712 10.326 1.00 1.14 C ATOM 743 CE LYS A 46 7.632 -9.620 11.502 1.00 23.52 C ATOM 744 NZ LYS A 46 7.843 -8.395 12.318 1.00 64.33 N ATOM 0 H LYS A 46 7.873 -10.776 6.740 1.00 35.43 H new ATOM 0 HA LYS A 46 7.236 -13.142 8.119 1.00 3.33 H new ATOM 0 HB2 LYS A 46 6.602 -10.189 8.623 1.00 20.21 H new ATOM 0 HB3 LYS A 46 6.338 -11.449 9.812 1.00 20.21 H new ATOM 0 HG2 LYS A 46 8.705 -11.865 10.058 1.00 20.44 H new ATOM 0 HG3 LYS A 46 9.097 -10.956 8.612 1.00 20.44 H new ATOM 0 HD2 LYS A 46 9.637 -9.690 10.712 1.00 1.14 H new ATOM 0 HD3 LYS A 46 8.499 -8.835 9.690 1.00 1.14 H new ATOM 0 HE2 LYS A 46 6.611 -9.628 11.120 1.00 23.52 H new ATOM 0 HE3 LYS A 46 7.742 -10.500 12.136 1.00 23.52 H new ATOM 0 HZ1 LYS A 46 6.945 -8.115 12.763 1.00 64.33 H new ATOM 0 HZ2 LYS A 46 8.550 -8.587 13.056 1.00 64.33 H new ATOM 0 HZ3 LYS A 46 8.181 -7.625 11.707 1.00 64.33 H new ATOM 758 N ALA A 47 4.631 -11.501 6.877 1.00 61.32 N ATOM 759 CA ALA A 47 3.196 -11.584 6.581 1.00 1.34 C ATOM 760 C ALA A 47 2.900 -12.810 5.703 1.00 75.53 C ATOM 761 O ALA A 47 2.172 -13.704 6.132 1.00 70.31 O ATOM 762 CB ALA A 47 2.706 -10.291 5.907 1.00 60.52 C ATOM 0 H ALA A 47 5.082 -10.667 6.501 1.00 61.32 H new ATOM 0 HA ALA A 47 2.654 -11.699 7.520 1.00 1.34 H new ATOM 0 HB1 ALA A 47 1.640 -10.372 5.696 1.00 60.52 H new ATOM 0 HB2 ALA A 47 2.881 -9.445 6.572 1.00 60.52 H new ATOM 0 HB3 ALA A 47 3.250 -10.138 4.975 1.00 60.52 H new ATOM 768 N ARG A 48 3.581 -12.902 4.539 1.00 3.03 N ATOM 769 CA ARG A 48 3.331 -13.963 3.531 1.00 15.11 C ATOM 770 C ARG A 48 3.755 -15.358 4.042 1.00 24.42 C ATOM 771 O ARG A 48 3.214 -16.377 3.599 1.00 43.43 O ATOM 772 CB ARG A 48 4.000 -13.608 2.158 1.00 62.11 C ATOM 773 CG ARG A 48 5.553 -13.442 2.136 1.00 35.21 C ATOM 774 CD ARG A 48 6.341 -14.768 2.113 1.00 62.21 C ATOM 775 NE ARG A 48 7.792 -14.575 2.050 1.00 24.34 N ATOM 776 CZ ARG A 48 8.702 -15.538 2.246 1.00 24.10 C ATOM 777 NH1 ARG A 48 8.332 -16.784 2.539 1.00 71.21 N ATOM 778 NH2 ARG A 48 9.986 -15.255 2.096 1.00 71.44 N ATOM 0 H ARG A 48 4.316 -12.248 4.270 1.00 3.03 H new ATOM 0 HA ARG A 48 2.255 -14.010 3.365 1.00 15.11 H new ATOM 0 HB2 ARG A 48 3.734 -14.387 1.443 1.00 62.11 H new ATOM 0 HB3 ARG A 48 3.557 -12.680 1.798 1.00 62.11 H new ATOM 0 HG2 ARG A 48 5.830 -12.855 1.260 1.00 35.21 H new ATOM 0 HG3 ARG A 48 5.856 -12.870 3.013 1.00 35.21 H new ATOM 0 HD2 ARG A 48 6.096 -15.345 3.005 1.00 62.21 H new ATOM 0 HD3 ARG A 48 6.022 -15.358 1.254 1.00 62.21 H new ATOM 0 HE ARG A 48 8.135 -13.637 1.841 1.00 24.34 H new ATOM 0 HH11 ARG A 48 7.342 -17.017 2.617 1.00 71.21 H new ATOM 0 HH12 ARG A 48 9.039 -17.505 2.685 1.00 71.21 H new ATOM 0 HH21 ARG A 48 10.273 -14.312 1.834 1.00 71.44 H new ATOM 0 HH22 ARG A 48 10.688 -15.980 2.243 1.00 71.44 H new ATOM 792 N LYS A 49 4.748 -15.376 4.961 1.00 13.23 N ATOM 793 CA LYS A 49 5.219 -16.602 5.649 1.00 71.53 C ATOM 794 C LYS A 49 4.060 -17.240 6.441 1.00 24.22 C ATOM 795 O LYS A 49 3.844 -18.453 6.403 1.00 75.43 O ATOM 796 CB LYS A 49 6.390 -16.252 6.611 1.00 52.45 C ATOM 797 CG LYS A 49 7.081 -17.472 7.295 1.00 44.21 C ATOM 798 CD LYS A 49 7.584 -17.168 8.729 1.00 63.30 C ATOM 799 CE LYS A 49 8.524 -15.953 8.819 1.00 24.31 C ATOM 800 NZ LYS A 49 9.782 -16.158 8.062 1.00 72.11 N ATOM 0 H LYS A 49 5.249 -14.535 5.248 1.00 13.23 H new ATOM 0 HA LYS A 49 5.572 -17.314 4.903 1.00 71.53 H new ATOM 0 HB2 LYS A 49 7.143 -15.696 6.052 1.00 52.45 H new ATOM 0 HB3 LYS A 49 6.013 -15.587 7.388 1.00 52.45 H new ATOM 0 HG2 LYS A 49 6.378 -18.304 7.333 1.00 44.21 H new ATOM 0 HG3 LYS A 49 7.923 -17.794 6.683 1.00 44.21 H new ATOM 0 HD2 LYS A 49 6.724 -16.997 9.376 1.00 63.30 H new ATOM 0 HD3 LYS A 49 8.103 -18.045 9.114 1.00 63.30 H new ATOM 0 HE2 LYS A 49 8.011 -15.071 8.436 1.00 24.31 H new ATOM 0 HE3 LYS A 49 8.760 -15.755 9.865 1.00 24.31 H new ATOM 0 HZ1 LYS A 49 10.517 -15.522 8.432 1.00 72.11 H new ATOM 0 HZ2 LYS A 49 10.093 -17.145 8.166 1.00 72.11 H new ATOM 0 HZ3 LYS A 49 9.619 -15.951 7.056 1.00 72.11 H new ATOM 814 N GLN A 50 3.316 -16.370 7.144 1.00 51.52 N ATOM 815 CA GLN A 50 2.122 -16.743 7.922 1.00 25.11 C ATOM 816 C GLN A 50 0.885 -16.879 6.992 1.00 42.14 C ATOM 817 O GLN A 50 -0.112 -17.517 7.350 1.00 73.43 O ATOM 818 CB GLN A 50 1.893 -15.663 9.025 1.00 53.32 C ATOM 819 CG GLN A 50 0.778 -15.983 10.045 1.00 43.24 C ATOM 820 CD GLN A 50 1.003 -17.277 10.844 1.00 22.24 C ATOM 821 OE1 GLN A 50 2.134 -17.679 11.118 1.00 34.44 O ATOM 822 NE2 GLN A 50 -0.073 -17.943 11.215 1.00 20.11 N ATOM 0 H GLN A 50 3.530 -15.374 7.189 1.00 51.52 H new ATOM 0 HA GLN A 50 2.272 -17.713 8.397 1.00 25.11 H new ATOM 0 HB2 GLN A 50 2.827 -15.518 9.567 1.00 53.32 H new ATOM 0 HB3 GLN A 50 1.657 -14.716 8.539 1.00 53.32 H new ATOM 0 HG2 GLN A 50 0.690 -15.150 10.742 1.00 43.24 H new ATOM 0 HG3 GLN A 50 -0.172 -16.057 9.516 1.00 43.24 H new ATOM 0 HE21 GLN A 50 -0.999 -17.589 10.976 1.00 20.11 H new ATOM 0 HE22 GLN A 50 0.021 -18.812 11.741 1.00 20.11 H new ATOM 831 N GLY A 51 0.987 -16.281 5.787 1.00 41.40 N ATOM 832 CA GLY A 51 -0.075 -16.315 4.772 1.00 52.33 C ATOM 833 C GLY A 51 -1.065 -15.173 4.926 1.00 10.32 C ATOM 834 O GLY A 51 -2.247 -15.314 4.617 1.00 62.04 O ATOM 0 H GLY A 51 1.813 -15.760 5.494 1.00 41.40 H new ATOM 0 HA2 GLY A 51 0.374 -16.271 3.780 1.00 52.33 H new ATOM 0 HA3 GLY A 51 -0.607 -17.264 4.839 1.00 52.33 H new ATOM 838 N ARG A 52 -0.560 -14.034 5.399 1.00 50.14 N ATOM 839 CA ARG A 52 -1.353 -12.832 5.703 1.00 62.40 C ATOM 840 C ARG A 52 -1.055 -11.712 4.691 1.00 54.31 C ATOM 841 O ARG A 52 0.009 -11.718 4.051 1.00 11.11 O ATOM 842 CB ARG A 52 -1.032 -12.331 7.143 1.00 43.31 C ATOM 843 CG ARG A 52 -1.463 -13.303 8.254 1.00 55.21 C ATOM 844 CD ARG A 52 -1.283 -12.733 9.670 1.00 41.21 C ATOM 845 NE ARG A 52 -1.811 -13.668 10.672 1.00 3.43 N ATOM 846 CZ ARG A 52 -2.470 -13.332 11.784 1.00 64.42 C ATOM 847 NH1 ARG A 52 -2.700 -12.058 12.088 1.00 62.24 N ATOM 848 NH2 ARG A 52 -2.924 -14.292 12.576 1.00 45.21 N ATOM 0 H ARG A 52 0.435 -13.913 5.588 1.00 50.14 H new ATOM 0 HA ARG A 52 -2.409 -13.094 5.636 1.00 62.40 H new ATOM 0 HB2 ARG A 52 0.041 -12.155 7.225 1.00 43.31 H new ATOM 0 HB3 ARG A 52 -1.526 -11.372 7.302 1.00 43.31 H new ATOM 0 HG2 ARG A 52 -2.510 -13.568 8.108 1.00 55.21 H new ATOM 0 HG3 ARG A 52 -0.886 -14.223 8.165 1.00 55.21 H new ATOM 0 HD2 ARG A 52 -0.227 -12.545 9.861 1.00 41.21 H new ATOM 0 HD3 ARG A 52 -1.797 -11.775 9.751 1.00 41.21 H new ATOM 0 HE ARG A 52 -1.661 -14.663 10.504 1.00 3.43 H new ATOM 0 HH11 ARG A 52 -2.371 -11.318 11.467 1.00 62.24 H new ATOM 0 HH12 ARG A 52 -3.205 -11.821 12.942 1.00 62.24 H new ATOM 0 HH21 ARG A 52 -2.768 -15.270 12.333 1.00 45.21 H new ATOM 0 HH22 ARG A 52 -3.429 -14.053 13.429 1.00 45.21 H new ATOM 862 N PRO A 53 -1.999 -10.735 4.523 1.00 43.03 N ATOM 863 CA PRO A 53 -1.736 -9.502 3.773 1.00 33.50 C ATOM 864 C PRO A 53 -1.045 -8.454 4.668 1.00 35.12 C ATOM 865 O PRO A 53 -1.083 -8.537 5.908 1.00 34.23 O ATOM 866 CB PRO A 53 -3.154 -9.034 3.323 1.00 41.42 C ATOM 867 CG PRO A 53 -4.145 -9.968 3.993 1.00 33.21 C ATOM 868 CD PRO A 53 -3.389 -10.735 5.049 1.00 72.31 C ATOM 0 HA PRO A 53 -1.063 -9.649 2.928 1.00 33.50 H new ATOM 0 HB2 PRO A 53 -3.334 -8.000 3.618 1.00 41.42 H new ATOM 0 HB3 PRO A 53 -3.251 -9.077 2.238 1.00 41.42 H new ATOM 0 HG2 PRO A 53 -4.964 -9.404 4.439 1.00 33.21 H new ATOM 0 HG3 PRO A 53 -4.586 -10.648 3.264 1.00 33.21 H new ATOM 0 HD2 PRO A 53 -3.453 -10.251 6.024 1.00 72.31 H new ATOM 0 HD3 PRO A 53 -3.776 -11.747 5.169 1.00 72.31 H new ATOM 876 N ILE A 54 -0.433 -7.463 4.032 1.00 23.24 N ATOM 877 CA ILE A 54 0.266 -6.377 4.721 1.00 54.23 C ATOM 878 C ILE A 54 -0.171 -5.030 4.124 1.00 21.34 C ATOM 879 O ILE A 54 -0.270 -4.886 2.899 1.00 74.22 O ATOM 880 CB ILE A 54 1.825 -6.570 4.650 1.00 23.15 C ATOM 881 CG1 ILE A 54 2.563 -5.354 5.286 1.00 30.41 C ATOM 882 CG2 ILE A 54 2.313 -6.849 3.206 1.00 53.44 C ATOM 883 CD1 ILE A 54 4.065 -5.442 5.268 1.00 10.23 C ATOM 0 H ILE A 54 -0.406 -7.387 3.015 1.00 23.24 H new ATOM 0 HA ILE A 54 -0.002 -6.391 5.777 1.00 54.23 H new ATOM 0 HB ILE A 54 2.073 -7.455 5.236 1.00 23.15 H new ATOM 0 HG12 ILE A 54 2.261 -4.449 4.760 1.00 30.41 H new ATOM 0 HG13 ILE A 54 2.233 -5.247 6.319 1.00 30.41 H new ATOM 0 HG21 ILE A 54 3.396 -6.975 3.206 1.00 53.44 H new ATOM 0 HG22 ILE A 54 1.841 -7.758 2.832 1.00 53.44 H new ATOM 0 HG23 ILE A 54 2.046 -6.010 2.563 1.00 53.44 H new ATOM 0 HD11 ILE A 54 4.487 -4.551 5.732 1.00 10.23 H new ATOM 0 HD12 ILE A 54 4.384 -6.325 5.821 1.00 10.23 H new ATOM 0 HD13 ILE A 54 4.413 -5.514 4.238 1.00 10.23 H new ATOM 895 N VAL A 55 -0.481 -4.070 5.018 1.00 72.44 N ATOM 896 CA VAL A 55 -0.948 -2.730 4.648 1.00 52.43 C ATOM 897 C VAL A 55 0.087 -1.685 5.115 1.00 61.32 C ATOM 898 O VAL A 55 0.229 -1.445 6.315 1.00 23.45 O ATOM 899 CB VAL A 55 -2.365 -2.423 5.278 1.00 63.22 C ATOM 900 CG1 VAL A 55 -3.024 -1.204 4.591 1.00 62.43 C ATOM 901 CG2 VAL A 55 -3.292 -3.666 5.225 1.00 72.44 C ATOM 0 H VAL A 55 -0.412 -4.210 6.026 1.00 72.44 H new ATOM 0 HA VAL A 55 -1.053 -2.682 3.564 1.00 52.43 H new ATOM 0 HB VAL A 55 -2.213 -2.175 6.328 1.00 63.22 H new ATOM 0 HG11 VAL A 55 -3.998 -1.014 5.043 1.00 62.43 H new ATOM 0 HG12 VAL A 55 -2.388 -0.328 4.717 1.00 62.43 H new ATOM 0 HG13 VAL A 55 -3.151 -1.410 3.528 1.00 62.43 H new ATOM 0 HG21 VAL A 55 -4.257 -3.419 5.666 1.00 72.44 H new ATOM 0 HG22 VAL A 55 -3.434 -3.970 4.188 1.00 72.44 H new ATOM 0 HG23 VAL A 55 -2.836 -4.484 5.783 1.00 72.44 H new ATOM 911 N ILE A 56 0.817 -1.082 4.157 1.00 35.34 N ATOM 912 CA ILE A 56 1.908 -0.124 4.447 1.00 12.05 C ATOM 913 C ILE A 56 1.434 1.321 4.254 1.00 34.41 C ATOM 914 O ILE A 56 1.056 1.715 3.156 1.00 32.33 O ATOM 915 CB ILE A 56 3.170 -0.419 3.547 1.00 64.42 C ATOM 916 CG1 ILE A 56 3.785 -1.798 3.924 1.00 15.01 C ATOM 917 CG2 ILE A 56 4.250 0.697 3.641 1.00 41.03 C ATOM 918 CD1 ILE A 56 4.370 -1.866 5.335 1.00 20.12 C ATOM 0 H ILE A 56 0.669 -1.243 3.161 1.00 35.34 H new ATOM 0 HA ILE A 56 2.196 -0.251 5.491 1.00 12.05 H new ATOM 0 HB ILE A 56 2.827 -0.441 2.513 1.00 64.42 H new ATOM 0 HG12 ILE A 56 3.016 -2.564 3.826 1.00 15.01 H new ATOM 0 HG13 ILE A 56 4.569 -2.040 3.207 1.00 15.01 H new ATOM 0 HG21 ILE A 56 5.095 0.441 3.001 1.00 41.03 H new ATOM 0 HG22 ILE A 56 3.823 1.645 3.315 1.00 41.03 H new ATOM 0 HG23 ILE A 56 4.590 0.788 4.672 1.00 41.03 H new ATOM 0 HD11 ILE A 56 4.776 -2.862 5.513 1.00 20.12 H new ATOM 0 HD12 ILE A 56 5.164 -1.127 5.436 1.00 20.12 H new ATOM 0 HD13 ILE A 56 3.587 -1.658 6.064 1.00 20.12 H new ATOM 930 N PHE A 57 1.456 2.097 5.344 1.00 3.33 N ATOM 931 CA PHE A 57 1.108 3.525 5.328 1.00 24.44 C ATOM 932 C PHE A 57 2.391 4.356 5.205 1.00 61.02 C ATOM 933 O PHE A 57 3.250 4.306 6.096 1.00 41.40 O ATOM 934 CB PHE A 57 0.335 3.897 6.615 1.00 5.12 C ATOM 935 CG PHE A 57 -1.069 3.311 6.672 1.00 11.41 C ATOM 936 CD1 PHE A 57 -1.276 1.968 6.996 1.00 40.31 C ATOM 937 CD2 PHE A 57 -2.180 4.101 6.381 1.00 34.23 C ATOM 938 CE1 PHE A 57 -2.548 1.439 7.019 1.00 72.24 C ATOM 939 CE2 PHE A 57 -3.445 3.567 6.398 1.00 1.05 C ATOM 940 CZ PHE A 57 -3.628 2.240 6.719 1.00 13.25 C ATOM 0 H PHE A 57 1.717 1.751 6.267 1.00 3.33 H new ATOM 0 HA PHE A 57 0.465 3.737 4.473 1.00 24.44 H new ATOM 0 HB2 PHE A 57 0.900 3.551 7.481 1.00 5.12 H new ATOM 0 HB3 PHE A 57 0.270 4.983 6.689 1.00 5.12 H new ATOM 0 HD1 PHE A 57 -0.431 1.338 7.231 1.00 40.31 H new ATOM 0 HD2 PHE A 57 -2.044 5.145 6.139 1.00 34.23 H new ATOM 0 HE1 PHE A 57 -2.698 0.400 7.271 1.00 72.24 H new ATOM 0 HE2 PHE A 57 -4.296 4.187 6.160 1.00 1.05 H new ATOM 0 HZ PHE A 57 -4.625 1.825 6.736 1.00 13.25 H new ATOM 950 N ILE A 58 2.514 5.104 4.098 1.00 51.11 N ATOM 951 CA ILE A 58 3.676 5.979 3.824 1.00 34.43 C ATOM 952 C ILE A 58 3.227 7.246 3.075 1.00 5.52 C ATOM 953 O ILE A 58 2.298 7.205 2.256 1.00 70.04 O ATOM 954 CB ILE A 58 4.816 5.237 3.023 1.00 34.13 C ATOM 955 CG1 ILE A 58 4.235 4.357 1.879 1.00 24.01 C ATOM 956 CG2 ILE A 58 5.733 4.410 3.959 1.00 63.24 C ATOM 957 CD1 ILE A 58 5.280 3.563 1.120 1.00 74.42 C ATOM 0 H ILE A 58 1.809 5.123 3.361 1.00 51.11 H new ATOM 0 HA ILE A 58 4.099 6.262 4.788 1.00 34.43 H new ATOM 0 HB ILE A 58 5.433 6.008 2.562 1.00 34.13 H new ATOM 0 HG12 ILE A 58 3.505 3.667 2.301 1.00 24.01 H new ATOM 0 HG13 ILE A 58 3.700 4.998 1.178 1.00 24.01 H new ATOM 0 HG21 ILE A 58 6.504 3.915 3.369 1.00 63.24 H new ATOM 0 HG22 ILE A 58 6.202 5.072 4.687 1.00 63.24 H new ATOM 0 HG23 ILE A 58 5.139 3.660 4.481 1.00 63.24 H new ATOM 0 HD11 ILE A 58 4.795 2.976 0.340 1.00 74.42 H new ATOM 0 HD12 ILE A 58 5.998 4.247 0.667 1.00 74.42 H new ATOM 0 HD13 ILE A 58 5.799 2.895 1.807 1.00 74.42 H new ATOM 969 N ARG A 59 3.911 8.367 3.370 1.00 74.54 N ATOM 970 CA ARG A 59 3.489 9.713 2.953 1.00 73.44 C ATOM 971 C ARG A 59 4.451 10.317 1.919 1.00 40.12 C ATOM 972 O ARG A 59 5.632 10.499 2.232 1.00 54.44 O ATOM 973 CB ARG A 59 3.442 10.666 4.182 1.00 72.43 C ATOM 974 CG ARG A 59 2.669 11.981 3.928 1.00 14.00 C ATOM 975 CD ARG A 59 3.032 13.095 4.918 1.00 22.20 C ATOM 976 NE ARG A 59 4.415 13.557 4.733 1.00 5.53 N ATOM 977 CZ ARG A 59 4.811 14.479 3.838 1.00 71.31 C ATOM 978 NH1 ARG A 59 3.939 15.072 3.023 1.00 74.44 N ATOM 979 NH2 ARG A 59 6.089 14.800 3.764 1.00 42.23 N ATOM 0 H ARG A 59 4.778 8.362 3.908 1.00 74.54 H new ATOM 0 HA ARG A 59 2.501 9.612 2.505 1.00 73.44 H new ATOM 0 HB2 ARG A 59 2.981 10.141 5.019 1.00 72.43 H new ATOM 0 HB3 ARG A 59 4.462 10.908 4.481 1.00 72.43 H new ATOM 0 HG2 ARG A 59 2.872 12.324 2.914 1.00 14.00 H new ATOM 0 HG3 ARG A 59 1.599 11.784 3.989 1.00 14.00 H new ATOM 0 HD2 ARG A 59 2.348 13.934 4.789 1.00 22.20 H new ATOM 0 HD3 ARG A 59 2.903 12.732 5.938 1.00 22.20 H new ATOM 0 HE ARG A 59 5.131 13.145 5.331 1.00 5.53 H new ATOM 0 HH11 ARG A 59 2.950 14.829 3.071 1.00 74.44 H new ATOM 0 HH12 ARG A 59 4.261 15.769 2.351 1.00 74.44 H new ATOM 0 HH21 ARG A 59 6.764 14.350 4.382 1.00 42.23 H new ATOM 0 HH22 ARG A 59 6.401 15.498 3.089 1.00 42.23 H new ATOM 993 N GLY A 60 3.920 10.600 0.711 1.00 61.20 N ATOM 994 CA GLY A 60 4.561 11.467 -0.291 1.00 63.13 C ATOM 995 C GLY A 60 6.000 11.098 -0.666 1.00 33.32 C ATOM 996 O GLY A 60 6.226 10.372 -1.620 1.00 41.11 O ATOM 0 H GLY A 60 3.022 10.226 0.403 1.00 61.20 H new ATOM 0 HA2 GLY A 60 3.954 11.454 -1.197 1.00 63.13 H new ATOM 0 HA3 GLY A 60 4.554 12.491 0.083 1.00 63.13 H new ATOM 1000 N ALA A 61 6.979 11.604 0.106 1.00 30.00 N ATOM 1001 CA ALA A 61 8.425 11.344 -0.129 1.00 43.22 C ATOM 1002 C ALA A 61 8.734 9.842 -0.006 1.00 21.41 C ATOM 1003 O ALA A 61 9.548 9.280 -0.743 1.00 13.41 O ATOM 1004 CB ALA A 61 9.263 12.144 0.876 1.00 52.55 C ATOM 0 H ALA A 61 6.798 12.204 0.911 1.00 30.00 H new ATOM 0 HA ALA A 61 8.679 11.661 -1.140 1.00 43.22 H new ATOM 0 HB1 ALA A 61 10.322 11.952 0.702 1.00 52.55 H new ATOM 0 HB2 ALA A 61 9.062 13.208 0.752 1.00 52.55 H new ATOM 0 HB3 ALA A 61 9.002 11.842 1.890 1.00 52.55 H new ATOM 1010 N TYR A 62 8.025 9.220 0.935 1.00 24.41 N ATOM 1011 CA TYR A 62 8.147 7.802 1.263 1.00 23.15 C ATOM 1012 C TYR A 62 7.511 6.912 0.178 1.00 63.12 C ATOM 1013 O TYR A 62 7.873 5.743 0.052 1.00 52.43 O ATOM 1014 CB TYR A 62 7.489 7.508 2.636 1.00 60.43 C ATOM 1015 CG TYR A 62 7.890 8.423 3.809 1.00 5.10 C ATOM 1016 CD1 TYR A 62 9.130 9.056 3.862 1.00 22.41 C ATOM 1017 CD2 TYR A 62 7.011 8.635 4.877 1.00 71.12 C ATOM 1018 CE1 TYR A 62 9.476 9.863 4.927 1.00 30.51 C ATOM 1019 CE2 TYR A 62 7.358 9.439 5.943 1.00 51.21 C ATOM 1020 CZ TYR A 62 8.588 10.048 5.966 1.00 45.32 C ATOM 1021 OH TYR A 62 8.934 10.843 7.037 1.00 10.53 O ATOM 0 H TYR A 62 7.331 9.703 1.506 1.00 24.41 H new ATOM 0 HA TYR A 62 9.210 7.567 1.313 1.00 23.15 H new ATOM 0 HB2 TYR A 62 6.407 7.567 2.514 1.00 60.43 H new ATOM 0 HB3 TYR A 62 7.723 6.480 2.912 1.00 60.43 H new ATOM 0 HD1 TYR A 62 9.833 8.913 3.055 1.00 22.41 H new ATOM 0 HD2 TYR A 62 6.041 8.160 4.867 1.00 71.12 H new ATOM 0 HE1 TYR A 62 10.440 10.349 4.947 1.00 30.51 H new ATOM 0 HE2 TYR A 62 6.664 9.589 6.757 1.00 51.21 H new ATOM 0 HH TYR A 62 8.194 10.867 7.679 1.00 10.53 H new ATOM 1031 N GLU A 63 6.497 7.448 -0.548 1.00 31.05 N ATOM 1032 CA GLU A 63 5.767 6.680 -1.587 1.00 12.24 C ATOM 1033 C GLU A 63 6.713 6.235 -2.720 1.00 23.24 C ATOM 1034 O GLU A 63 6.496 5.188 -3.315 1.00 3.35 O ATOM 1035 CB GLU A 63 4.558 7.479 -2.160 1.00 14.01 C ATOM 1036 CG GLU A 63 4.836 8.371 -3.407 1.00 2.43 C ATOM 1037 CD GLU A 63 3.643 9.260 -3.822 1.00 3.50 C ATOM 1038 OE1 GLU A 63 3.360 10.250 -3.114 1.00 13.24 O ATOM 1039 OE2 GLU A 63 2.972 8.971 -4.842 1.00 22.34 O ATOM 0 H GLU A 63 6.168 8.406 -0.433 1.00 31.05 H new ATOM 0 HA GLU A 63 5.370 5.788 -1.103 1.00 12.24 H new ATOM 0 HB2 GLU A 63 3.772 6.769 -2.418 1.00 14.01 H new ATOM 0 HB3 GLU A 63 4.164 8.115 -1.367 1.00 14.01 H new ATOM 0 HG2 GLU A 63 5.696 9.008 -3.201 1.00 2.43 H new ATOM 0 HG3 GLU A 63 5.108 7.730 -4.246 1.00 2.43 H new ATOM 1046 N GLU A 64 7.779 7.027 -2.972 1.00 14.12 N ATOM 1047 CA GLU A 64 8.817 6.702 -3.977 1.00 33.45 C ATOM 1048 C GLU A 64 9.464 5.319 -3.707 1.00 1.13 C ATOM 1049 O GLU A 64 9.829 4.596 -4.639 1.00 50.21 O ATOM 1050 CB GLU A 64 9.901 7.814 -3.998 1.00 14.32 C ATOM 1051 CG GLU A 64 11.108 7.496 -4.902 1.00 53.35 C ATOM 1052 CD GLU A 64 12.147 8.616 -4.981 1.00 65.32 C ATOM 1053 OE1 GLU A 64 12.831 8.868 -3.969 1.00 20.53 O ATOM 1054 OE2 GLU A 64 12.298 9.243 -6.058 1.00 13.32 O ATOM 0 H GLU A 64 7.944 7.908 -2.486 1.00 14.12 H new ATOM 0 HA GLU A 64 8.335 6.651 -4.953 1.00 33.45 H new ATOM 0 HB2 GLU A 64 9.445 8.746 -4.333 1.00 14.32 H new ATOM 0 HB3 GLU A 64 10.256 7.980 -2.981 1.00 14.32 H new ATOM 0 HG2 GLU A 64 11.593 6.591 -4.536 1.00 53.35 H new ATOM 0 HG3 GLU A 64 10.747 7.279 -5.907 1.00 53.35 H new ATOM 1061 N VAL A 65 9.555 4.969 -2.412 1.00 71.24 N ATOM 1062 CA VAL A 65 10.159 3.713 -1.941 1.00 54.41 C ATOM 1063 C VAL A 65 9.357 2.479 -2.427 1.00 73.52 C ATOM 1064 O VAL A 65 9.941 1.413 -2.627 1.00 53.11 O ATOM 1065 CB VAL A 65 10.305 3.694 -0.371 1.00 24.51 C ATOM 1066 CG1 VAL A 65 11.040 2.424 0.123 1.00 33.33 C ATOM 1067 CG2 VAL A 65 11.009 4.979 0.141 1.00 61.23 C ATOM 0 H VAL A 65 9.207 5.558 -1.655 1.00 71.24 H new ATOM 0 HA VAL A 65 11.158 3.659 -2.374 1.00 54.41 H new ATOM 0 HB VAL A 65 9.298 3.670 0.047 1.00 24.51 H new ATOM 0 HG11 VAL A 65 11.120 2.449 1.210 1.00 33.33 H new ATOM 0 HG12 VAL A 65 10.480 1.539 -0.179 1.00 33.33 H new ATOM 0 HG13 VAL A 65 12.038 2.388 -0.314 1.00 33.33 H new ATOM 0 HG21 VAL A 65 11.096 4.938 1.227 1.00 61.23 H new ATOM 0 HG22 VAL A 65 12.003 5.050 -0.300 1.00 61.23 H new ATOM 0 HG23 VAL A 65 10.423 5.853 -0.143 1.00 61.23 H new ATOM 1077 N VAL A 66 8.022 2.639 -2.640 1.00 63.51 N ATOM 1078 CA VAL A 66 7.145 1.535 -3.130 1.00 50.11 C ATOM 1079 C VAL A 66 7.704 0.900 -4.421 1.00 52.34 C ATOM 1080 O VAL A 66 7.537 -0.285 -4.637 1.00 2.23 O ATOM 1081 CB VAL A 66 5.664 1.992 -3.400 1.00 30.54 C ATOM 1082 CG1 VAL A 66 4.770 0.837 -3.918 1.00 32.24 C ATOM 1083 CG2 VAL A 66 5.037 2.628 -2.160 1.00 41.14 C ATOM 0 H VAL A 66 7.530 3.518 -2.481 1.00 63.51 H new ATOM 0 HA VAL A 66 7.135 0.801 -2.324 1.00 50.11 H new ATOM 0 HB VAL A 66 5.720 2.744 -4.187 1.00 30.54 H new ATOM 0 HG11 VAL A 66 3.759 1.207 -4.088 1.00 32.24 H new ATOM 0 HG12 VAL A 66 5.177 0.453 -4.853 1.00 32.24 H new ATOM 0 HG13 VAL A 66 4.744 0.037 -3.178 1.00 32.24 H new ATOM 0 HG21 VAL A 66 4.014 2.931 -2.384 1.00 41.14 H new ATOM 0 HG22 VAL A 66 5.031 1.905 -1.344 1.00 41.14 H new ATOM 0 HG23 VAL A 66 5.618 3.502 -1.866 1.00 41.14 H new ATOM 1093 N ARG A 67 8.384 1.714 -5.247 1.00 23.24 N ATOM 1094 CA ARG A 67 9.008 1.267 -6.507 1.00 63.31 C ATOM 1095 C ARG A 67 9.972 0.067 -6.269 1.00 23.04 C ATOM 1096 O ARG A 67 9.882 -0.958 -6.957 1.00 73.24 O ATOM 1097 CB ARG A 67 9.771 2.456 -7.141 1.00 61.53 C ATOM 1098 CG ARG A 67 10.416 2.167 -8.515 1.00 32.24 C ATOM 1099 CD ARG A 67 11.479 3.221 -8.905 1.00 53.13 C ATOM 1100 NE ARG A 67 12.558 3.338 -7.890 1.00 22.34 N ATOM 1101 CZ ARG A 67 13.466 2.383 -7.592 1.00 31.15 C ATOM 1102 NH1 ARG A 67 13.463 1.211 -8.218 1.00 22.40 N ATOM 1103 NH2 ARG A 67 14.371 2.601 -6.648 1.00 3.35 N ATOM 0 H ARG A 67 8.518 2.708 -5.059 1.00 23.24 H new ATOM 0 HA ARG A 67 8.226 0.926 -7.185 1.00 63.31 H new ATOM 0 HB2 ARG A 67 9.081 3.293 -7.250 1.00 61.53 H new ATOM 0 HB3 ARG A 67 10.552 2.775 -6.451 1.00 61.53 H new ATOM 0 HG2 ARG A 67 10.878 1.180 -8.495 1.00 32.24 H new ATOM 0 HG3 ARG A 67 9.639 2.140 -9.279 1.00 32.24 H new ATOM 0 HD2 ARG A 67 11.916 2.954 -9.867 1.00 53.13 H new ATOM 0 HD3 ARG A 67 10.997 4.190 -9.032 1.00 53.13 H new ATOM 0 HE ARG A 67 12.618 4.215 -7.373 1.00 22.34 H new ATOM 0 HH11 ARG A 67 12.767 1.019 -8.938 1.00 22.40 H new ATOM 0 HH12 ARG A 67 14.157 0.503 -7.978 1.00 22.40 H new ATOM 0 HH21 ARG A 67 14.382 3.489 -6.147 1.00 3.35 H new ATOM 0 HH22 ARG A 67 15.057 1.880 -6.423 1.00 3.35 H new ATOM 1117 N ASP A 68 10.888 0.213 -5.287 1.00 71.51 N ATOM 1118 CA ASP A 68 11.827 -0.869 -4.893 1.00 2.51 C ATOM 1119 C ASP A 68 11.150 -1.936 -3.986 1.00 60.45 C ATOM 1120 O ASP A 68 11.561 -3.099 -3.987 1.00 14.11 O ATOM 1121 CB ASP A 68 13.124 -0.297 -4.258 1.00 63.15 C ATOM 1122 CG ASP A 68 12.909 0.509 -2.965 1.00 34.11 C ATOM 1123 OD1 ASP A 68 12.856 -0.101 -1.868 1.00 50.15 O ATOM 1124 OD2 ASP A 68 12.834 1.758 -3.036 1.00 55.42 O ATOM 0 H ASP A 68 11.000 1.072 -4.749 1.00 71.51 H new ATOM 0 HA ASP A 68 12.119 -1.385 -5.807 1.00 2.51 H new ATOM 0 HB2 ASP A 68 13.803 -1.123 -4.046 1.00 63.15 H new ATOM 0 HB3 ASP A 68 13.619 0.342 -4.990 1.00 63.15 H new ATOM 1129 N ILE A 69 10.129 -1.523 -3.191 1.00 31.13 N ATOM 1130 CA ILE A 69 9.283 -2.454 -2.379 1.00 15.22 C ATOM 1131 C ILE A 69 8.542 -3.457 -3.299 1.00 53.34 C ATOM 1132 O ILE A 69 8.390 -4.644 -2.965 1.00 4.52 O ATOM 1133 CB ILE A 69 8.237 -1.660 -1.485 1.00 24.51 C ATOM 1134 CG1 ILE A 69 8.967 -0.767 -0.428 1.00 44.54 C ATOM 1135 CG2 ILE A 69 7.212 -2.601 -0.795 1.00 1.43 C ATOM 1136 CD1 ILE A 69 8.054 0.164 0.365 1.00 31.12 C ATOM 0 H ILE A 69 9.865 -0.543 -3.091 1.00 31.13 H new ATOM 0 HA ILE A 69 9.947 -3.005 -1.713 1.00 15.22 H new ATOM 0 HB ILE A 69 7.675 -1.013 -2.159 1.00 24.51 H new ATOM 0 HG12 ILE A 69 9.496 -1.415 0.270 1.00 44.54 H new ATOM 0 HG13 ILE A 69 9.720 -0.166 -0.939 1.00 44.54 H new ATOM 0 HG21 ILE A 69 6.520 -2.009 -0.196 1.00 1.43 H new ATOM 0 HG22 ILE A 69 6.656 -3.152 -1.553 1.00 1.43 H new ATOM 0 HG23 ILE A 69 7.740 -3.304 -0.150 1.00 1.43 H new ATOM 0 HD11 ILE A 69 8.649 0.742 1.072 1.00 31.12 H new ATOM 0 HD12 ILE A 69 7.543 0.842 -0.319 1.00 31.12 H new ATOM 0 HD13 ILE A 69 7.317 -0.426 0.909 1.00 31.12 H new ATOM 1148 N VAL A 70 8.139 -2.945 -4.480 1.00 63.45 N ATOM 1149 CA VAL A 70 7.474 -3.708 -5.544 1.00 54.12 C ATOM 1150 C VAL A 70 8.411 -4.819 -6.025 1.00 35.32 C ATOM 1151 O VAL A 70 8.012 -5.981 -6.065 1.00 41.40 O ATOM 1152 CB VAL A 70 7.038 -2.740 -6.737 1.00 64.43 C ATOM 1153 CG1 VAL A 70 6.989 -3.443 -8.114 1.00 5.54 C ATOM 1154 CG2 VAL A 70 5.675 -2.072 -6.425 1.00 62.41 C ATOM 0 H VAL A 70 8.273 -1.963 -4.722 1.00 63.45 H new ATOM 0 HA VAL A 70 6.564 -4.167 -5.157 1.00 54.12 H new ATOM 0 HB VAL A 70 7.812 -1.976 -6.808 1.00 64.43 H new ATOM 0 HG11 VAL A 70 6.686 -2.727 -8.878 1.00 5.54 H new ATOM 0 HG12 VAL A 70 7.976 -3.836 -8.357 1.00 5.54 H new ATOM 0 HG13 VAL A 70 6.271 -4.262 -8.079 1.00 5.54 H new ATOM 0 HG21 VAL A 70 5.394 -1.416 -7.249 1.00 62.41 H new ATOM 0 HG22 VAL A 70 4.913 -2.841 -6.298 1.00 62.41 H new ATOM 0 HG23 VAL A 70 5.757 -1.488 -5.508 1.00 62.41 H new ATOM 1164 N GLU A 71 9.680 -4.432 -6.304 1.00 64.44 N ATOM 1165 CA GLU A 71 10.730 -5.351 -6.777 1.00 15.31 C ATOM 1166 C GLU A 71 10.895 -6.553 -5.831 1.00 63.34 C ATOM 1167 O GLU A 71 10.915 -7.702 -6.284 1.00 54.10 O ATOM 1168 CB GLU A 71 12.082 -4.616 -6.932 1.00 73.33 C ATOM 1169 CG GLU A 71 12.081 -3.484 -7.973 1.00 30.30 C ATOM 1170 CD GLU A 71 13.461 -2.830 -8.125 1.00 32.21 C ATOM 1171 OE1 GLU A 71 14.420 -3.541 -8.498 1.00 10.54 O ATOM 1172 OE2 GLU A 71 13.600 -1.616 -7.869 1.00 42.44 O ATOM 0 H GLU A 71 9.999 -3.468 -6.205 1.00 64.44 H new ATOM 0 HA GLU A 71 10.416 -5.722 -7.753 1.00 15.31 H new ATOM 0 HB2 GLU A 71 12.368 -4.202 -5.965 1.00 73.33 H new ATOM 0 HB3 GLU A 71 12.846 -5.343 -7.206 1.00 73.33 H new ATOM 0 HG2 GLU A 71 11.761 -3.880 -8.937 1.00 30.30 H new ATOM 0 HG3 GLU A 71 11.353 -2.727 -7.682 1.00 30.30 H new ATOM 1179 N TYR A 72 10.963 -6.261 -4.515 1.00 43.31 N ATOM 1180 CA TYR A 72 11.088 -7.289 -3.469 1.00 61.20 C ATOM 1181 C TYR A 72 9.864 -8.225 -3.451 1.00 51.32 C ATOM 1182 O TYR A 72 10.015 -9.447 -3.394 1.00 12.44 O ATOM 1183 CB TYR A 72 11.273 -6.642 -2.073 1.00 4.14 C ATOM 1184 CG TYR A 72 11.353 -7.680 -0.936 1.00 0.51 C ATOM 1185 CD1 TYR A 72 12.549 -8.338 -0.640 1.00 11.33 C ATOM 1186 CD2 TYR A 72 10.218 -8.031 -0.188 1.00 41.54 C ATOM 1187 CE1 TYR A 72 12.610 -9.292 0.352 1.00 3.34 C ATOM 1188 CE2 TYR A 72 10.283 -8.981 0.804 1.00 10.02 C ATOM 1189 CZ TYR A 72 11.479 -9.611 1.066 1.00 21.52 C ATOM 1190 OH TYR A 72 11.548 -10.573 2.046 1.00 3.52 O ATOM 0 H TYR A 72 10.933 -5.308 -4.152 1.00 43.31 H new ATOM 0 HA TYR A 72 11.973 -7.881 -3.704 1.00 61.20 H new ATOM 0 HB2 TYR A 72 12.183 -6.041 -2.074 1.00 4.14 H new ATOM 0 HB3 TYR A 72 10.443 -5.963 -1.880 1.00 4.14 H new ATOM 0 HD1 TYR A 72 13.441 -8.095 -1.198 1.00 11.33 H new ATOM 0 HD2 TYR A 72 9.276 -7.546 -0.396 1.00 41.54 H new ATOM 0 HE1 TYR A 72 13.544 -9.788 0.568 1.00 3.34 H new ATOM 0 HE2 TYR A 72 9.401 -9.232 1.374 1.00 10.02 H new ATOM 0 HH TYR A 72 10.976 -11.330 1.802 1.00 3.52 H new ATOM 1200 N ALA A 73 8.663 -7.632 -3.477 1.00 54.05 N ATOM 1201 CA ALA A 73 7.394 -8.378 -3.436 1.00 63.34 C ATOM 1202 C ALA A 73 7.237 -9.289 -4.677 1.00 12.44 C ATOM 1203 O ALA A 73 6.587 -10.335 -4.605 1.00 74.33 O ATOM 1204 CB ALA A 73 6.219 -7.409 -3.282 1.00 32.44 C ATOM 0 H ALA A 73 8.542 -6.620 -3.527 1.00 54.05 H new ATOM 0 HA ALA A 73 7.403 -9.035 -2.566 1.00 63.34 H new ATOM 0 HB1 ALA A 73 5.285 -7.971 -3.253 1.00 32.44 H new ATOM 0 HB2 ALA A 73 6.332 -6.844 -2.356 1.00 32.44 H new ATOM 0 HB3 ALA A 73 6.202 -6.721 -4.127 1.00 32.44 H new ATOM 1210 N GLN A 74 7.836 -8.865 -5.812 1.00 50.31 N ATOM 1211 CA GLN A 74 7.915 -9.673 -7.048 1.00 10.10 C ATOM 1212 C GLN A 74 8.830 -10.898 -6.845 1.00 13.44 C ATOM 1213 O GLN A 74 8.572 -11.954 -7.423 1.00 14.03 O ATOM 1214 CB GLN A 74 8.444 -8.820 -8.228 1.00 42.05 C ATOM 1215 CG GLN A 74 7.534 -7.638 -8.625 1.00 31.42 C ATOM 1216 CD GLN A 74 8.177 -6.673 -9.627 1.00 44.35 C ATOM 1217 OE1 GLN A 74 9.397 -6.529 -9.691 1.00 61.02 O ATOM 1218 NE2 GLN A 74 7.368 -5.975 -10.388 1.00 0.42 N ATOM 0 H GLN A 74 8.279 -7.950 -5.896 1.00 50.31 H new ATOM 0 HA GLN A 74 6.908 -10.019 -7.283 1.00 10.10 H new ATOM 0 HB2 GLN A 74 9.428 -8.432 -7.966 1.00 42.05 H new ATOM 0 HB3 GLN A 74 8.577 -9.466 -9.096 1.00 42.05 H new ATOM 0 HG2 GLN A 74 6.611 -8.030 -9.053 1.00 31.42 H new ATOM 0 HG3 GLN A 74 7.260 -7.085 -7.727 1.00 31.42 H new ATOM 0 HE21 GLN A 74 6.359 -6.110 -10.319 1.00 0.42 H new ATOM 0 HE22 GLN A 74 7.748 -5.297 -11.049 1.00 0.42 H new ATOM 1227 N LYS A 75 9.903 -10.739 -6.020 1.00 22.00 N ATOM 1228 CA LYS A 75 10.823 -11.860 -5.667 1.00 10.10 C ATOM 1229 C LYS A 75 10.068 -12.896 -4.811 1.00 23.15 C ATOM 1230 O LYS A 75 10.301 -14.102 -4.922 1.00 4.21 O ATOM 1231 CB LYS A 75 12.091 -11.373 -4.888 1.00 60.45 C ATOM 1232 CG LYS A 75 12.808 -10.144 -5.483 1.00 21.53 C ATOM 1233 CD LYS A 75 13.173 -10.279 -6.982 1.00 51.42 C ATOM 1234 CE LYS A 75 13.794 -8.984 -7.543 1.00 41.45 C ATOM 1235 NZ LYS A 75 14.049 -9.061 -9.005 1.00 11.02 N ATOM 0 H LYS A 75 10.152 -9.849 -5.588 1.00 22.00 H new ATOM 0 HA LYS A 75 11.162 -12.307 -6.602 1.00 10.10 H new ATOM 0 HB2 LYS A 75 11.799 -11.140 -3.864 1.00 60.45 H new ATOM 0 HB3 LYS A 75 12.803 -12.197 -4.837 1.00 60.45 H new ATOM 0 HG2 LYS A 75 12.171 -9.269 -5.354 1.00 21.53 H new ATOM 0 HG3 LYS A 75 13.720 -9.960 -4.915 1.00 21.53 H new ATOM 0 HD2 LYS A 75 13.874 -11.103 -7.112 1.00 51.42 H new ATOM 0 HD3 LYS A 75 12.278 -10.529 -7.552 1.00 51.42 H new ATOM 0 HE2 LYS A 75 13.127 -8.147 -7.338 1.00 41.45 H new ATOM 0 HE3 LYS A 75 14.731 -8.780 -7.024 1.00 41.45 H new ATOM 0 HZ1 LYS A 75 14.466 -8.166 -9.332 1.00 11.02 H new ATOM 0 HZ2 LYS A 75 14.707 -9.842 -9.202 1.00 11.02 H new ATOM 0 HZ3 LYS A 75 13.153 -9.228 -9.505 1.00 11.02 H new ATOM 1249 N GLU A 76 9.159 -12.378 -3.957 1.00 51.12 N ATOM 1250 CA GLU A 76 8.262 -13.198 -3.120 1.00 1.43 C ATOM 1251 C GLU A 76 7.139 -13.824 -3.978 1.00 34.32 C ATOM 1252 O GLU A 76 6.559 -14.843 -3.602 1.00 10.40 O ATOM 1253 CB GLU A 76 7.678 -12.329 -1.963 1.00 40.22 C ATOM 1254 CG GLU A 76 8.722 -11.544 -1.136 1.00 61.44 C ATOM 1255 CD GLU A 76 9.751 -12.417 -0.387 1.00 60.11 C ATOM 1256 OE1 GLU A 76 10.732 -12.882 -1.009 1.00 62.31 O ATOM 1257 OE2 GLU A 76 9.606 -12.610 0.841 1.00 30.25 O ATOM 0 H GLU A 76 9.028 -11.375 -3.830 1.00 51.12 H new ATOM 0 HA GLU A 76 8.832 -14.016 -2.680 1.00 1.43 H new ATOM 0 HB2 GLU A 76 6.966 -11.620 -2.386 1.00 40.22 H new ATOM 0 HB3 GLU A 76 7.119 -12.978 -1.289 1.00 40.22 H new ATOM 0 HG2 GLU A 76 9.258 -10.868 -1.803 1.00 61.44 H new ATOM 0 HG3 GLU A 76 8.196 -10.924 -0.409 1.00 61.44 H new ATOM 1264 N GLY A 77 6.870 -13.204 -5.145 1.00 2.42 N ATOM 1265 CA GLY A 77 5.856 -13.684 -6.089 1.00 54.33 C ATOM 1266 C GLY A 77 4.443 -13.357 -5.631 1.00 30.43 C ATOM 1267 O GLY A 77 3.506 -14.130 -5.853 1.00 14.21 O ATOM 0 H GLY A 77 7.351 -12.359 -5.453 1.00 2.42 H new ATOM 0 HA2 GLY A 77 6.032 -13.236 -7.067 1.00 54.33 H new ATOM 0 HA3 GLY A 77 5.956 -14.763 -6.210 1.00 54.33 H new ATOM 1271 N LEU A 78 4.310 -12.203 -4.965 1.00 10.14 N ATOM 1272 CA LEU A 78 3.043 -11.720 -4.404 1.00 32.32 C ATOM 1273 C LEU A 78 2.348 -10.764 -5.381 1.00 51.41 C ATOM 1274 O LEU A 78 3.011 -10.072 -6.167 1.00 30.44 O ATOM 1275 CB LEU A 78 3.311 -11.003 -3.048 1.00 54.44 C ATOM 1276 CG LEU A 78 3.967 -11.878 -1.933 1.00 31.23 C ATOM 1277 CD1 LEU A 78 4.271 -11.051 -0.671 1.00 53.32 C ATOM 1278 CD2 LEU A 78 3.092 -13.106 -1.599 1.00 34.43 C ATOM 0 H LEU A 78 5.092 -11.569 -4.799 1.00 10.14 H new ATOM 0 HA LEU A 78 2.385 -12.573 -4.236 1.00 32.32 H new ATOM 0 HB2 LEU A 78 3.955 -10.143 -3.234 1.00 54.44 H new ATOM 0 HB3 LEU A 78 2.365 -10.616 -2.670 1.00 54.44 H new ATOM 0 HG LEU A 78 4.918 -12.242 -2.321 1.00 31.23 H new ATOM 0 HD11 LEU A 78 4.727 -11.692 0.083 1.00 53.32 H new ATOM 0 HD12 LEU A 78 4.957 -10.242 -0.922 1.00 53.32 H new ATOM 0 HD13 LEU A 78 3.344 -10.632 -0.279 1.00 53.32 H new ATOM 0 HD21 LEU A 78 3.575 -13.696 -0.820 1.00 34.43 H new ATOM 0 HD22 LEU A 78 2.115 -12.772 -1.249 1.00 34.43 H new ATOM 0 HD23 LEU A 78 2.968 -13.718 -2.492 1.00 34.43 H new ATOM 1290 N ARG A 79 1.008 -10.748 -5.325 1.00 53.21 N ATOM 1291 CA ARG A 79 0.175 -9.788 -6.059 1.00 21.10 C ATOM 1292 C ARG A 79 0.319 -8.431 -5.348 1.00 51.45 C ATOM 1293 O ARG A 79 -0.023 -8.315 -4.176 1.00 71.12 O ATOM 1294 CB ARG A 79 -1.306 -10.311 -6.072 1.00 74.41 C ATOM 1295 CG ARG A 79 -2.347 -9.514 -6.920 1.00 42.14 C ATOM 1296 CD ARG A 79 -2.778 -8.157 -6.312 1.00 31.22 C ATOM 1297 NE ARG A 79 -3.921 -7.553 -7.021 1.00 62.13 N ATOM 1298 CZ ARG A 79 -3.850 -6.683 -8.036 1.00 53.43 C ATOM 1299 NH1 ARG A 79 -2.680 -6.265 -8.518 1.00 15.44 N ATOM 1300 NH2 ARG A 79 -4.968 -6.187 -8.535 1.00 73.53 N ATOM 0 H ARG A 79 0.469 -11.407 -4.764 1.00 53.21 H new ATOM 0 HA ARG A 79 0.482 -9.673 -7.099 1.00 21.10 H new ATOM 0 HB2 ARG A 79 -1.296 -11.340 -6.433 1.00 74.41 H new ATOM 0 HB3 ARG A 79 -1.662 -10.338 -5.042 1.00 74.41 H new ATOM 0 HG2 ARG A 79 -1.928 -9.336 -7.910 1.00 42.14 H new ATOM 0 HG3 ARG A 79 -3.234 -10.133 -7.056 1.00 42.14 H new ATOM 0 HD2 ARG A 79 -3.041 -8.300 -5.264 1.00 31.22 H new ATOM 0 HD3 ARG A 79 -1.934 -7.468 -6.338 1.00 31.22 H new ATOM 0 HE ARG A 79 -4.854 -7.823 -6.709 1.00 62.13 H new ATOM 0 HH11 ARG A 79 -1.809 -6.609 -8.113 1.00 15.44 H new ATOM 0 HH12 ARG A 79 -2.655 -5.601 -9.292 1.00 15.44 H new ATOM 0 HH21 ARG A 79 -5.868 -6.468 -8.147 1.00 73.53 H new ATOM 0 HH22 ARG A 79 -4.931 -5.523 -9.308 1.00 73.53 H new ATOM 1314 N VAL A 80 0.831 -7.415 -6.046 1.00 1.02 N ATOM 1315 CA VAL A 80 1.063 -6.086 -5.456 1.00 13.21 C ATOM 1316 C VAL A 80 0.009 -5.123 -6.014 1.00 23.10 C ATOM 1317 O VAL A 80 -0.159 -5.020 -7.240 1.00 72.31 O ATOM 1318 CB VAL A 80 2.516 -5.545 -5.746 1.00 15.22 C ATOM 1319 CG1 VAL A 80 2.825 -4.287 -4.893 1.00 20.24 C ATOM 1320 CG2 VAL A 80 3.576 -6.648 -5.529 1.00 63.32 C ATOM 0 H VAL A 80 1.096 -7.484 -7.029 1.00 1.02 H new ATOM 0 HA VAL A 80 0.976 -6.164 -4.372 1.00 13.21 H new ATOM 0 HB VAL A 80 2.559 -5.250 -6.795 1.00 15.22 H new ATOM 0 HG11 VAL A 80 3.833 -3.936 -5.114 1.00 20.24 H new ATOM 0 HG12 VAL A 80 2.107 -3.501 -5.130 1.00 20.24 H new ATOM 0 HG13 VAL A 80 2.752 -4.538 -3.835 1.00 20.24 H new ATOM 0 HG21 VAL A 80 4.568 -6.246 -5.736 1.00 63.32 H new ATOM 0 HG22 VAL A 80 3.534 -6.995 -4.497 1.00 63.32 H new ATOM 0 HG23 VAL A 80 3.375 -7.483 -6.201 1.00 63.32 H new ATOM 1330 N LEU A 81 -0.734 -4.482 -5.114 1.00 72.31 N ATOM 1331 CA LEU A 81 -1.798 -3.540 -5.454 1.00 61.13 C ATOM 1332 C LEU A 81 -1.712 -2.339 -4.508 1.00 42.21 C ATOM 1333 O LEU A 81 -2.028 -2.468 -3.328 1.00 10.43 O ATOM 1334 CB LEU A 81 -3.165 -4.256 -5.316 1.00 3.15 C ATOM 1335 CG LEU A 81 -4.422 -3.433 -5.694 1.00 52.15 C ATOM 1336 CD1 LEU A 81 -4.295 -2.922 -7.122 1.00 61.24 C ATOM 1337 CD2 LEU A 81 -5.713 -4.261 -5.508 1.00 35.40 C ATOM 0 H LEU A 81 -0.611 -4.605 -4.109 1.00 72.31 H new ATOM 0 HA LEU A 81 -1.691 -3.188 -6.480 1.00 61.13 H new ATOM 0 HB2 LEU A 81 -3.145 -5.151 -5.938 1.00 3.15 H new ATOM 0 HB3 LEU A 81 -3.273 -4.587 -4.283 1.00 3.15 H new ATOM 0 HG LEU A 81 -4.491 -2.577 -5.023 1.00 52.15 H new ATOM 0 HD11 LEU A 81 -5.182 -2.344 -7.382 1.00 61.24 H new ATOM 0 HD12 LEU A 81 -3.412 -2.288 -7.205 1.00 61.24 H new ATOM 0 HD13 LEU A 81 -4.200 -3.767 -7.804 1.00 61.24 H new ATOM 0 HD21 LEU A 81 -6.577 -3.655 -5.782 1.00 35.40 H new ATOM 0 HD22 LEU A 81 -5.673 -5.145 -6.145 1.00 35.40 H new ATOM 0 HD23 LEU A 81 -5.801 -4.568 -4.466 1.00 35.40 H new ATOM 1349 N VAL A 82 -1.290 -1.177 -5.011 1.00 31.33 N ATOM 1350 CA VAL A 82 -1.121 0.022 -4.172 1.00 70.20 C ATOM 1351 C VAL A 82 -2.369 0.920 -4.290 1.00 65.03 C ATOM 1352 O VAL A 82 -2.832 1.219 -5.391 1.00 75.41 O ATOM 1353 CB VAL A 82 0.208 0.790 -4.531 1.00 4.31 C ATOM 1354 CG1 VAL A 82 1.412 -0.172 -4.437 1.00 0.11 C ATOM 1355 CG2 VAL A 82 0.164 1.456 -5.919 1.00 44.51 C ATOM 0 H VAL A 82 -1.058 -1.036 -5.994 1.00 31.33 H new ATOM 0 HA VAL A 82 -1.024 -0.283 -3.130 1.00 70.20 H new ATOM 0 HB VAL A 82 0.317 1.595 -3.804 1.00 4.31 H new ATOM 0 HG11 VAL A 82 2.327 0.365 -4.686 1.00 0.11 H new ATOM 0 HG12 VAL A 82 1.486 -0.564 -3.423 1.00 0.11 H new ATOM 0 HG13 VAL A 82 1.274 -0.997 -5.136 1.00 0.11 H new ATOM 0 HG21 VAL A 82 1.108 1.968 -6.107 1.00 44.51 H new ATOM 0 HG22 VAL A 82 0.006 0.695 -6.683 1.00 44.51 H new ATOM 0 HG23 VAL A 82 -0.653 2.177 -5.951 1.00 44.51 H new ATOM 1365 N ILE A 83 -2.948 1.288 -3.141 1.00 11.01 N ATOM 1366 CA ILE A 83 -4.161 2.119 -3.075 1.00 33.10 C ATOM 1367 C ILE A 83 -3.738 3.568 -2.761 1.00 31.32 C ATOM 1368 O ILE A 83 -3.234 3.850 -1.673 1.00 3.52 O ATOM 1369 CB ILE A 83 -5.148 1.582 -1.974 1.00 54.21 C ATOM 1370 CG1 ILE A 83 -5.407 0.053 -2.180 1.00 21.14 C ATOM 1371 CG2 ILE A 83 -6.485 2.382 -1.980 1.00 15.41 C ATOM 1372 CD1 ILE A 83 -6.139 -0.624 -1.036 1.00 14.23 C ATOM 0 H ILE A 83 -2.588 1.018 -2.226 1.00 11.01 H new ATOM 0 HA ILE A 83 -4.685 2.081 -4.030 1.00 33.10 H new ATOM 0 HB ILE A 83 -4.685 1.725 -0.998 1.00 54.21 H new ATOM 0 HG12 ILE A 83 -5.984 -0.084 -3.095 1.00 21.14 H new ATOM 0 HG13 ILE A 83 -4.450 -0.447 -2.328 1.00 21.14 H new ATOM 0 HG21 ILE A 83 -7.148 1.989 -1.209 1.00 15.41 H new ATOM 0 HG22 ILE A 83 -6.280 3.434 -1.781 1.00 15.41 H new ATOM 0 HG23 ILE A 83 -6.964 2.284 -2.954 1.00 15.41 H new ATOM 0 HD11 ILE A 83 -6.275 -1.681 -1.266 1.00 14.23 H new ATOM 0 HD12 ILE A 83 -5.556 -0.523 -0.121 1.00 14.23 H new ATOM 0 HD13 ILE A 83 -7.113 -0.155 -0.899 1.00 14.23 H new ATOM 1384 N LYS A 84 -3.936 4.467 -3.727 1.00 34.25 N ATOM 1385 CA LYS A 84 -3.370 5.824 -3.700 1.00 60.41 C ATOM 1386 C LYS A 84 -4.479 6.884 -3.796 1.00 14.34 C ATOM 1387 O LYS A 84 -5.413 6.752 -4.594 1.00 44.33 O ATOM 1388 CB LYS A 84 -2.405 5.965 -4.905 1.00 23.14 C ATOM 1389 CG LYS A 84 -1.710 7.345 -5.040 1.00 34.43 C ATOM 1390 CD LYS A 84 -1.041 7.544 -6.419 1.00 71.30 C ATOM 1391 CE LYS A 84 -2.071 7.543 -7.563 1.00 13.25 C ATOM 1392 NZ LYS A 84 -3.164 8.534 -7.327 1.00 42.30 N ATOM 0 H LYS A 84 -4.497 4.276 -4.557 1.00 34.25 H new ATOM 0 HA LYS A 84 -2.840 5.980 -2.760 1.00 60.41 H new ATOM 0 HB2 LYS A 84 -1.637 5.196 -4.826 1.00 23.14 H new ATOM 0 HB3 LYS A 84 -2.962 5.766 -5.821 1.00 23.14 H new ATOM 0 HG2 LYS A 84 -2.445 8.134 -4.880 1.00 34.43 H new ATOM 0 HG3 LYS A 84 -0.958 7.446 -4.258 1.00 34.43 H new ATOM 0 HD2 LYS A 84 -0.494 8.487 -6.424 1.00 71.30 H new ATOM 0 HD3 LYS A 84 -0.312 6.751 -6.586 1.00 71.30 H new ATOM 0 HE2 LYS A 84 -1.570 7.772 -8.503 1.00 13.25 H new ATOM 0 HE3 LYS A 84 -2.500 6.546 -7.665 1.00 13.25 H new ATOM 0 HZ1 LYS A 84 -3.358 9.053 -8.207 1.00 42.30 H new ATOM 0 HZ2 LYS A 84 -4.024 8.036 -7.022 1.00 42.30 H new ATOM 0 HZ3 LYS A 84 -2.871 9.204 -6.588 1.00 42.30 H new ATOM 1406 N VAL A 85 -4.348 7.935 -2.982 1.00 13.03 N ATOM 1407 CA VAL A 85 -5.185 9.137 -3.040 1.00 44.14 C ATOM 1408 C VAL A 85 -4.298 10.341 -3.420 1.00 4.12 C ATOM 1409 O VAL A 85 -3.388 10.729 -2.675 1.00 20.41 O ATOM 1410 CB VAL A 85 -5.950 9.374 -1.677 1.00 50.50 C ATOM 1411 CG1 VAL A 85 -5.023 9.263 -0.460 1.00 32.01 C ATOM 1412 CG2 VAL A 85 -6.726 10.715 -1.660 1.00 42.22 C ATOM 0 H VAL A 85 -3.641 7.975 -2.248 1.00 13.03 H new ATOM 0 HA VAL A 85 -5.954 9.009 -3.802 1.00 44.14 H new ATOM 0 HB VAL A 85 -6.683 8.571 -1.605 1.00 50.50 H new ATOM 0 HG11 VAL A 85 -5.597 9.434 0.451 1.00 32.01 H new ATOM 0 HG12 VAL A 85 -4.581 8.267 -0.429 1.00 32.01 H new ATOM 0 HG13 VAL A 85 -4.232 10.009 -0.536 1.00 32.01 H new ATOM 0 HG21 VAL A 85 -7.234 10.829 -0.702 1.00 42.22 H new ATOM 0 HG22 VAL A 85 -6.029 11.541 -1.802 1.00 42.22 H new ATOM 0 HG23 VAL A 85 -7.462 10.720 -2.464 1.00 42.22 H new ATOM 1422 N ALA A 86 -4.522 10.868 -4.630 1.00 62.34 N ATOM 1423 CA ALA A 86 -3.878 12.098 -5.103 1.00 24.40 C ATOM 1424 C ALA A 86 -4.713 13.309 -4.674 1.00 40.31 C ATOM 1425 O ALA A 86 -5.935 13.226 -4.556 1.00 51.21 O ATOM 1426 CB ALA A 86 -3.715 12.072 -6.632 1.00 30.44 C ATOM 0 H ALA A 86 -5.157 10.451 -5.310 1.00 62.34 H new ATOM 0 HA ALA A 86 -2.885 12.172 -4.660 1.00 24.40 H new ATOM 0 HB1 ALA A 86 -3.235 12.993 -6.962 1.00 30.44 H new ATOM 0 HB2 ALA A 86 -3.099 11.219 -6.918 1.00 30.44 H new ATOM 0 HB3 ALA A 86 -4.695 11.985 -7.101 1.00 30.44 H new ATOM 1432 N GLN A 87 -4.029 14.417 -4.425 1.00 31.03 N ATOM 1433 CA GLN A 87 -4.637 15.723 -4.109 1.00 44.44 C ATOM 1434 C GLN A 87 -4.308 16.714 -5.252 1.00 54.34 C ATOM 1435 O GLN A 87 -4.142 17.921 -5.024 1.00 32.21 O ATOM 1436 CB GLN A 87 -4.087 16.200 -2.739 1.00 73.31 C ATOM 1437 CG GLN A 87 -4.412 15.258 -1.561 1.00 53.15 C ATOM 1438 CD GLN A 87 -3.608 15.584 -0.306 1.00 61.52 C ATOM 1439 OE1 GLN A 87 -2.522 15.046 -0.101 1.00 21.52 O ATOM 1440 NE2 GLN A 87 -4.108 16.490 0.518 1.00 73.35 N ATOM 0 H GLN A 87 -3.009 14.444 -4.435 1.00 31.03 H new ATOM 0 HA GLN A 87 -5.722 15.654 -4.032 1.00 44.44 H new ATOM 0 HB2 GLN A 87 -3.005 16.310 -2.813 1.00 73.31 H new ATOM 0 HB3 GLN A 87 -4.493 17.188 -2.522 1.00 73.31 H new ATOM 0 HG2 GLN A 87 -5.476 15.322 -1.333 1.00 53.15 H new ATOM 0 HG3 GLN A 87 -4.212 14.229 -1.859 1.00 53.15 H new ATOM 0 HE21 GLN A 87 -5.012 16.917 0.318 1.00 73.35 H new ATOM 0 HE22 GLN A 87 -3.589 16.761 1.353 1.00 73.35 H new ATOM 1449 N ASP A 88 -4.259 16.150 -6.483 1.00 43.32 N ATOM 1450 CA ASP A 88 -3.893 16.834 -7.740 1.00 43.02 C ATOM 1451 C ASP A 88 -2.389 17.181 -7.758 1.00 65.43 C ATOM 1452 O ASP A 88 -1.978 18.291 -7.395 1.00 61.11 O ATOM 1453 CB ASP A 88 -4.799 18.074 -8.033 1.00 34.51 C ATOM 1454 CG ASP A 88 -4.518 18.734 -9.402 1.00 73.31 C ATOM 1455 OD1 ASP A 88 -4.938 18.172 -10.430 1.00 75.14 O ATOM 1456 OD2 ASP A 88 -3.874 19.807 -9.459 1.00 13.20 O ATOM 0 H ASP A 88 -4.483 15.166 -6.630 1.00 43.32 H new ATOM 0 HA ASP A 88 -4.078 16.138 -8.558 1.00 43.02 H new ATOM 0 HB2 ASP A 88 -5.844 17.767 -7.994 1.00 34.51 H new ATOM 0 HB3 ASP A 88 -4.654 18.814 -7.246 1.00 34.51 H new ATOM 1461 N GLN A 89 -1.564 16.169 -8.110 1.00 52.53 N ATOM 1462 CA GLN A 89 -0.113 16.329 -8.342 1.00 35.11 C ATOM 1463 C GLN A 89 0.250 15.594 -9.645 1.00 22.44 C ATOM 1464 O GLN A 89 0.108 14.372 -9.733 1.00 54.33 O ATOM 1465 CB GLN A 89 0.759 15.791 -7.156 1.00 31.24 C ATOM 1466 CG GLN A 89 0.477 16.410 -5.755 1.00 12.14 C ATOM 1467 CD GLN A 89 -0.603 15.675 -4.946 1.00 64.23 C ATOM 1468 OE1 GLN A 89 -1.460 14.988 -5.499 1.00 32.43 O ATOM 1469 NE2 GLN A 89 -0.602 15.859 -3.635 1.00 61.44 N ATOM 0 H GLN A 89 -1.890 15.212 -8.242 1.00 52.53 H new ATOM 0 HA GLN A 89 0.104 17.394 -8.419 1.00 35.11 H new ATOM 0 HB2 GLN A 89 0.616 14.713 -7.088 1.00 31.24 H new ATOM 0 HB3 GLN A 89 1.808 15.959 -7.399 1.00 31.24 H new ATOM 0 HG2 GLN A 89 1.403 16.417 -5.180 1.00 12.14 H new ATOM 0 HG3 GLN A 89 0.174 17.449 -5.884 1.00 12.14 H new ATOM 0 HE21 GLN A 89 0.121 16.434 -3.201 1.00 61.44 H new ATOM 0 HE22 GLN A 89 -1.324 15.426 -3.059 1.00 61.44 H new ATOM 1478 N GLU A 90 0.672 16.364 -10.658 1.00 3.10 N ATOM 1479 CA GLU A 90 1.095 15.844 -11.973 1.00 15.23 C ATOM 1480 C GLU A 90 2.427 15.068 -11.856 1.00 15.13 C ATOM 1481 O GLU A 90 2.668 14.110 -12.594 1.00 51.32 O ATOM 1482 CB GLU A 90 1.212 17.024 -12.980 1.00 24.50 C ATOM 1483 CG GLU A 90 1.401 16.604 -14.455 1.00 12.23 C ATOM 1484 CD GLU A 90 1.446 17.798 -15.424 1.00 51.42 C ATOM 1485 OE1 GLU A 90 0.375 18.356 -15.753 1.00 65.15 O ATOM 1486 OE2 GLU A 90 2.552 18.197 -15.851 1.00 32.11 O ATOM 0 H GLU A 90 0.731 17.380 -10.589 1.00 3.10 H new ATOM 0 HA GLU A 90 0.346 15.143 -12.341 1.00 15.23 H new ATOM 0 HB2 GLU A 90 0.314 17.638 -12.904 1.00 24.50 H new ATOM 0 HB3 GLU A 90 2.053 17.652 -12.686 1.00 24.50 H new ATOM 0 HG2 GLU A 90 2.325 16.034 -14.548 1.00 12.23 H new ATOM 0 HG3 GLU A 90 0.586 15.940 -14.744 1.00 12.23 H new ATOM 1493 N LEU A 91 3.283 15.494 -10.908 1.00 12.42 N ATOM 1494 CA LEU A 91 4.568 14.819 -10.599 1.00 63.33 C ATOM 1495 C LEU A 91 4.324 13.409 -9.997 1.00 11.43 C ATOM 1496 O LEU A 91 5.118 12.488 -10.205 1.00 2.43 O ATOM 1497 CB LEU A 91 5.401 15.699 -9.624 1.00 43.02 C ATOM 1498 CG LEU A 91 6.858 15.209 -9.317 1.00 34.01 C ATOM 1499 CD1 LEU A 91 7.724 15.164 -10.596 1.00 23.35 C ATOM 1500 CD2 LEU A 91 7.529 16.064 -8.212 1.00 1.31 C ATOM 0 H LEU A 91 3.107 16.317 -10.331 1.00 12.42 H new ATOM 0 HA LEU A 91 5.128 14.690 -11.525 1.00 63.33 H new ATOM 0 HB2 LEU A 91 5.459 16.706 -10.037 1.00 43.02 H new ATOM 0 HB3 LEU A 91 4.859 15.772 -8.681 1.00 43.02 H new ATOM 0 HG LEU A 91 6.780 14.190 -8.938 1.00 34.01 H new ATOM 0 HD11 LEU A 91 8.727 14.820 -10.344 1.00 23.35 H new ATOM 0 HD12 LEU A 91 7.275 14.479 -11.315 1.00 23.35 H new ATOM 0 HD13 LEU A 91 7.781 16.161 -11.032 1.00 23.35 H new ATOM 0 HD21 LEU A 91 8.537 15.694 -8.027 1.00 1.31 H new ATOM 0 HD22 LEU A 91 7.578 17.104 -8.536 1.00 1.31 H new ATOM 0 HD23 LEU A 91 6.944 15.997 -7.295 1.00 1.31 H new ATOM 1512 N LEU A 92 3.198 13.271 -9.267 1.00 75.43 N ATOM 1513 CA LEU A 92 2.729 11.983 -8.698 1.00 30.22 C ATOM 1514 C LEU A 92 2.389 10.969 -9.810 1.00 3.23 C ATOM 1515 O LEU A 92 2.518 9.757 -9.608 1.00 0.34 O ATOM 1516 CB LEU A 92 1.516 12.259 -7.738 1.00 71.00 C ATOM 1517 CG LEU A 92 0.517 11.081 -7.380 1.00 62.21 C ATOM 1518 CD1 LEU A 92 -0.124 11.290 -5.989 1.00 74.02 C ATOM 1519 CD2 LEU A 92 -0.609 10.927 -8.452 1.00 12.34 C ATOM 0 H LEU A 92 2.581 14.054 -9.052 1.00 75.43 H new ATOM 0 HA LEU A 92 3.529 11.526 -8.115 1.00 30.22 H new ATOM 0 HB2 LEU A 92 1.922 12.639 -6.800 1.00 71.00 H new ATOM 0 HB3 LEU A 92 0.927 13.063 -8.179 1.00 71.00 H new ATOM 0 HG LEU A 92 1.110 10.166 -7.366 1.00 62.21 H new ATOM 0 HD11 LEU A 92 -0.803 10.465 -5.774 1.00 74.02 H new ATOM 0 HD12 LEU A 92 0.657 11.324 -5.230 1.00 74.02 H new ATOM 0 HD13 LEU A 92 -0.679 12.228 -5.981 1.00 74.02 H new ATOM 0 HD21 LEU A 92 -1.272 10.109 -8.169 1.00 12.34 H new ATOM 0 HD22 LEU A 92 -1.181 11.853 -8.514 1.00 12.34 H new ATOM 0 HD23 LEU A 92 -0.161 10.712 -9.422 1.00 12.34 H new ATOM 1531 N GLU A 93 1.945 11.482 -10.981 1.00 42.34 N ATOM 1532 CA GLU A 93 1.595 10.645 -12.150 1.00 3.30 C ATOM 1533 C GLU A 93 2.814 9.882 -12.696 1.00 12.42 C ATOM 1534 O GLU A 93 2.644 8.864 -13.358 1.00 53.31 O ATOM 1535 CB GLU A 93 0.943 11.490 -13.267 1.00 34.13 C ATOM 1536 CG GLU A 93 -0.382 12.170 -12.871 1.00 32.55 C ATOM 1537 CD GLU A 93 -1.062 12.836 -14.073 1.00 32.33 C ATOM 1538 OE1 GLU A 93 -1.714 12.120 -14.869 1.00 32.04 O ATOM 1539 OE2 GLU A 93 -0.945 14.067 -14.246 1.00 21.10 O ATOM 0 H GLU A 93 1.820 12.482 -11.141 1.00 42.34 H new ATOM 0 HA GLU A 93 0.869 9.908 -11.806 1.00 3.30 H new ATOM 0 HB2 GLU A 93 1.650 12.258 -13.582 1.00 34.13 H new ATOM 0 HB3 GLU A 93 0.763 10.849 -14.130 1.00 34.13 H new ATOM 0 HG2 GLU A 93 -1.055 11.430 -12.437 1.00 32.55 H new ATOM 0 HG3 GLU A 93 -0.191 12.918 -12.101 1.00 32.55 H new ATOM 1546 N ARG A 94 4.036 10.397 -12.430 1.00 42.45 N ATOM 1547 CA ARG A 94 5.294 9.696 -12.761 1.00 43.25 C ATOM 1548 C ARG A 94 5.413 8.399 -11.938 1.00 52.33 C ATOM 1549 O ARG A 94 5.750 7.342 -12.485 1.00 31.43 O ATOM 1550 CB ARG A 94 6.515 10.610 -12.498 1.00 53.43 C ATOM 1551 CG ARG A 94 7.887 9.967 -12.826 1.00 1.12 C ATOM 1552 CD ARG A 94 9.066 10.895 -12.503 1.00 53.44 C ATOM 1553 NE ARG A 94 8.988 12.174 -13.235 1.00 33.30 N ATOM 1554 CZ ARG A 94 9.810 13.221 -13.057 1.00 21.31 C ATOM 1555 NH1 ARG A 94 10.802 13.172 -12.164 1.00 0.13 N ATOM 1556 NH2 ARG A 94 9.624 14.324 -13.771 1.00 31.23 N ATOM 0 H ARG A 94 4.176 11.303 -11.983 1.00 42.45 H new ATOM 0 HA ARG A 94 5.277 9.441 -13.821 1.00 43.25 H new ATOM 0 HB2 ARG A 94 6.405 11.520 -13.088 1.00 53.43 H new ATOM 0 HB3 ARG A 94 6.510 10.908 -11.449 1.00 53.43 H new ATOM 0 HG2 ARG A 94 7.994 9.040 -12.262 1.00 1.12 H new ATOM 0 HG3 ARG A 94 7.917 9.702 -13.883 1.00 1.12 H new ATOM 0 HD2 ARG A 94 9.087 11.093 -11.431 1.00 53.44 H new ATOM 0 HD3 ARG A 94 10.000 10.392 -12.753 1.00 53.44 H new ATOM 0 HE ARG A 94 8.250 12.271 -13.933 1.00 33.30 H new ATOM 0 HH11 ARG A 94 10.944 12.331 -11.605 1.00 0.13 H new ATOM 0 HH12 ARG A 94 11.418 13.976 -12.041 1.00 0.13 H new ATOM 0 HH21 ARG A 94 8.862 14.371 -14.448 1.00 31.23 H new ATOM 0 HH22 ARG A 94 10.243 15.125 -13.643 1.00 31.23 H new ATOM 1570 N PHE A 95 5.121 8.503 -10.621 1.00 42.44 N ATOM 1571 CA PHE A 95 5.110 7.346 -9.704 1.00 71.23 C ATOM 1572 C PHE A 95 4.045 6.328 -10.147 1.00 45.14 C ATOM 1573 O PHE A 95 4.334 5.136 -10.259 1.00 74.11 O ATOM 1574 CB PHE A 95 4.858 7.798 -8.235 1.00 71.32 C ATOM 1575 CG PHE A 95 4.632 6.632 -7.264 1.00 71.43 C ATOM 1576 CD1 PHE A 95 5.684 5.788 -6.908 1.00 12.41 C ATOM 1577 CD2 PHE A 95 3.355 6.352 -6.752 1.00 10.40 C ATOM 1578 CE1 PHE A 95 5.469 4.718 -6.066 1.00 31.31 C ATOM 1579 CE2 PHE A 95 3.148 5.278 -5.912 1.00 2.33 C ATOM 1580 CZ PHE A 95 4.202 4.462 -5.571 1.00 14.23 C ATOM 0 H PHE A 95 4.888 9.387 -10.169 1.00 42.44 H new ATOM 0 HA PHE A 95 6.089 6.869 -9.743 1.00 71.23 H new ATOM 0 HB2 PHE A 95 5.711 8.385 -7.893 1.00 71.32 H new ATOM 0 HB3 PHE A 95 3.988 8.455 -8.210 1.00 71.32 H new ATOM 0 HD1 PHE A 95 6.675 5.974 -7.295 1.00 12.41 H new ATOM 0 HD2 PHE A 95 2.523 6.987 -7.020 1.00 10.40 H new ATOM 0 HE1 PHE A 95 6.293 4.076 -5.791 1.00 31.31 H new ATOM 0 HE2 PHE A 95 2.161 5.078 -5.523 1.00 2.33 H new ATOM 0 HZ PHE A 95 4.040 3.619 -4.915 1.00 14.23 H new ATOM 1590 N TYR A 96 2.824 6.837 -10.418 1.00 0.15 N ATOM 1591 CA TYR A 96 1.689 6.034 -10.912 1.00 54.10 C ATOM 1592 C TYR A 96 2.107 5.216 -12.160 1.00 31.32 C ATOM 1593 O TYR A 96 2.012 3.982 -12.180 1.00 35.12 O ATOM 1594 CB TYR A 96 0.496 6.991 -11.243 1.00 10.32 C ATOM 1595 CG TYR A 96 -0.638 6.334 -12.050 1.00 40.23 C ATOM 1596 CD1 TYR A 96 -1.470 5.391 -11.462 1.00 0.53 C ATOM 1597 CD2 TYR A 96 -0.842 6.624 -13.405 1.00 21.23 C ATOM 1598 CE1 TYR A 96 -2.455 4.755 -12.178 1.00 75.13 C ATOM 1599 CE2 TYR A 96 -1.841 5.995 -14.124 1.00 71.45 C ATOM 1600 CZ TYR A 96 -2.639 5.060 -13.505 1.00 21.42 C ATOM 1601 OH TYR A 96 -3.616 4.407 -14.226 1.00 22.22 O ATOM 0 H TYR A 96 2.598 7.825 -10.299 1.00 0.15 H new ATOM 0 HA TYR A 96 1.377 5.327 -10.144 1.00 54.10 H new ATOM 0 HB2 TYR A 96 0.086 7.377 -10.310 1.00 10.32 H new ATOM 0 HB3 TYR A 96 0.876 7.846 -11.802 1.00 10.32 H new ATOM 0 HD1 TYR A 96 -1.340 5.152 -10.417 1.00 0.53 H new ATOM 0 HD2 TYR A 96 -0.210 7.350 -13.895 1.00 21.23 H new ATOM 0 HE1 TYR A 96 -3.083 4.018 -11.699 1.00 75.13 H new ATOM 0 HE2 TYR A 96 -1.994 6.236 -15.166 1.00 71.45 H new ATOM 0 HH TYR A 96 -3.618 4.738 -15.148 1.00 22.22 H new ATOM 1611 N GLU A 97 2.660 5.943 -13.139 1.00 24.32 N ATOM 1612 CA GLU A 97 3.043 5.420 -14.459 1.00 34.33 C ATOM 1613 C GLU A 97 4.206 4.410 -14.352 1.00 40.20 C ATOM 1614 O GLU A 97 4.307 3.494 -15.175 1.00 52.45 O ATOM 1615 CB GLU A 97 3.434 6.622 -15.355 1.00 51.41 C ATOM 1616 CG GLU A 97 3.906 6.268 -16.773 1.00 14.11 C ATOM 1617 CD GLU A 97 4.499 7.469 -17.512 1.00 44.34 C ATOM 1618 OE1 GLU A 97 5.584 7.933 -17.098 1.00 64.52 O ATOM 1619 OE2 GLU A 97 3.898 7.957 -18.495 1.00 25.41 O ATOM 0 H GLU A 97 2.859 6.938 -13.033 1.00 24.32 H new ATOM 0 HA GLU A 97 2.203 4.882 -14.897 1.00 34.33 H new ATOM 0 HB2 GLU A 97 2.575 7.288 -15.433 1.00 51.41 H new ATOM 0 HB3 GLU A 97 4.226 7.181 -14.857 1.00 51.41 H new ATOM 0 HG2 GLU A 97 4.653 5.476 -16.716 1.00 14.11 H new ATOM 0 HG3 GLU A 97 3.065 5.873 -17.344 1.00 14.11 H new ATOM 1626 N GLN A 98 5.059 4.582 -13.320 1.00 73.41 N ATOM 1627 CA GLN A 98 6.237 3.725 -13.081 1.00 4.23 C ATOM 1628 C GLN A 98 5.814 2.270 -12.784 1.00 12.21 C ATOM 1629 O GLN A 98 6.401 1.323 -13.314 1.00 44.33 O ATOM 1630 CB GLN A 98 7.094 4.296 -11.914 1.00 21.11 C ATOM 1631 CG GLN A 98 8.388 3.505 -11.601 1.00 13.04 C ATOM 1632 CD GLN A 98 9.397 3.483 -12.761 1.00 14.20 C ATOM 1633 OE1 GLN A 98 10.277 4.339 -12.857 1.00 61.14 O ATOM 1634 NE2 GLN A 98 9.278 2.507 -13.648 1.00 0.21 N ATOM 0 H GLN A 98 4.948 5.322 -12.627 1.00 73.41 H new ATOM 0 HA GLN A 98 6.843 3.719 -13.987 1.00 4.23 H new ATOM 0 HB2 GLN A 98 7.364 5.325 -12.152 1.00 21.11 H new ATOM 0 HB3 GLN A 98 6.479 4.328 -11.014 1.00 21.11 H new ATOM 0 HG2 GLN A 98 8.866 3.941 -10.724 1.00 13.04 H new ATOM 0 HG3 GLN A 98 8.123 2.480 -11.343 1.00 13.04 H new ATOM 0 HE21 GLN A 98 8.540 1.811 -13.544 1.00 0.21 H new ATOM 0 HE22 GLN A 98 9.925 2.451 -14.435 1.00 0.21 H new ATOM 1643 N LEU A 99 4.779 2.116 -11.943 1.00 64.12 N ATOM 1644 CA LEU A 99 4.221 0.793 -11.592 1.00 54.55 C ATOM 1645 C LEU A 99 3.377 0.237 -12.751 1.00 3.33 C ATOM 1646 O LEU A 99 3.273 -0.972 -12.923 1.00 74.24 O ATOM 1647 CB LEU A 99 3.388 0.846 -10.274 1.00 63.40 C ATOM 1648 CG LEU A 99 4.197 1.048 -8.938 1.00 71.24 C ATOM 1649 CD1 LEU A 99 4.856 2.433 -8.869 1.00 74.21 C ATOM 1650 CD2 LEU A 99 3.306 0.806 -7.702 1.00 52.31 C ATOM 0 H LEU A 99 4.306 2.897 -11.488 1.00 64.12 H new ATOM 0 HA LEU A 99 5.059 0.118 -11.418 1.00 54.55 H new ATOM 0 HB2 LEU A 99 2.664 1.657 -10.360 1.00 63.40 H new ATOM 0 HB3 LEU A 99 2.820 -0.081 -10.192 1.00 63.40 H new ATOM 0 HG LEU A 99 4.994 0.305 -8.935 1.00 71.24 H new ATOM 0 HD11 LEU A 99 5.403 2.529 -7.931 1.00 74.21 H new ATOM 0 HD12 LEU A 99 5.545 2.550 -9.705 1.00 74.21 H new ATOM 0 HD13 LEU A 99 4.088 3.204 -8.921 1.00 74.21 H new ATOM 0 HD21 LEU A 99 3.893 0.953 -6.796 1.00 52.31 H new ATOM 0 HD22 LEU A 99 2.472 1.508 -7.712 1.00 52.31 H new ATOM 0 HD23 LEU A 99 2.922 -0.214 -7.724 1.00 52.31 H new ATOM 1662 N LYS A 100 2.773 1.145 -13.534 1.00 35.43 N ATOM 1663 CA LYS A 100 1.892 0.783 -14.658 1.00 75.35 C ATOM 1664 C LYS A 100 2.673 0.259 -15.881 1.00 12.11 C ATOM 1665 O LYS A 100 2.158 -0.575 -16.635 1.00 31.35 O ATOM 1666 CB LYS A 100 1.010 1.999 -15.034 1.00 4.14 C ATOM 1667 CG LYS A 100 -0.022 2.429 -13.950 1.00 43.02 C ATOM 1668 CD LYS A 100 -1.348 1.614 -13.959 1.00 0.42 C ATOM 1669 CE LYS A 100 -1.241 0.180 -13.421 1.00 12.10 C ATOM 1670 NZ LYS A 100 -2.501 -0.591 -13.624 1.00 44.32 N ATOM 0 H LYS A 100 2.881 2.151 -13.406 1.00 35.43 H new ATOM 0 HA LYS A 100 1.255 -0.040 -14.333 1.00 75.35 H new ATOM 0 HB2 LYS A 100 1.660 2.847 -15.250 1.00 4.14 H new ATOM 0 HB3 LYS A 100 0.472 1.767 -15.953 1.00 4.14 H new ATOM 0 HG2 LYS A 100 0.441 2.334 -12.968 1.00 43.02 H new ATOM 0 HG3 LYS A 100 -0.258 3.484 -14.090 1.00 43.02 H new ATOM 0 HD2 LYS A 100 -2.090 2.152 -13.368 1.00 0.42 H new ATOM 0 HD3 LYS A 100 -1.723 1.574 -14.982 1.00 0.42 H new ATOM 0 HE2 LYS A 100 -0.418 -0.333 -13.919 1.00 12.10 H new ATOM 0 HE3 LYS A 100 -1.002 0.209 -12.358 1.00 12.10 H new ATOM 0 HZ1 LYS A 100 -2.270 -1.574 -13.874 1.00 44.32 H new ATOM 0 HZ2 LYS A 100 -3.060 -0.579 -12.747 1.00 44.32 H new ATOM 0 HZ3 LYS A 100 -3.053 -0.159 -14.392 1.00 44.32 H new ATOM 1684 N LYS A 101 3.908 0.754 -16.077 1.00 14.30 N ATOM 1685 CA LYS A 101 4.807 0.245 -17.138 1.00 74.21 C ATOM 1686 C LYS A 101 5.521 -1.031 -16.665 1.00 23.12 C ATOM 1687 O LYS A 101 6.019 -1.806 -17.483 1.00 43.35 O ATOM 1688 CB LYS A 101 5.837 1.325 -17.570 1.00 33.34 C ATOM 1689 CG LYS A 101 6.847 1.763 -16.483 1.00 31.12 C ATOM 1690 CD LYS A 101 7.815 2.892 -16.932 1.00 73.44 C ATOM 1691 CE LYS A 101 7.137 4.268 -17.126 1.00 31.31 C ATOM 1692 NZ LYS A 101 6.212 4.330 -18.296 1.00 54.11 N ATOM 0 H LYS A 101 4.310 1.506 -15.517 1.00 14.30 H new ATOM 0 HA LYS A 101 4.199 0.001 -18.009 1.00 74.21 H new ATOM 0 HB2 LYS A 101 6.395 0.946 -18.427 1.00 33.34 H new ATOM 0 HB3 LYS A 101 5.292 2.206 -17.909 1.00 33.34 H new ATOM 0 HG2 LYS A 101 6.296 2.100 -15.605 1.00 31.12 H new ATOM 0 HG3 LYS A 101 7.434 0.897 -16.178 1.00 31.12 H new ATOM 0 HD2 LYS A 101 8.608 2.991 -16.191 1.00 73.44 H new ATOM 0 HD3 LYS A 101 8.289 2.598 -17.868 1.00 73.44 H new ATOM 0 HE2 LYS A 101 6.581 4.518 -16.223 1.00 31.31 H new ATOM 0 HE3 LYS A 101 7.909 5.028 -17.246 1.00 31.31 H new ATOM 0 HZ1 LYS A 101 6.234 5.286 -18.706 1.00 54.11 H new ATOM 0 HZ2 LYS A 101 6.512 3.639 -19.013 1.00 54.11 H new ATOM 0 HZ3 LYS A 101 5.244 4.109 -17.986 1.00 54.11 H new ATOM 1706 N ASP A 102 5.576 -1.202 -15.334 1.00 32.41 N ATOM 1707 CA ASP A 102 6.139 -2.389 -14.681 1.00 3.05 C ATOM 1708 C ASP A 102 5.187 -3.598 -14.838 1.00 31.04 C ATOM 1709 O ASP A 102 5.533 -4.598 -15.477 1.00 32.24 O ATOM 1710 CB ASP A 102 6.400 -2.065 -13.183 1.00 64.20 C ATOM 1711 CG ASP A 102 6.771 -3.294 -12.340 1.00 55.33 C ATOM 1712 OD1 ASP A 102 7.924 -3.776 -12.442 1.00 21.52 O ATOM 1713 OD2 ASP A 102 5.904 -3.795 -11.582 1.00 51.23 O ATOM 0 H ASP A 102 5.225 -0.508 -14.674 1.00 32.41 H new ATOM 0 HA ASP A 102 7.083 -2.657 -15.155 1.00 3.05 H new ATOM 0 HB2 ASP A 102 7.204 -1.332 -13.114 1.00 64.20 H new ATOM 0 HB3 ASP A 102 5.509 -1.601 -12.760 1.00 64.20 H new ATOM 1718 N GLY A 103 3.985 -3.469 -14.252 1.00 42.42 N ATOM 1719 CA GLY A 103 2.992 -4.545 -14.218 1.00 64.34 C ATOM 1720 C GLY A 103 2.058 -4.414 -13.021 1.00 72.01 C ATOM 1721 O GLY A 103 0.895 -4.820 -13.093 1.00 70.12 O ATOM 0 H GLY A 103 3.678 -2.613 -13.789 1.00 42.42 H new ATOM 0 HA2 GLY A 103 2.408 -4.530 -15.138 1.00 64.34 H new ATOM 0 HA3 GLY A 103 3.501 -5.508 -14.179 1.00 64.34 H new ATOM 1725 N VAL A 104 2.581 -3.848 -11.913 1.00 40.51 N ATOM 1726 CA VAL A 104 1.821 -3.638 -10.659 1.00 20.32 C ATOM 1727 C VAL A 104 0.714 -2.575 -10.834 1.00 12.14 C ATOM 1728 O VAL A 104 0.914 -1.554 -11.497 1.00 75.24 O ATOM 1729 CB VAL A 104 2.805 -3.253 -9.488 1.00 55.23 C ATOM 1730 CG1 VAL A 104 2.067 -2.718 -8.235 1.00 73.22 C ATOM 1731 CG2 VAL A 104 3.694 -4.469 -9.130 1.00 61.34 C ATOM 0 H VAL A 104 3.546 -3.522 -11.861 1.00 40.51 H new ATOM 0 HA VAL A 104 1.324 -4.573 -10.402 1.00 20.32 H new ATOM 0 HB VAL A 104 3.433 -2.436 -9.843 1.00 55.23 H new ATOM 0 HG11 VAL A 104 2.795 -2.469 -7.463 1.00 73.22 H new ATOM 0 HG12 VAL A 104 1.500 -1.826 -8.500 1.00 73.22 H new ATOM 0 HG13 VAL A 104 1.386 -3.482 -7.860 1.00 73.22 H new ATOM 0 HG21 VAL A 104 4.372 -4.198 -8.321 1.00 61.34 H new ATOM 0 HG22 VAL A 104 3.064 -5.300 -8.813 1.00 61.34 H new ATOM 0 HG23 VAL A 104 4.273 -4.766 -10.004 1.00 61.34 H new ATOM 1741 N ASP A 105 -0.461 -2.835 -10.229 1.00 63.04 N ATOM 1742 CA ASP A 105 -1.649 -1.982 -10.389 1.00 14.40 C ATOM 1743 C ASP A 105 -1.693 -0.891 -9.302 1.00 41.22 C ATOM 1744 O ASP A 105 -1.282 -1.124 -8.157 1.00 50.14 O ATOM 1745 CB ASP A 105 -2.939 -2.836 -10.337 1.00 15.34 C ATOM 1746 CG ASP A 105 -4.157 -2.090 -10.924 1.00 73.44 C ATOM 1747 OD1 ASP A 105 -4.379 -2.168 -12.151 1.00 54.35 O ATOM 1748 OD2 ASP A 105 -4.871 -1.387 -10.176 1.00 65.42 O ATOM 0 H ASP A 105 -0.611 -3.639 -9.619 1.00 63.04 H new ATOM 0 HA ASP A 105 -1.586 -1.496 -11.363 1.00 14.40 H new ATOM 0 HB2 ASP A 105 -2.782 -3.762 -10.889 1.00 15.34 H new ATOM 0 HB3 ASP A 105 -3.148 -3.113 -9.304 1.00 15.34 H new ATOM 1753 N VAL A 106 -2.215 0.292 -9.676 1.00 70.50 N ATOM 1754 CA VAL A 106 -2.405 1.432 -8.765 1.00 1.12 C ATOM 1755 C VAL A 106 -3.892 1.825 -8.777 1.00 33.13 C ATOM 1756 O VAL A 106 -4.400 2.258 -9.817 1.00 54.22 O ATOM 1757 CB VAL A 106 -1.558 2.690 -9.208 1.00 10.33 C ATOM 1758 CG1 VAL A 106 -1.585 3.801 -8.129 1.00 32.24 C ATOM 1759 CG2 VAL A 106 -0.111 2.316 -9.609 1.00 73.05 C ATOM 0 H VAL A 106 -2.520 0.483 -10.630 1.00 70.50 H new ATOM 0 HA VAL A 106 -2.075 1.129 -7.772 1.00 1.12 H new ATOM 0 HB VAL A 106 -2.034 3.090 -10.103 1.00 10.33 H new ATOM 0 HG11 VAL A 106 -0.992 4.651 -8.467 1.00 32.24 H new ATOM 0 HG12 VAL A 106 -2.614 4.120 -7.961 1.00 32.24 H new ATOM 0 HG13 VAL A 106 -1.168 3.415 -7.199 1.00 32.24 H new ATOM 0 HG21 VAL A 106 0.429 3.216 -9.905 1.00 73.05 H new ATOM 0 HG22 VAL A 106 0.393 1.853 -8.761 1.00 73.05 H new ATOM 0 HG23 VAL A 106 -0.134 1.616 -10.444 1.00 73.05 H new ATOM 1769 N ARG A 107 -4.572 1.711 -7.631 1.00 14.31 N ATOM 1770 CA ARG A 107 -5.978 2.116 -7.513 1.00 43.23 C ATOM 1771 C ARG A 107 -6.024 3.612 -7.185 1.00 42.23 C ATOM 1772 O ARG A 107 -5.673 4.020 -6.074 1.00 13.43 O ATOM 1773 CB ARG A 107 -6.685 1.311 -6.398 1.00 65.25 C ATOM 1774 CG ARG A 107 -6.635 -0.214 -6.570 1.00 25.31 C ATOM 1775 CD ARG A 107 -7.344 -0.739 -7.837 1.00 44.21 C ATOM 1776 NE ARG A 107 -7.549 -2.200 -7.758 1.00 42.15 N ATOM 1777 CZ ARG A 107 -7.599 -3.054 -8.789 1.00 63.14 C ATOM 1778 NH1 ARG A 107 -7.469 -2.643 -10.048 1.00 53.11 N ATOM 1779 NH2 ARG A 107 -7.788 -4.338 -8.544 1.00 50.04 N ATOM 0 H ARG A 107 -4.171 1.341 -6.770 1.00 14.31 H new ATOM 0 HA ARG A 107 -6.495 1.918 -8.452 1.00 43.23 H new ATOM 0 HB2 ARG A 107 -6.232 1.569 -5.441 1.00 65.25 H new ATOM 0 HB3 ARG A 107 -7.728 1.623 -6.351 1.00 65.25 H new ATOM 0 HG2 ARG A 107 -5.592 -0.530 -6.595 1.00 25.31 H new ATOM 0 HG3 ARG A 107 -7.088 -0.681 -5.696 1.00 25.31 H new ATOM 0 HD2 ARG A 107 -8.305 -0.239 -7.955 1.00 44.21 H new ATOM 0 HD3 ARG A 107 -6.749 -0.498 -8.718 1.00 44.21 H new ATOM 0 HE ARG A 107 -7.664 -2.598 -6.826 1.00 42.15 H new ATOM 0 HH11 ARG A 107 -7.327 -1.653 -10.249 1.00 53.11 H new ATOM 0 HH12 ARG A 107 -7.512 -3.318 -10.812 1.00 53.11 H new ATOM 0 HH21 ARG A 107 -7.893 -4.664 -7.583 1.00 50.04 H new ATOM 0 HH22 ARG A 107 -7.829 -5.004 -9.316 1.00 50.04 H new ATOM 1793 N VAL A 108 -6.437 4.424 -8.167 1.00 74.14 N ATOM 1794 CA VAL A 108 -6.583 5.872 -7.983 1.00 41.23 C ATOM 1795 C VAL A 108 -7.980 6.175 -7.396 1.00 74.34 C ATOM 1796 O VAL A 108 -9.019 5.822 -7.973 1.00 74.43 O ATOM 1797 CB VAL A 108 -6.303 6.679 -9.320 1.00 64.04 C ATOM 1798 CG1 VAL A 108 -4.858 6.425 -9.815 1.00 52.12 C ATOM 1799 CG2 VAL A 108 -7.328 6.362 -10.439 1.00 10.40 C ATOM 0 H VAL A 108 -6.677 4.098 -9.103 1.00 74.14 H new ATOM 0 HA VAL A 108 -5.827 6.212 -7.275 1.00 41.23 H new ATOM 0 HB VAL A 108 -6.418 7.736 -9.080 1.00 64.04 H new ATOM 0 HG11 VAL A 108 -4.684 6.986 -10.733 1.00 52.12 H new ATOM 0 HG12 VAL A 108 -4.150 6.748 -9.052 1.00 52.12 H new ATOM 0 HG13 VAL A 108 -4.722 5.361 -10.009 1.00 52.12 H new ATOM 0 HG21 VAL A 108 -7.086 6.943 -11.329 1.00 10.40 H new ATOM 0 HG22 VAL A 108 -7.289 5.299 -10.678 1.00 10.40 H new ATOM 0 HG23 VAL A 108 -8.330 6.621 -10.098 1.00 10.40 H new ATOM 1809 N THR A 109 -7.982 6.737 -6.189 1.00 5.40 N ATOM 1810 CA THR A 109 -9.196 7.150 -5.480 1.00 32.32 C ATOM 1811 C THR A 109 -9.279 8.671 -5.552 1.00 61.03 C ATOM 1812 O THR A 109 -10.301 9.240 -5.946 1.00 53.24 O ATOM 1813 CB THR A 109 -9.158 6.663 -3.995 1.00 33.24 C ATOM 1814 OG1 THR A 109 -8.033 7.239 -3.310 1.00 53.44 O ATOM 1815 CG2 THR A 109 -9.057 5.133 -3.899 1.00 2.34 C ATOM 0 H THR A 109 -7.126 6.922 -5.665 1.00 5.40 H new ATOM 0 HA THR A 109 -10.077 6.704 -5.942 1.00 32.32 H new ATOM 0 HB THR A 109 -10.090 6.984 -3.530 1.00 33.24 H new ATOM 0 HG1 THR A 109 -7.202 6.913 -3.714 1.00 53.44 H new ATOM 0 HG21 THR A 109 -9.033 4.835 -2.851 1.00 2.34 H new ATOM 0 HG22 THR A 109 -9.921 4.680 -4.385 1.00 2.34 H new ATOM 0 HG23 THR A 109 -8.145 4.797 -4.393 1.00 2.34 H new ATOM 1823 N ASP A 110 -8.153 9.302 -5.149 1.00 32.34 N ATOM 1824 CA ASP A 110 -7.872 10.744 -5.312 1.00 22.33 C ATOM 1825 C ASP A 110 -8.884 11.644 -4.570 1.00 41.12 C ATOM 1826 O ASP A 110 -8.946 12.855 -4.785 1.00 30.34 O ATOM 1827 CB ASP A 110 -7.738 11.106 -6.820 1.00 34.40 C ATOM 1828 CG ASP A 110 -6.753 10.202 -7.613 1.00 53.11 C ATOM 1829 OD1 ASP A 110 -5.902 9.489 -7.003 1.00 54.32 O ATOM 1830 OD2 ASP A 110 -6.813 10.211 -8.859 1.00 61.34 O ATOM 0 H ASP A 110 -7.392 8.805 -4.687 1.00 32.34 H new ATOM 0 HA ASP A 110 -6.913 10.946 -4.835 1.00 22.33 H new ATOM 0 HB2 ASP A 110 -8.722 11.045 -7.285 1.00 34.40 H new ATOM 0 HB3 ASP A 110 -7.409 12.142 -6.905 1.00 34.40 H new ATOM 1835 N ASN A 111 -9.620 11.019 -3.650 1.00 72.14 N ATOM 1836 CA ASN A 111 -10.596 11.660 -2.758 1.00 73.14 C ATOM 1837 C ASN A 111 -10.390 11.048 -1.373 1.00 45.33 C ATOM 1838 O ASN A 111 -10.226 9.828 -1.265 1.00 51.01 O ATOM 1839 CB ASN A 111 -12.051 11.412 -3.241 1.00 23.22 C ATOM 1840 CG ASN A 111 -12.386 12.122 -4.556 1.00 34.25 C ATOM 1841 OD1 ASN A 111 -12.184 11.581 -5.642 1.00 65.32 O ATOM 1842 ND2 ASN A 111 -12.903 13.341 -4.467 1.00 64.21 N ATOM 0 H ASN A 111 -9.552 10.013 -3.497 1.00 72.14 H new ATOM 0 HA ASN A 111 -10.447 12.740 -2.745 1.00 73.14 H new ATOM 0 HB2 ASN A 111 -12.207 10.340 -3.366 1.00 23.22 H new ATOM 0 HB3 ASN A 111 -12.744 11.747 -2.469 1.00 23.22 H new ATOM 0 HD21 ASN A 111 -13.144 13.856 -5.314 1.00 64.21 H new ATOM 0 HD22 ASN A 111 -13.059 13.763 -3.552 1.00 64.21 H new ATOM 1849 N GLU A 112 -10.406 11.900 -0.336 1.00 55.31 N ATOM 1850 CA GLU A 112 -10.097 11.510 1.069 1.00 25.23 C ATOM 1851 C GLU A 112 -11.037 10.389 1.566 1.00 55.42 C ATOM 1852 O GLU A 112 -10.606 9.407 2.192 1.00 73.24 O ATOM 1853 CB GLU A 112 -10.258 12.744 1.996 1.00 53.11 C ATOM 1854 CG GLU A 112 -9.579 14.032 1.486 1.00 70.01 C ATOM 1855 CD GLU A 112 -9.968 15.260 2.320 1.00 34.01 C ATOM 1856 OE1 GLU A 112 -11.115 15.728 2.178 1.00 21.34 O ATOM 1857 OE2 GLU A 112 -9.154 15.747 3.136 1.00 24.32 O ATOM 0 H GLU A 112 -10.634 12.889 -0.439 1.00 55.31 H new ATOM 0 HA GLU A 112 -9.072 11.141 1.095 1.00 25.23 H new ATOM 0 HB2 GLU A 112 -11.321 12.941 2.133 1.00 53.11 H new ATOM 0 HB3 GLU A 112 -9.850 12.499 2.977 1.00 53.11 H new ATOM 0 HG2 GLU A 112 -8.497 13.905 1.512 1.00 70.01 H new ATOM 0 HG3 GLU A 112 -9.856 14.199 0.445 1.00 70.01 H new ATOM 1864 N ASP A 113 -12.329 10.581 1.255 1.00 71.21 N ATOM 1865 CA ASP A 113 -13.427 9.696 1.656 1.00 30.04 C ATOM 1866 C ASP A 113 -13.391 8.383 0.849 1.00 45.24 C ATOM 1867 O ASP A 113 -13.491 7.303 1.427 1.00 3.33 O ATOM 1868 CB ASP A 113 -14.776 10.444 1.469 1.00 61.11 C ATOM 1869 CG ASP A 113 -16.002 9.640 1.935 1.00 75.51 C ATOM 1870 OD1 ASP A 113 -16.160 9.435 3.155 1.00 21.43 O ATOM 1871 OD2 ASP A 113 -16.825 9.228 1.082 1.00 44.22 O ATOM 0 H ASP A 113 -12.644 11.379 0.703 1.00 71.21 H new ATOM 0 HA ASP A 113 -13.317 9.429 2.707 1.00 30.04 H new ATOM 0 HB2 ASP A 113 -14.739 11.384 2.020 1.00 61.11 H new ATOM 0 HB3 ASP A 113 -14.898 10.696 0.416 1.00 61.11 H new ATOM 1876 N GLU A 114 -13.204 8.498 -0.487 1.00 3.40 N ATOM 1877 CA GLU A 114 -13.167 7.333 -1.406 1.00 3.15 C ATOM 1878 C GLU A 114 -11.927 6.444 -1.152 1.00 62.02 C ATOM 1879 O GLU A 114 -11.966 5.238 -1.403 1.00 14.11 O ATOM 1880 CB GLU A 114 -13.221 7.796 -2.894 1.00 23.22 C ATOM 1881 CG GLU A 114 -13.260 6.658 -3.953 1.00 30.22 C ATOM 1882 CD GLU A 114 -14.519 5.761 -3.869 1.00 1.55 C ATOM 1883 OE1 GLU A 114 -14.546 4.817 -3.058 1.00 52.04 O ATOM 1884 OE2 GLU A 114 -15.492 5.999 -4.613 1.00 72.30 O ATOM 0 H GLU A 114 -13.075 9.394 -0.957 1.00 3.40 H new ATOM 0 HA GLU A 114 -14.051 6.729 -1.202 1.00 3.15 H new ATOM 0 HB2 GLU A 114 -14.102 8.423 -3.029 1.00 23.22 H new ATOM 0 HB3 GLU A 114 -12.351 8.422 -3.092 1.00 23.22 H new ATOM 0 HG2 GLU A 114 -13.207 7.100 -4.948 1.00 30.22 H new ATOM 0 HG3 GLU A 114 -12.374 6.035 -3.834 1.00 30.22 H new ATOM 1891 N ALA A 115 -10.841 7.059 -0.664 1.00 31.50 N ATOM 1892 CA ALA A 115 -9.586 6.355 -0.347 1.00 3.21 C ATOM 1893 C ALA A 115 -9.808 5.254 0.694 1.00 0.52 C ATOM 1894 O ALA A 115 -9.507 4.087 0.436 1.00 42.14 O ATOM 1895 CB ALA A 115 -8.542 7.365 0.130 1.00 23.14 C ATOM 0 H ALA A 115 -10.806 8.061 -0.477 1.00 31.50 H new ATOM 0 HA ALA A 115 -9.221 5.867 -1.251 1.00 3.21 H new ATOM 0 HB1 ALA A 115 -7.613 6.845 0.365 1.00 23.14 H new ATOM 0 HB2 ALA A 115 -8.359 8.098 -0.656 1.00 23.14 H new ATOM 0 HB3 ALA A 115 -8.908 7.873 1.022 1.00 23.14 H new ATOM 1901 N LYS A 116 -10.391 5.640 1.844 1.00 2.23 N ATOM 1902 CA LYS A 116 -10.704 4.714 2.951 1.00 34.45 C ATOM 1903 C LYS A 116 -11.834 3.735 2.591 1.00 45.35 C ATOM 1904 O LYS A 116 -11.852 2.600 3.088 1.00 4.43 O ATOM 1905 CB LYS A 116 -10.995 5.491 4.261 1.00 73.43 C ATOM 1906 CG LYS A 116 -12.025 6.632 4.153 1.00 50.32 C ATOM 1907 CD LYS A 116 -12.115 7.466 5.453 1.00 14.43 C ATOM 1908 CE LYS A 116 -13.063 8.667 5.329 1.00 12.40 C ATOM 1909 NZ LYS A 116 -14.469 8.254 5.091 1.00 52.30 N ATOM 0 H LYS A 116 -10.660 6.606 2.033 1.00 2.23 H new ATOM 0 HA LYS A 116 -9.819 4.102 3.124 1.00 34.45 H new ATOM 0 HB2 LYS A 116 -11.345 4.782 5.011 1.00 73.43 H new ATOM 0 HB3 LYS A 116 -10.058 5.908 4.629 1.00 73.43 H new ATOM 0 HG2 LYS A 116 -11.755 7.285 3.323 1.00 50.32 H new ATOM 0 HG3 LYS A 116 -13.005 6.213 3.924 1.00 50.32 H new ATOM 0 HD2 LYS A 116 -12.454 6.825 6.267 1.00 14.43 H new ATOM 0 HD3 LYS A 116 -11.120 7.821 5.720 1.00 14.43 H new ATOM 0 HE2 LYS A 116 -13.011 9.263 6.240 1.00 12.40 H new ATOM 0 HE3 LYS A 116 -12.731 9.306 4.511 1.00 12.40 H new ATOM 0 HZ1 LYS A 116 -14.826 8.717 4.231 1.00 52.30 H new ATOM 0 HZ2 LYS A 116 -14.512 7.222 4.972 1.00 52.30 H new ATOM 0 HZ3 LYS A 116 -15.055 8.534 5.903 1.00 52.30 H new ATOM 1923 N LYS A 117 -12.773 4.179 1.728 1.00 61.32 N ATOM 1924 CA LYS A 117 -13.829 3.304 1.169 1.00 50.33 C ATOM 1925 C LYS A 117 -13.203 2.125 0.396 1.00 50.35 C ATOM 1926 O LYS A 117 -13.495 0.959 0.683 1.00 25.33 O ATOM 1927 CB LYS A 117 -14.793 4.106 0.253 1.00 21.43 C ATOM 1928 CG LYS A 117 -15.711 5.102 0.991 1.00 62.31 C ATOM 1929 CD LYS A 117 -16.525 6.035 0.047 1.00 53.14 C ATOM 1930 CE LYS A 117 -17.641 5.335 -0.756 1.00 10.32 C ATOM 1931 NZ LYS A 117 -17.140 4.463 -1.857 1.00 54.35 N ATOM 0 H LYS A 117 -12.822 5.144 1.401 1.00 61.32 H new ATOM 0 HA LYS A 117 -14.409 2.904 2.001 1.00 50.33 H new ATOM 0 HB2 LYS A 117 -14.202 4.654 -0.481 1.00 21.43 H new ATOM 0 HB3 LYS A 117 -15.415 3.402 -0.300 1.00 21.43 H new ATOM 0 HG2 LYS A 117 -16.405 4.543 1.619 1.00 62.31 H new ATOM 0 HG3 LYS A 117 -15.103 5.716 1.656 1.00 62.31 H new ATOM 0 HD2 LYS A 117 -16.971 6.831 0.643 1.00 53.14 H new ATOM 0 HD3 LYS A 117 -15.837 6.509 -0.653 1.00 53.14 H new ATOM 0 HE2 LYS A 117 -18.242 4.733 -0.074 1.00 10.32 H new ATOM 0 HE3 LYS A 117 -18.301 6.093 -1.178 1.00 10.32 H new ATOM 0 HZ1 LYS A 117 -17.751 4.572 -2.691 1.00 54.35 H new ATOM 0 HZ2 LYS A 117 -16.167 4.738 -2.102 1.00 54.35 H new ATOM 0 HZ3 LYS A 117 -17.151 3.471 -1.546 1.00 54.35 H new ATOM 1945 N ARG A 118 -12.296 2.453 -0.552 1.00 54.24 N ATOM 1946 CA ARG A 118 -11.628 1.457 -1.411 1.00 51.23 C ATOM 1947 C ARG A 118 -10.579 0.633 -0.647 1.00 25.15 C ATOM 1948 O ARG A 118 -10.223 -0.461 -1.100 1.00 30.51 O ATOM 1949 CB ARG A 118 -11.044 2.076 -2.703 1.00 72.34 C ATOM 1950 CG ARG A 118 -12.128 2.651 -3.652 1.00 4.43 C ATOM 1951 CD ARG A 118 -11.654 2.806 -5.109 1.00 70.31 C ATOM 1952 NE ARG A 118 -12.618 3.545 -5.944 1.00 64.33 N ATOM 1953 CZ ARG A 118 -13.772 3.061 -6.435 1.00 71.34 C ATOM 1954 NH1 ARG A 118 -14.171 1.815 -6.193 1.00 23.52 N ATOM 1955 NH2 ARG A 118 -14.521 3.842 -7.196 1.00 12.32 N ATOM 0 H ARG A 118 -12.009 3.414 -0.740 1.00 54.24 H new ATOM 0 HA ARG A 118 -12.408 0.764 -1.725 1.00 51.23 H new ATOM 0 HB2 ARG A 118 -10.348 2.870 -2.434 1.00 72.34 H new ATOM 0 HB3 ARG A 118 -10.471 1.316 -3.235 1.00 72.34 H new ATOM 0 HG2 ARG A 118 -13.001 1.998 -3.630 1.00 4.43 H new ATOM 0 HG3 ARG A 118 -12.448 3.623 -3.278 1.00 4.43 H new ATOM 0 HD2 ARG A 118 -10.695 3.325 -5.122 1.00 70.31 H new ATOM 0 HD3 ARG A 118 -11.488 1.819 -5.540 1.00 70.31 H new ATOM 0 HE ARG A 118 -12.388 4.513 -6.170 1.00 64.33 H new ATOM 0 HH11 ARG A 118 -13.596 1.197 -5.620 1.00 23.52 H new ATOM 0 HH12 ARG A 118 -15.052 1.477 -6.580 1.00 23.52 H new ATOM 0 HH21 ARG A 118 -14.220 4.795 -7.402 1.00 12.32 H new ATOM 0 HH22 ARG A 118 -15.400 3.492 -7.577 1.00 12.32 H new ATOM 1969 N LEU A 119 -10.048 1.176 0.477 1.00 24.35 N ATOM 1970 CA LEU A 119 -9.208 0.387 1.407 1.00 11.25 C ATOM 1971 C LEU A 119 -9.985 -0.841 1.900 1.00 33.33 C ATOM 1972 O LEU A 119 -9.540 -1.966 1.695 1.00 11.12 O ATOM 1973 CB LEU A 119 -8.744 1.220 2.635 1.00 61.33 C ATOM 1974 CG LEU A 119 -7.693 2.328 2.363 1.00 2.52 C ATOM 1975 CD1 LEU A 119 -7.298 3.021 3.665 1.00 12.24 C ATOM 1976 CD2 LEU A 119 -6.460 1.772 1.639 1.00 71.20 C ATOM 0 H LEU A 119 -10.186 2.147 0.758 1.00 24.35 H new ATOM 0 HA LEU A 119 -8.320 0.080 0.854 1.00 11.25 H new ATOM 0 HB2 LEU A 119 -9.622 1.685 3.083 1.00 61.33 H new ATOM 0 HB3 LEU A 119 -8.333 0.535 3.376 1.00 61.33 H new ATOM 0 HG LEU A 119 -8.149 3.066 1.704 1.00 2.52 H new ATOM 0 HD11 LEU A 119 -6.560 3.795 3.456 1.00 12.24 H new ATOM 0 HD12 LEU A 119 -8.180 3.473 4.119 1.00 12.24 H new ATOM 0 HD13 LEU A 119 -6.872 2.290 4.352 1.00 12.24 H new ATOM 0 HD21 LEU A 119 -5.746 2.577 1.466 1.00 71.20 H new ATOM 0 HD22 LEU A 119 -5.995 1.000 2.253 1.00 71.20 H new ATOM 0 HD23 LEU A 119 -6.762 1.343 0.684 1.00 71.20 H new ATOM 1988 N LYS A 120 -11.180 -0.592 2.482 1.00 24.21 N ATOM 1989 CA LYS A 120 -12.048 -1.656 3.022 1.00 4.13 C ATOM 1990 C LYS A 120 -12.549 -2.577 1.893 1.00 21.01 C ATOM 1991 O LYS A 120 -12.534 -3.797 2.032 1.00 0.24 O ATOM 1992 CB LYS A 120 -13.259 -1.066 3.806 1.00 44.20 C ATOM 1993 CG LYS A 120 -14.187 -2.154 4.409 1.00 50.44 C ATOM 1994 CD LYS A 120 -15.389 -1.592 5.204 1.00 73.45 C ATOM 1995 CE LYS A 120 -16.248 -2.719 5.816 1.00 24.54 C ATOM 1996 NZ LYS A 120 -17.408 -2.193 6.578 1.00 61.01 N ATOM 0 H LYS A 120 -11.565 0.346 2.589 1.00 24.21 H new ATOM 0 HA LYS A 120 -11.448 -2.242 3.718 1.00 4.13 H new ATOM 0 HB2 LYS A 120 -12.888 -0.429 4.609 1.00 44.20 H new ATOM 0 HB3 LYS A 120 -13.841 -0.431 3.138 1.00 44.20 H new ATOM 0 HG2 LYS A 120 -14.562 -2.784 3.602 1.00 50.44 H new ATOM 0 HG3 LYS A 120 -13.598 -2.794 5.066 1.00 50.44 H new ATOM 0 HD2 LYS A 120 -15.026 -0.939 5.998 1.00 73.45 H new ATOM 0 HD3 LYS A 120 -16.006 -0.981 4.546 1.00 73.45 H new ATOM 0 HE2 LYS A 120 -16.605 -3.373 5.021 1.00 24.54 H new ATOM 0 HE3 LYS A 120 -15.629 -3.327 6.475 1.00 24.54 H new ATOM 0 HZ1 LYS A 120 -17.955 -2.986 6.970 1.00 61.01 H new ATOM 0 HZ2 LYS A 120 -17.069 -1.590 7.354 1.00 61.01 H new ATOM 0 HZ3 LYS A 120 -18.015 -1.634 5.945 1.00 61.01 H new ATOM 2010 N GLU A 121 -12.906 -1.948 0.757 1.00 4.45 N ATOM 2011 CA GLU A 121 -13.444 -2.617 -0.451 1.00 43.14 C ATOM 2012 C GLU A 121 -12.527 -3.773 -0.901 1.00 32.12 C ATOM 2013 O GLU A 121 -12.965 -4.916 -1.083 1.00 12.42 O ATOM 2014 CB GLU A 121 -13.549 -1.536 -1.563 1.00 60.42 C ATOM 2015 CG GLU A 121 -13.991 -2.005 -2.954 1.00 41.33 C ATOM 2016 CD GLU A 121 -13.860 -0.899 -4.022 1.00 32.23 C ATOM 2017 OE1 GLU A 121 -14.651 0.064 -3.984 1.00 25.31 O ATOM 2018 OE2 GLU A 121 -12.962 -0.972 -4.889 1.00 3.22 O ATOM 0 H GLU A 121 -12.828 -0.937 0.648 1.00 4.45 H new ATOM 0 HA GLU A 121 -14.420 -3.053 -0.240 1.00 43.14 H new ATOM 0 HB2 GLU A 121 -14.248 -0.771 -1.226 1.00 60.42 H new ATOM 0 HB3 GLU A 121 -12.575 -1.056 -1.661 1.00 60.42 H new ATOM 0 HG2 GLU A 121 -13.391 -2.865 -3.251 1.00 41.33 H new ATOM 0 HG3 GLU A 121 -15.027 -2.340 -2.908 1.00 41.33 H new ATOM 2025 N LEU A 122 -11.240 -3.446 -1.041 1.00 31.53 N ATOM 2026 CA LEU A 122 -10.204 -4.391 -1.468 1.00 62.30 C ATOM 2027 C LEU A 122 -9.742 -5.298 -0.316 1.00 43.13 C ATOM 2028 O LEU A 122 -9.358 -6.434 -0.559 1.00 43.30 O ATOM 2029 CB LEU A 122 -9.029 -3.594 -2.085 1.00 41.01 C ATOM 2030 CG LEU A 122 -9.418 -2.744 -3.342 1.00 71.21 C ATOM 2031 CD1 LEU A 122 -8.261 -1.848 -3.803 1.00 72.05 C ATOM 2032 CD2 LEU A 122 -9.920 -3.649 -4.488 1.00 33.22 C ATOM 0 H LEU A 122 -10.884 -2.508 -0.859 1.00 31.53 H new ATOM 0 HA LEU A 122 -10.618 -5.060 -2.222 1.00 62.30 H new ATOM 0 HB2 LEU A 122 -8.617 -2.930 -1.325 1.00 41.01 H new ATOM 0 HB3 LEU A 122 -8.238 -4.291 -2.362 1.00 41.01 H new ATOM 0 HG LEU A 122 -10.237 -2.086 -3.052 1.00 71.21 H new ATOM 0 HD11 LEU A 122 -8.571 -1.275 -4.677 1.00 72.05 H new ATOM 0 HD12 LEU A 122 -7.987 -1.165 -2.999 1.00 72.05 H new ATOM 0 HD13 LEU A 122 -7.402 -2.467 -4.061 1.00 72.05 H new ATOM 0 HD21 LEU A 122 -10.183 -3.034 -5.349 1.00 33.22 H new ATOM 0 HD22 LEU A 122 -9.134 -4.349 -4.770 1.00 33.22 H new ATOM 0 HD23 LEU A 122 -10.798 -4.203 -4.156 1.00 33.22 H new ATOM 2044 N LEU A 123 -9.801 -4.786 0.932 1.00 40.13 N ATOM 2045 CA LEU A 123 -9.271 -5.480 2.137 1.00 20.11 C ATOM 2046 C LEU A 123 -10.108 -6.722 2.508 1.00 13.31 C ATOM 2047 O LEU A 123 -9.560 -7.741 2.956 1.00 35.55 O ATOM 2048 CB LEU A 123 -9.235 -4.500 3.343 1.00 24.41 C ATOM 2049 CG LEU A 123 -8.493 -4.986 4.630 1.00 31.32 C ATOM 2050 CD1 LEU A 123 -6.969 -5.109 4.393 1.00 4.03 C ATOM 2051 CD2 LEU A 123 -8.807 -4.062 5.827 1.00 42.25 C ATOM 0 H LEU A 123 -10.217 -3.878 1.138 1.00 40.13 H new ATOM 0 HA LEU A 123 -8.262 -5.816 1.899 1.00 20.11 H new ATOM 0 HB2 LEU A 123 -8.767 -3.573 3.012 1.00 24.41 H new ATOM 0 HB3 LEU A 123 -10.263 -4.259 3.615 1.00 24.41 H new ATOM 0 HG LEU A 123 -8.862 -5.983 4.872 1.00 31.32 H new ATOM 0 HD11 LEU A 123 -6.485 -5.449 5.308 1.00 4.03 H new ATOM 0 HD12 LEU A 123 -6.782 -5.827 3.595 1.00 4.03 H new ATOM 0 HD13 LEU A 123 -6.565 -4.137 4.109 1.00 4.03 H new ATOM 0 HD21 LEU A 123 -8.280 -4.420 6.711 1.00 42.25 H new ATOM 0 HD22 LEU A 123 -8.483 -3.047 5.598 1.00 42.25 H new ATOM 0 HD23 LEU A 123 -9.880 -4.066 6.018 1.00 42.25 H new ATOM 2063 N GLU A 124 -11.439 -6.620 2.309 1.00 71.01 N ATOM 2064 CA GLU A 124 -12.402 -7.696 2.648 1.00 23.35 C ATOM 2065 C GLU A 124 -12.188 -8.937 1.776 1.00 74.33 C ATOM 2066 O GLU A 124 -12.427 -10.063 2.223 1.00 71.23 O ATOM 2067 CB GLU A 124 -13.860 -7.188 2.513 1.00 72.31 C ATOM 2068 CG GLU A 124 -14.191 -6.018 3.452 1.00 4.33 C ATOM 2069 CD GLU A 124 -15.656 -5.571 3.385 1.00 21.34 C ATOM 2070 OE1 GLU A 124 -16.004 -4.775 2.492 1.00 53.11 O ATOM 2071 OE2 GLU A 124 -16.472 -6.023 4.225 1.00 41.41 O ATOM 0 H GLU A 124 -11.879 -5.791 1.909 1.00 71.01 H new ATOM 0 HA GLU A 124 -12.224 -7.981 3.685 1.00 23.35 H new ATOM 0 HB2 GLU A 124 -14.034 -6.877 1.483 1.00 72.31 H new ATOM 0 HB3 GLU A 124 -14.544 -8.012 2.717 1.00 72.31 H new ATOM 0 HG2 GLU A 124 -13.955 -6.307 4.476 1.00 4.33 H new ATOM 0 HG3 GLU A 124 -13.550 -5.172 3.204 1.00 4.33 H new ATOM 2078 N LYS A 125 -11.743 -8.716 0.534 1.00 64.54 N ATOM 2079 CA LYS A 125 -11.434 -9.796 -0.418 1.00 51.44 C ATOM 2080 C LYS A 125 -9.902 -9.897 -0.634 1.00 3.24 C ATOM 2081 O LYS A 125 -9.430 -10.702 -1.438 1.00 75.20 O ATOM 2082 CB LYS A 125 -12.210 -9.533 -1.735 1.00 72.44 C ATOM 2083 CG LYS A 125 -12.276 -10.737 -2.712 1.00 24.23 C ATOM 2084 CD LYS A 125 -13.230 -10.498 -3.903 1.00 53.33 C ATOM 2085 CE LYS A 125 -14.666 -10.169 -3.456 1.00 24.03 C ATOM 2086 NZ LYS A 125 -15.302 -11.280 -2.706 1.00 53.43 N ATOM 0 H LYS A 125 -11.586 -7.781 0.157 1.00 64.54 H new ATOM 0 HA LYS A 125 -11.754 -10.761 -0.024 1.00 51.44 H new ATOM 0 HB2 LYS A 125 -13.227 -9.232 -1.485 1.00 72.44 H new ATOM 0 HB3 LYS A 125 -11.746 -8.692 -2.250 1.00 72.44 H new ATOM 0 HG2 LYS A 125 -11.276 -10.945 -3.091 1.00 24.23 H new ATOM 0 HG3 LYS A 125 -12.600 -11.623 -2.166 1.00 24.23 H new ATOM 0 HD2 LYS A 125 -12.847 -9.679 -4.512 1.00 53.33 H new ATOM 0 HD3 LYS A 125 -13.245 -11.386 -4.535 1.00 53.33 H new ATOM 0 HE2 LYS A 125 -14.652 -9.276 -2.831 1.00 24.03 H new ATOM 0 HE3 LYS A 125 -15.270 -9.935 -4.333 1.00 24.03 H new ATOM 0 HZ1 LYS A 125 -16.266 -11.005 -2.430 1.00 53.43 H new ATOM 0 HZ2 LYS A 125 -15.343 -12.127 -3.308 1.00 53.43 H new ATOM 0 HZ3 LYS A 125 -14.744 -11.488 -1.854 1.00 53.43 H new ATOM 2100 N VAL A 126 -9.153 -9.064 0.129 1.00 21.13 N ATOM 2101 CA VAL A 126 -7.679 -9.084 0.223 1.00 62.41 C ATOM 2102 C VAL A 126 -6.996 -8.782 -1.131 1.00 75.14 C ATOM 2103 O VAL A 126 -6.691 -9.698 -1.900 1.00 53.33 O ATOM 2104 CB VAL A 126 -7.166 -10.438 0.845 1.00 31.33 C ATOM 2105 CG1 VAL A 126 -5.632 -10.507 0.907 1.00 11.43 C ATOM 2106 CG2 VAL A 126 -7.785 -10.671 2.241 1.00 41.24 C ATOM 0 H VAL A 126 -9.573 -8.340 0.712 1.00 21.13 H new ATOM 0 HA VAL A 126 -7.393 -8.278 0.898 1.00 62.41 H new ATOM 0 HB VAL A 126 -7.494 -11.239 0.182 1.00 31.33 H new ATOM 0 HG11 VAL A 126 -5.328 -11.459 1.343 1.00 11.43 H new ATOM 0 HG12 VAL A 126 -5.223 -10.422 -0.100 1.00 11.43 H new ATOM 0 HG13 VAL A 126 -5.256 -9.689 1.522 1.00 11.43 H new ATOM 0 HG21 VAL A 126 -7.416 -11.612 2.650 1.00 41.24 H new ATOM 0 HG22 VAL A 126 -7.506 -9.852 2.904 1.00 41.24 H new ATOM 0 HG23 VAL A 126 -8.871 -10.714 2.155 1.00 41.24 H new ATOM 2116 N GLY A 127 -6.834 -7.470 -1.428 1.00 33.00 N ATOM 2117 CA GLY A 127 -6.079 -6.987 -2.598 1.00 44.33 C ATOM 2118 C GLY A 127 -6.556 -7.531 -3.950 1.00 73.15 C ATOM 2119 O GLY A 127 -5.813 -7.504 -4.934 1.00 11.22 O ATOM 0 H GLY A 127 -7.226 -6.720 -0.859 1.00 33.00 H new ATOM 0 HA2 GLY A 127 -6.134 -5.899 -2.622 1.00 44.33 H new ATOM 0 HA3 GLY A 127 -5.029 -7.251 -2.468 1.00 44.33 H new