USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 786 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 49 TYR OH : rot 180:sc= 0.276 USER MOD Set 1.2: B 48 GLN : amide:sc= -0.0949 X(o=0.18,f=0.066) USER MOD Set 2.1: B 34 GLN : amide:sc= 0.871 K(o=1.9,f=1.3) USER MOD Set 2.2: B 38 TYR OH : rot 180:sc= 1.03 USER MOD Set 3.1: B 35 THR OG1 : rot -74:sc= 1.76 USER MOD Set 3.2: B 36 LYS NZ :NH3+ 161:sc= 1.02 (180deg=-1.03!) USER MOD Set 4.1: A 34 GLN : amide:sc= 1.32 K(o=2.1,f=1.2) USER MOD Set 4.2: A 38 TYR OH : rot 180:sc= 0.76 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 95:sc= 1.28 USER MOD Single : A 15 SER OG : rot 163:sc= 0.997 USER MOD Single : A 16 GLN : amide:sc= -0.197 X(o=-0.2,f=-0.077) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -150:sc= -0.272 (180deg=-1.33) USER MOD Single : A 23 SER OG : rot 180:sc= -0.364 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.0119 USER MOD Single : A 36 LYS NZ :NH3+ 168:sc= -0.0148 (180deg=-0.158) USER MOD Single : A 37 ASN : amide:sc= 0.766 K(o=0.77,f=-6.1!) USER MOD Single : A 46 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 48 GLN : amide:sc= -0.0163 K(o=-0.016,f=-0.88) USER MOD Single : A 50 SER OG : rot 56:sc= 0.227 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 1 GLY N :NH3+ -135:sc= 0.00496 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 13 SER OG : rot 95:sc=-0.00247 USER MOD Single : B 15 SER OG : rot 137:sc= 0.431 USER MOD Single : B 16 GLN : amide:sc= -0.273 K(o=-0.27,f=-0.84) USER MOD Single : B 17 MET CE :methyl -144:sc= 0 (180deg=-0.0613) USER MOD Single : B 19 SER OG : rot 72:sc= 0.803 USER MOD Single : B 20 MET CE :methyl -167:sc= -0.0028 (180deg=-0.214) USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= 0.667 K(o=0.67,f=-5.4!) USER MOD Single : B 46 THR OG1 : rot 91:sc= 1.21 USER MOD Single : B 49 TYR OH : rot 180:sc= 0 USER MOD Single : B 50 SER OG : rot 180:sc= -0.0783 USER MOD Single : B 51 LYS NZ :NH3+ 159:sc= -0.082 (180deg=-0.433) USER MOD Single : B 52 HIS : no HE2:sc= 0.375 K(o=0.38,f=-1.3) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.262 19.669 -3.244 1.00 10.00 N ATOM 2 CA GLY A 1 18.706 18.374 -3.709 1.00 10.00 C ATOM 3 C GLY A 1 19.298 17.200 -2.963 1.00 10.00 C ATOM 4 O GLY A 1 18.656 16.631 -2.079 1.00 10.00 O ATOM 0 H1 GLY A 1 18.828 20.446 -3.782 1.00 10.00 H new ATOM 0 H2 GLY A 1 19.056 19.792 -2.232 1.00 10.00 H new ATOM 0 H3 GLY A 1 20.291 19.678 -3.392 1.00 10.00 H new ATOM 0 HA2 GLY A 1 17.624 18.377 -3.579 1.00 10.00 H new ATOM 0 HA3 GLY A 1 18.899 18.259 -4.776 1.00 10.00 H new ATOM 10 N SER A 2 20.519 16.838 -3.312 1.00 10.00 N ATOM 11 CA SER A 2 21.198 15.728 -2.667 1.00 10.00 C ATOM 12 C SER A 2 22.379 16.250 -1.853 1.00 10.00 C ATOM 13 O SER A 2 23.461 16.473 -2.393 1.00 10.00 O ATOM 14 CB SER A 2 21.678 14.730 -3.722 1.00 10.00 C ATOM 15 OG SER A 2 20.702 14.558 -4.738 1.00 10.00 O ATOM 0 H SER A 2 21.063 17.298 -4.042 1.00 10.00 H new ATOM 0 HA SER A 2 20.505 15.221 -1.996 1.00 10.00 H new ATOM 0 HB2 SER A 2 22.610 15.082 -4.164 1.00 10.00 H new ATOM 0 HB3 SER A 2 21.891 13.771 -3.251 1.00 10.00 H new ATOM 0 HG SER A 2 21.031 13.917 -5.402 1.00 10.00 H new ATOM 21 N PRO A 3 22.185 16.455 -0.546 1.00 10.00 N ATOM 22 CA PRO A 3 23.233 16.972 0.329 1.00 10.00 C ATOM 23 C PRO A 3 24.247 15.906 0.722 1.00 10.00 C ATOM 24 O PRO A 3 23.917 14.722 0.791 1.00 10.00 O ATOM 25 CB PRO A 3 22.455 17.445 1.556 1.00 10.00 C ATOM 26 CG PRO A 3 21.259 16.561 1.612 1.00 10.00 C ATOM 27 CD PRO A 3 20.931 16.198 0.186 1.00 10.00 C ATOM 0 HA PRO A 3 23.821 17.752 -0.155 1.00 10.00 H new ATOM 0 HB2 PRO A 3 23.054 17.358 2.462 1.00 10.00 H new ATOM 0 HB3 PRO A 3 22.169 18.493 1.463 1.00 10.00 H new ATOM 0 HG2 PRO A 3 21.463 15.668 2.203 1.00 10.00 H new ATOM 0 HG3 PRO A 3 20.420 17.072 2.086 1.00 10.00 H new ATOM 0 HD2 PRO A 3 20.625 15.155 0.100 1.00 10.00 H new ATOM 0 HD3 PRO A 3 20.112 16.803 -0.201 1.00 10.00 H new ATOM 35 N PRO A 4 25.499 16.309 0.995 1.00 10.00 N ATOM 36 CA PRO A 4 26.552 15.376 1.403 1.00 10.00 C ATOM 37 C PRO A 4 26.334 14.890 2.831 1.00 10.00 C ATOM 38 O PRO A 4 27.050 14.023 3.331 1.00 10.00 O ATOM 39 CB PRO A 4 27.826 16.211 1.305 1.00 10.00 C ATOM 40 CG PRO A 4 27.371 17.614 1.517 1.00 10.00 C ATOM 41 CD PRO A 4 25.995 17.699 0.912 1.00 10.00 C ATOM 0 HA PRO A 4 26.580 14.478 0.786 1.00 10.00 H new ATOM 0 HB2 PRO A 4 28.555 15.912 2.058 1.00 10.00 H new ATOM 0 HB3 PRO A 4 28.305 16.092 0.333 1.00 10.00 H new ATOM 0 HG2 PRO A 4 27.347 17.860 2.579 1.00 10.00 H new ATOM 0 HG3 PRO A 4 28.051 18.321 1.041 1.00 10.00 H new ATOM 0 HD2 PRO A 4 25.355 18.388 1.464 1.00 10.00 H new ATOM 0 HD3 PRO A 4 26.030 18.052 -0.118 1.00 10.00 H new ATOM 49 N GLU A 5 25.334 15.478 3.479 1.00 10.00 N ATOM 50 CA GLU A 5 24.972 15.127 4.841 1.00 10.00 C ATOM 51 C GLU A 5 24.037 13.922 4.835 1.00 10.00 C ATOM 52 O GLU A 5 23.596 13.452 5.887 1.00 10.00 O ATOM 53 CB GLU A 5 24.288 16.312 5.530 1.00 10.00 C ATOM 54 CG GLU A 5 25.083 17.607 5.467 1.00 10.00 C ATOM 55 CD GLU A 5 24.665 18.587 6.542 1.00 10.00 C ATOM 56 OE1 GLU A 5 23.586 19.199 6.411 1.00 10.00 O ATOM 57 OE2 GLU A 5 25.409 18.732 7.534 1.00 10.00 O ATOM 0 H GLU A 5 24.754 16.211 3.072 1.00 10.00 H new ATOM 0 HA GLU A 5 25.878 14.875 5.391 1.00 10.00 H new ATOM 0 HB2 GLU A 5 23.313 16.473 5.070 1.00 10.00 H new ATOM 0 HB3 GLU A 5 24.109 16.058 6.575 1.00 10.00 H new ATOM 0 HG2 GLU A 5 26.145 17.385 5.573 1.00 10.00 H new ATOM 0 HG3 GLU A 5 24.950 18.066 4.487 1.00 10.00 H new ATOM 64 N ALA A 6 23.725 13.445 3.638 1.00 10.00 N ATOM 65 CA ALA A 6 22.853 12.296 3.468 1.00 10.00 C ATOM 66 C ALA A 6 23.676 11.102 3.010 1.00 10.00 C ATOM 67 O ALA A 6 24.556 11.239 2.162 1.00 10.00 O ATOM 68 CB ALA A 6 21.751 12.606 2.466 1.00 10.00 C ATOM 0 H ALA A 6 24.068 13.842 2.763 1.00 10.00 H new ATOM 0 HA ALA A 6 22.381 12.059 4.421 1.00 10.00 H new ATOM 0 HB1 ALA A 6 21.108 11.734 2.351 1.00 10.00 H new ATOM 0 HB2 ALA A 6 21.160 13.449 2.825 1.00 10.00 H new ATOM 0 HB3 ALA A 6 22.195 12.858 1.503 1.00 10.00 H new ATOM 74 N ASP A 7 23.405 9.943 3.585 1.00 10.00 N ATOM 75 CA ASP A 7 24.136 8.732 3.245 1.00 10.00 C ATOM 76 C ASP A 7 23.735 8.219 1.862 1.00 10.00 C ATOM 77 O ASP A 7 22.548 8.049 1.575 1.00 10.00 O ATOM 78 CB ASP A 7 23.879 7.650 4.294 1.00 10.00 C ATOM 79 CG ASP A 7 24.900 6.535 4.243 1.00 10.00 C ATOM 80 OD1 ASP A 7 24.894 5.757 3.268 1.00 10.00 O ATOM 81 OD2 ASP A 7 25.715 6.428 5.181 1.00 10.00 O ATOM 0 H ASP A 7 22.681 9.814 4.292 1.00 10.00 H new ATOM 0 HA ASP A 7 25.199 8.972 3.228 1.00 10.00 H new ATOM 0 HB2 ASP A 7 23.889 8.101 5.286 1.00 10.00 H new ATOM 0 HB3 ASP A 7 22.883 7.233 4.144 1.00 10.00 H new ATOM 86 N PRO A 8 24.725 7.954 0.996 1.00 10.00 N ATOM 87 CA PRO A 8 24.490 7.456 -0.365 1.00 10.00 C ATOM 88 C PRO A 8 23.807 6.090 -0.383 1.00 10.00 C ATOM 89 O PRO A 8 23.126 5.741 -1.348 1.00 10.00 O ATOM 90 CB PRO A 8 25.895 7.350 -0.965 1.00 10.00 C ATOM 91 CG PRO A 8 26.816 7.301 0.205 1.00 10.00 C ATOM 92 CD PRO A 8 26.163 8.131 1.270 1.00 10.00 C ATOM 0 HA PRO A 8 23.823 8.117 -0.919 1.00 10.00 H new ATOM 0 HB2 PRO A 8 25.994 6.457 -1.582 1.00 10.00 H new ATOM 0 HB3 PRO A 8 26.116 8.205 -1.605 1.00 10.00 H new ATOM 0 HG2 PRO A 8 26.965 6.276 0.544 1.00 10.00 H new ATOM 0 HG3 PRO A 8 27.798 7.697 -0.053 1.00 10.00 H new ATOM 0 HD2 PRO A 8 26.429 7.786 2.269 1.00 10.00 H new ATOM 0 HD3 PRO A 8 26.460 9.178 1.204 1.00 10.00 H new ATOM 100 N ARG A 9 23.977 5.323 0.684 1.00 10.00 N ATOM 101 CA ARG A 9 23.375 3.997 0.775 1.00 10.00 C ATOM 102 C ARG A 9 21.962 4.097 1.324 1.00 10.00 C ATOM 103 O ARG A 9 21.101 3.276 1.014 1.00 10.00 O ATOM 104 CB ARG A 9 24.220 3.090 1.664 1.00 10.00 C ATOM 105 CG ARG A 9 25.684 3.022 1.260 1.00 10.00 C ATOM 106 CD ARG A 9 26.550 2.576 2.421 1.00 10.00 C ATOM 107 NE ARG A 9 26.432 3.480 3.561 1.00 10.00 N ATOM 108 CZ ARG A 9 26.895 3.208 4.778 1.00 10.00 C ATOM 109 NH1 ARG A 9 27.477 2.046 5.037 1.00 10.00 N ATOM 110 NH2 ARG A 9 26.772 4.101 5.743 1.00 10.00 N ATOM 0 H ARG A 9 24.526 5.594 1.500 1.00 10.00 H new ATOM 0 HA ARG A 9 23.334 3.566 -0.225 1.00 10.00 H new ATOM 0 HB2 ARG A 9 24.153 3.442 2.693 1.00 10.00 H new ATOM 0 HB3 ARG A 9 23.800 2.084 1.643 1.00 10.00 H new ATOM 0 HG2 ARG A 9 25.803 2.330 0.427 1.00 10.00 H new ATOM 0 HG3 ARG A 9 26.014 4.000 0.911 1.00 10.00 H new ATOM 0 HD2 ARG A 9 26.262 1.569 2.724 1.00 10.00 H new ATOM 0 HD3 ARG A 9 27.591 2.528 2.101 1.00 10.00 H new ATOM 0 HE ARG A 9 25.966 4.375 3.415 1.00 10.00 H new ATOM 0 HH11 ARG A 9 27.574 1.348 4.299 1.00 10.00 H new ATOM 0 HH12 ARG A 9 27.828 1.849 5.974 1.00 10.00 H new ATOM 0 HH21 ARG A 9 26.323 4.997 5.554 1.00 10.00 H new ATOM 0 HH22 ARG A 9 27.126 3.895 6.677 1.00 10.00 H new ATOM 124 N LEU A 10 21.725 5.123 2.131 1.00 10.00 N ATOM 125 CA LEU A 10 20.411 5.342 2.718 1.00 10.00 C ATOM 126 C LEU A 10 19.423 5.745 1.631 1.00 10.00 C ATOM 127 O LEU A 10 18.253 5.361 1.662 1.00 10.00 O ATOM 128 CB LEU A 10 20.479 6.426 3.802 1.00 10.00 C ATOM 129 CG LEU A 10 19.165 6.703 4.538 1.00 10.00 C ATOM 130 CD1 LEU A 10 18.753 5.498 5.368 1.00 10.00 C ATOM 131 CD2 LEU A 10 19.303 7.938 5.417 1.00 10.00 C ATOM 0 H LEU A 10 22.426 5.816 2.394 1.00 10.00 H new ATOM 0 HA LEU A 10 20.074 4.415 3.182 1.00 10.00 H new ATOM 0 HB2 LEU A 10 21.232 6.136 4.535 1.00 10.00 H new ATOM 0 HB3 LEU A 10 20.821 7.354 3.343 1.00 10.00 H new ATOM 0 HG LEU A 10 18.386 6.890 3.799 1.00 10.00 H new ATOM 0 HD11 LEU A 10 17.817 5.714 5.883 1.00 10.00 H new ATOM 0 HD12 LEU A 10 18.617 4.636 4.715 1.00 10.00 H new ATOM 0 HD13 LEU A 10 19.529 5.279 6.101 1.00 10.00 H new ATOM 0 HD21 LEU A 10 18.362 8.123 5.934 1.00 10.00 H new ATOM 0 HD22 LEU A 10 20.094 7.777 6.149 1.00 10.00 H new ATOM 0 HD23 LEU A 10 19.552 8.799 4.798 1.00 10.00 H new ATOM 143 N ILE A 11 19.911 6.510 0.658 1.00 10.00 N ATOM 144 CA ILE A 11 19.080 6.956 -0.455 1.00 10.00 C ATOM 145 C ILE A 11 18.903 5.829 -1.477 1.00 10.00 C ATOM 146 O ILE A 11 18.017 5.880 -2.331 1.00 10.00 O ATOM 147 CB ILE A 11 19.673 8.217 -1.133 1.00 10.00 C ATOM 148 CG1 ILE A 11 18.610 8.932 -1.972 1.00 10.00 C ATOM 149 CG2 ILE A 11 20.879 7.861 -1.990 1.00 10.00 C ATOM 150 CD1 ILE A 11 19.060 10.275 -2.512 1.00 10.00 C ATOM 0 H ILE A 11 20.878 6.834 0.618 1.00 10.00 H new ATOM 0 HA ILE A 11 18.102 7.222 -0.055 1.00 10.00 H new ATOM 0 HB ILE A 11 20.005 8.895 -0.347 1.00 10.00 H new ATOM 0 HG12 ILE A 11 18.328 8.291 -2.807 1.00 10.00 H new ATOM 0 HG13 ILE A 11 17.717 9.076 -1.364 1.00 10.00 H new ATOM 0 HG21 ILE A 11 21.275 8.764 -2.454 1.00 10.00 H new ATOM 0 HG22 ILE A 11 21.648 7.407 -1.365 1.00 10.00 H new ATOM 0 HG23 ILE A 11 20.579 7.157 -2.766 1.00 10.00 H new ATOM 0 HD11 ILE A 11 18.255 10.721 -3.096 1.00 10.00 H new ATOM 0 HD12 ILE A 11 19.315 10.934 -1.682 1.00 10.00 H new ATOM 0 HD13 ILE A 11 19.935 10.137 -3.147 1.00 10.00 H new ATOM 162 N GLU A 12 19.732 4.795 -1.362 1.00 10.00 N ATOM 163 CA GLU A 12 19.667 3.653 -2.269 1.00 10.00 C ATOM 164 C GLU A 12 18.399 2.846 -2.040 1.00 10.00 C ATOM 165 O GLU A 12 17.985 2.072 -2.899 1.00 10.00 O ATOM 166 CB GLU A 12 20.887 2.753 -2.092 1.00 10.00 C ATOM 167 CG GLU A 12 22.086 3.209 -2.897 1.00 10.00 C ATOM 168 CD GLU A 12 21.898 3.009 -4.384 1.00 10.00 C ATOM 169 OE1 GLU A 12 21.048 3.704 -4.982 1.00 10.00 O ATOM 170 OE2 GLU A 12 22.606 2.155 -4.965 1.00 10.00 O ATOM 0 H GLU A 12 20.458 4.725 -0.649 1.00 10.00 H new ATOM 0 HA GLU A 12 19.656 4.041 -3.288 1.00 10.00 H new ATOM 0 HB2 GLU A 12 21.157 2.721 -1.036 1.00 10.00 H new ATOM 0 HB3 GLU A 12 20.626 1.736 -2.385 1.00 10.00 H new ATOM 0 HG2 GLU A 12 22.273 4.264 -2.697 1.00 10.00 H new ATOM 0 HG3 GLU A 12 22.969 2.661 -2.569 1.00 10.00 H new ATOM 177 N SER A 13 17.786 3.037 -0.877 1.00 10.00 N ATOM 178 CA SER A 13 16.558 2.336 -0.529 1.00 10.00 C ATOM 179 C SER A 13 15.454 2.658 -1.533 1.00 10.00 C ATOM 180 O SER A 13 14.573 1.836 -1.790 1.00 10.00 O ATOM 181 CB SER A 13 16.127 2.723 0.886 1.00 10.00 C ATOM 182 OG SER A 13 17.253 2.803 1.748 1.00 10.00 O ATOM 0 H SER A 13 18.123 3.675 -0.156 1.00 10.00 H new ATOM 0 HA SER A 13 16.742 1.262 -0.562 1.00 10.00 H new ATOM 0 HB2 SER A 13 15.610 3.682 0.865 1.00 10.00 H new ATOM 0 HB3 SER A 13 15.420 1.988 1.270 1.00 10.00 H new ATOM 0 HG SER A 13 17.561 3.732 1.798 1.00 10.00 H new ATOM 188 N LEU A 14 15.523 3.851 -2.114 1.00 10.00 N ATOM 189 CA LEU A 14 14.538 4.279 -3.094 1.00 10.00 C ATOM 190 C LEU A 14 14.868 3.689 -4.465 1.00 10.00 C ATOM 191 O LEU A 14 13.987 3.190 -5.164 1.00 10.00 O ATOM 192 CB LEU A 14 14.479 5.807 -3.173 1.00 10.00 C ATOM 193 CG LEU A 14 13.961 6.505 -1.912 1.00 10.00 C ATOM 194 CD1 LEU A 14 15.119 7.015 -1.065 1.00 10.00 C ATOM 195 CD2 LEU A 14 13.027 7.647 -2.282 1.00 10.00 C ATOM 0 H LEU A 14 16.252 4.537 -1.921 1.00 10.00 H new ATOM 0 HA LEU A 14 13.560 3.916 -2.780 1.00 10.00 H new ATOM 0 HB2 LEU A 14 15.479 6.182 -3.392 1.00 10.00 H new ATOM 0 HB3 LEU A 14 13.842 6.087 -4.012 1.00 10.00 H new ATOM 0 HG LEU A 14 13.402 5.778 -1.323 1.00 10.00 H new ATOM 0 HD11 LEU A 14 14.729 7.507 -0.174 1.00 10.00 H new ATOM 0 HD12 LEU A 14 15.750 6.177 -0.769 1.00 10.00 H new ATOM 0 HD13 LEU A 14 15.708 7.726 -1.644 1.00 10.00 H new ATOM 0 HD21 LEU A 14 12.668 8.132 -1.374 1.00 10.00 H new ATOM 0 HD22 LEU A 14 13.564 8.373 -2.893 1.00 10.00 H new ATOM 0 HD23 LEU A 14 12.179 7.256 -2.844 1.00 10.00 H new ATOM 207 N SER A 15 16.145 3.734 -4.831 1.00 10.00 N ATOM 208 CA SER A 15 16.594 3.200 -6.109 1.00 10.00 C ATOM 209 C SER A 15 16.402 1.686 -6.158 1.00 10.00 C ATOM 210 O SER A 15 16.056 1.123 -7.199 1.00 10.00 O ATOM 211 CB SER A 15 18.062 3.561 -6.331 1.00 10.00 C ATOM 212 OG SER A 15 18.518 4.463 -5.333 1.00 10.00 O ATOM 0 H SER A 15 16.887 4.136 -4.258 1.00 10.00 H new ATOM 0 HA SER A 15 15.995 3.642 -6.905 1.00 10.00 H new ATOM 0 HB2 SER A 15 18.670 2.656 -6.314 1.00 10.00 H new ATOM 0 HB3 SER A 15 18.185 4.010 -7.317 1.00 10.00 H new ATOM 0 HG SER A 15 19.498 4.472 -5.323 1.00 10.00 H new ATOM 218 N GLN A 16 16.610 1.031 -5.015 1.00 10.00 N ATOM 219 CA GLN A 16 16.446 -0.413 -4.913 1.00 10.00 C ATOM 220 C GLN A 16 15.010 -0.801 -5.236 1.00 10.00 C ATOM 221 O GLN A 16 14.766 -1.778 -5.938 1.00 10.00 O ATOM 222 CB GLN A 16 16.813 -0.896 -3.508 1.00 10.00 C ATOM 223 CG GLN A 16 16.850 -2.411 -3.375 1.00 10.00 C ATOM 224 CD GLN A 16 17.964 -3.040 -4.187 1.00 10.00 C ATOM 225 OE1 GLN A 16 19.084 -3.194 -3.709 1.00 10.00 O ATOM 226 NE2 GLN A 16 17.662 -3.414 -5.422 1.00 10.00 N ATOM 0 H GLN A 16 16.893 1.483 -4.146 1.00 10.00 H new ATOM 0 HA GLN A 16 17.114 -0.888 -5.631 1.00 10.00 H new ATOM 0 HB2 GLN A 16 17.788 -0.492 -3.237 1.00 10.00 H new ATOM 0 HB3 GLN A 16 16.093 -0.495 -2.795 1.00 10.00 H new ATOM 0 HG2 GLN A 16 16.976 -2.677 -2.325 1.00 10.00 H new ATOM 0 HG3 GLN A 16 15.894 -2.824 -3.696 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.719 -3.269 -5.783 1.00 10.00 H new ATOM 0 HE22 GLN A 16 18.373 -3.847 -6.012 1.00 10.00 H new ATOM 235 N MET A 17 14.069 -0.013 -4.726 1.00 10.00 N ATOM 236 CA MET A 17 12.650 -0.245 -4.961 1.00 10.00 C ATOM 237 C MET A 17 12.330 -0.065 -6.437 1.00 10.00 C ATOM 238 O MET A 17 11.643 -0.889 -7.042 1.00 10.00 O ATOM 239 CB MET A 17 11.803 0.719 -4.127 1.00 10.00 C ATOM 240 CG MET A 17 11.396 0.165 -2.773 1.00 10.00 C ATOM 241 SD MET A 17 10.268 -1.232 -2.911 1.00 10.00 S ATOM 242 CE MET A 17 9.882 -1.518 -1.187 1.00 10.00 C ATOM 0 H MET A 17 14.268 0.799 -4.142 1.00 10.00 H new ATOM 0 HA MET A 17 12.413 -1.267 -4.664 1.00 10.00 H new ATOM 0 HB2 MET A 17 12.362 1.643 -3.978 1.00 10.00 H new ATOM 0 HB3 MET A 17 10.905 0.977 -4.688 1.00 10.00 H new ATOM 0 HG2 MET A 17 12.288 -0.144 -2.228 1.00 10.00 H new ATOM 0 HG3 MET A 17 10.923 0.954 -2.189 1.00 10.00 H new ATOM 0 HE1 MET A 17 9.190 -2.356 -1.103 1.00 10.00 H new ATOM 0 HE2 MET A 17 10.798 -1.747 -0.642 1.00 10.00 H new ATOM 0 HE3 MET A 17 9.422 -0.625 -0.764 1.00 10.00 H new ATOM 252 N LEU A 18 12.859 1.009 -7.011 1.00 10.00 N ATOM 253 CA LEU A 18 12.649 1.316 -8.417 1.00 10.00 C ATOM 254 C LEU A 18 13.193 0.198 -9.306 1.00 10.00 C ATOM 255 O LEU A 18 12.541 -0.212 -10.266 1.00 10.00 O ATOM 256 CB LEU A 18 13.317 2.646 -8.770 1.00 10.00 C ATOM 257 CG LEU A 18 12.566 3.513 -9.785 1.00 10.00 C ATOM 258 CD1 LEU A 18 11.220 3.950 -9.229 1.00 10.00 C ATOM 259 CD2 LEU A 18 13.400 4.724 -10.168 1.00 10.00 C ATOM 0 H LEU A 18 13.441 1.686 -6.518 1.00 10.00 H new ATOM 0 HA LEU A 18 11.577 1.400 -8.594 1.00 10.00 H new ATOM 0 HB2 LEU A 18 13.448 3.221 -7.853 1.00 10.00 H new ATOM 0 HB3 LEU A 18 14.313 2.440 -9.162 1.00 10.00 H new ATOM 0 HG LEU A 18 12.389 2.916 -10.679 1.00 10.00 H new ATOM 0 HD11 LEU A 18 10.704 4.565 -9.967 1.00 10.00 H new ATOM 0 HD12 LEU A 18 10.617 3.071 -9.003 1.00 10.00 H new ATOM 0 HD13 LEU A 18 11.373 4.528 -8.318 1.00 10.00 H new ATOM 0 HD21 LEU A 18 12.852 5.330 -10.890 1.00 10.00 H new ATOM 0 HD22 LEU A 18 13.608 5.319 -9.279 1.00 10.00 H new ATOM 0 HD23 LEU A 18 14.340 4.393 -10.611 1.00 10.00 H new ATOM 271 N SER A 19 14.379 -0.301 -8.968 1.00 10.00 N ATOM 272 CA SER A 19 15.004 -1.376 -9.734 1.00 10.00 C ATOM 273 C SER A 19 14.325 -2.719 -9.462 1.00 10.00 C ATOM 274 O SER A 19 14.431 -3.650 -10.258 1.00 10.00 O ATOM 275 CB SER A 19 16.496 -1.462 -9.408 1.00 10.00 C ATOM 276 OG SER A 19 17.236 -0.502 -10.146 1.00 10.00 O ATOM 0 H SER A 19 14.926 0.021 -8.170 1.00 10.00 H new ATOM 0 HA SER A 19 14.884 -1.147 -10.793 1.00 10.00 H new ATOM 0 HB2 SER A 19 16.648 -1.301 -8.341 1.00 10.00 H new ATOM 0 HB3 SER A 19 16.864 -2.463 -9.635 1.00 10.00 H new ATOM 0 HG SER A 19 18.186 -0.576 -9.919 1.00 10.00 H new ATOM 282 N MET A 20 13.623 -2.810 -8.341 1.00 10.00 N ATOM 283 CA MET A 20 12.927 -4.039 -7.976 1.00 10.00 C ATOM 284 C MET A 20 11.629 -4.157 -8.762 1.00 10.00 C ATOM 285 O MET A 20 10.978 -5.204 -8.762 1.00 10.00 O ATOM 286 CB MET A 20 12.637 -4.062 -6.476 1.00 10.00 C ATOM 287 CG MET A 20 12.401 -5.459 -5.920 1.00 10.00 C ATOM 288 SD MET A 20 12.083 -5.475 -4.144 1.00 10.00 S ATOM 289 CE MET A 20 13.515 -4.591 -3.524 1.00 10.00 C ATOM 0 H MET A 20 13.520 -2.050 -7.669 1.00 10.00 H new ATOM 0 HA MET A 20 13.567 -4.887 -8.219 1.00 10.00 H new ATOM 0 HB2 MET A 20 13.473 -3.606 -5.946 1.00 10.00 H new ATOM 0 HB3 MET A 20 11.759 -3.448 -6.275 1.00 10.00 H new ATOM 0 HG2 MET A 20 11.555 -5.911 -6.438 1.00 10.00 H new ATOM 0 HG3 MET A 20 13.272 -6.079 -6.132 1.00 10.00 H new ATOM 0 HE1 MET A 20 13.760 -4.951 -2.525 1.00 10.00 H new ATOM 0 HE2 MET A 20 14.363 -4.760 -4.188 1.00 10.00 H new ATOM 0 HE3 MET A 20 13.294 -3.524 -3.482 1.00 10.00 H new ATOM 299 N GLY A 21 11.265 -3.074 -9.432 1.00 10.00 N ATOM 300 CA GLY A 21 10.055 -3.057 -10.219 1.00 10.00 C ATOM 301 C GLY A 21 8.875 -2.546 -9.423 1.00 10.00 C ATOM 302 O GLY A 21 7.731 -2.652 -9.859 1.00 10.00 O ATOM 0 H GLY A 21 11.793 -2.201 -9.443 1.00 10.00 H new ATOM 0 HA2 GLY A 21 10.201 -2.428 -11.097 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.842 -4.063 -10.580 1.00 10.00 H new ATOM 306 N PHE A 22 9.157 -1.985 -8.253 1.00 10.00 N ATOM 307 CA PHE A 22 8.109 -1.455 -7.401 1.00 10.00 C ATOM 308 C PHE A 22 8.057 0.063 -7.498 1.00 10.00 C ATOM 309 O PHE A 22 9.037 0.767 -7.233 1.00 10.00 O ATOM 310 CB PHE A 22 8.314 -1.878 -5.942 1.00 10.00 C ATOM 311 CG PHE A 22 7.877 -3.287 -5.660 1.00 10.00 C ATOM 312 CD1 PHE A 22 6.541 -3.574 -5.423 1.00 10.00 C ATOM 313 CD2 PHE A 22 8.797 -4.320 -5.629 1.00 10.00 C ATOM 314 CE1 PHE A 22 6.134 -4.869 -5.160 1.00 10.00 C ATOM 315 CE2 PHE A 22 8.397 -5.614 -5.366 1.00 10.00 C ATOM 316 CZ PHE A 22 7.064 -5.890 -5.132 1.00 10.00 C ATOM 0 H PHE A 22 10.100 -1.887 -7.877 1.00 10.00 H new ATOM 0 HA PHE A 22 7.161 -1.866 -7.748 1.00 10.00 H new ATOM 0 HB2 PHE A 22 9.369 -1.775 -5.687 1.00 10.00 H new ATOM 0 HB3 PHE A 22 7.761 -1.198 -5.294 1.00 10.00 H new ATOM 0 HD1 PHE A 22 5.811 -2.778 -5.444 1.00 10.00 H new ATOM 0 HD2 PHE A 22 9.841 -4.111 -5.813 1.00 10.00 H new ATOM 0 HE1 PHE A 22 5.091 -5.082 -4.977 1.00 10.00 H new ATOM 0 HE2 PHE A 22 9.126 -6.411 -5.343 1.00 10.00 H new ATOM 0 HZ PHE A 22 6.749 -6.903 -4.927 1.00 10.00 H new ATOM 326 N SER A 23 6.901 0.554 -7.894 1.00 10.00 N ATOM 327 CA SER A 23 6.663 1.977 -8.034 1.00 10.00 C ATOM 328 C SER A 23 5.164 2.229 -7.944 1.00 10.00 C ATOM 329 O SER A 23 4.368 1.449 -8.472 1.00 10.00 O ATOM 330 CB SER A 23 7.195 2.489 -9.375 1.00 10.00 C ATOM 331 OG SER A 23 8.490 1.980 -9.657 1.00 10.00 O ATOM 0 H SER A 23 6.095 -0.025 -8.129 1.00 10.00 H new ATOM 0 HA SER A 23 7.185 2.509 -7.239 1.00 10.00 H new ATOM 0 HB2 SER A 23 6.510 2.201 -10.172 1.00 10.00 H new ATOM 0 HB3 SER A 23 7.228 3.578 -9.361 1.00 10.00 H new ATOM 0 HG SER A 23 8.797 2.327 -10.521 1.00 10.00 H new ATOM 337 N ASP A 24 4.770 3.293 -7.271 1.00 10.00 N ATOM 338 CA ASP A 24 3.357 3.608 -7.133 1.00 10.00 C ATOM 339 C ASP A 24 3.004 4.827 -7.991 1.00 10.00 C ATOM 340 O ASP A 24 3.897 5.524 -8.478 1.00 10.00 O ATOM 341 CB ASP A 24 2.996 3.789 -5.652 1.00 10.00 C ATOM 342 CG ASP A 24 2.968 5.223 -5.202 1.00 10.00 C ATOM 343 OD1 ASP A 24 1.904 5.847 -5.317 1.00 10.00 O ATOM 344 OD2 ASP A 24 3.989 5.722 -4.689 1.00 10.00 O ATOM 0 H ASP A 24 5.401 3.951 -6.814 1.00 10.00 H new ATOM 0 HA ASP A 24 2.754 2.778 -7.502 1.00 10.00 H new ATOM 0 HB2 ASP A 24 2.019 3.342 -5.469 1.00 10.00 H new ATOM 0 HB3 ASP A 24 3.716 3.242 -5.043 1.00 10.00 H new ATOM 349 N GLU A 25 1.716 5.066 -8.199 1.00 10.00 N ATOM 350 CA GLU A 25 1.269 6.171 -9.050 1.00 10.00 C ATOM 351 C GLU A 25 0.462 7.231 -8.301 1.00 10.00 C ATOM 352 O GLU A 25 -0.034 8.179 -8.912 1.00 10.00 O ATOM 353 CB GLU A 25 0.432 5.623 -10.214 1.00 10.00 C ATOM 354 CG GLU A 25 0.176 4.121 -10.149 1.00 10.00 C ATOM 355 CD GLU A 25 -0.858 3.732 -9.107 1.00 10.00 C ATOM 356 OE1 GLU A 25 -0.476 3.481 -7.939 1.00 10.00 O ATOM 357 OE2 GLU A 25 -2.056 3.657 -9.451 1.00 10.00 O ATOM 0 H GLU A 25 0.961 4.513 -7.793 1.00 10.00 H new ATOM 0 HA GLU A 25 2.171 6.662 -9.417 1.00 10.00 H new ATOM 0 HB2 GLU A 25 -0.526 6.143 -10.234 1.00 10.00 H new ATOM 0 HB3 GLU A 25 0.939 5.853 -11.151 1.00 10.00 H new ATOM 0 HG2 GLU A 25 -0.156 3.773 -11.127 1.00 10.00 H new ATOM 0 HG3 GLU A 25 1.113 3.609 -9.930 1.00 10.00 H new ATOM 364 N GLY A 26 0.331 7.091 -6.998 1.00 10.00 N ATOM 365 CA GLY A 26 -0.432 8.062 -6.245 1.00 10.00 C ATOM 366 C GLY A 26 0.409 8.785 -5.220 1.00 10.00 C ATOM 367 O GLY A 26 -0.060 9.718 -4.569 1.00 10.00 O ATOM 0 H GLY A 26 0.733 6.332 -6.449 1.00 10.00 H new ATOM 0 HA2 GLY A 26 -0.868 8.788 -6.931 1.00 10.00 H new ATOM 0 HA3 GLY A 26 -1.259 7.560 -5.743 1.00 10.00 H new ATOM 371 N GLY A 27 1.650 8.354 -5.082 1.00 10.00 N ATOM 372 CA GLY A 27 2.553 8.948 -4.128 1.00 10.00 C ATOM 373 C GLY A 27 2.351 8.348 -2.758 1.00 10.00 C ATOM 374 O GLY A 27 2.560 9.007 -1.741 1.00 10.00 O ATOM 0 H GLY A 27 2.052 7.590 -5.625 1.00 10.00 H new ATOM 0 HA2 GLY A 27 3.583 8.794 -4.450 1.00 10.00 H new ATOM 0 HA3 GLY A 27 2.390 10.025 -4.087 1.00 10.00 H new ATOM 378 N TRP A 28 1.907 7.094 -2.731 1.00 10.00 N ATOM 379 CA TRP A 28 1.649 6.413 -1.473 1.00 10.00 C ATOM 380 C TRP A 28 2.822 5.532 -1.037 1.00 10.00 C ATOM 381 O TRP A 28 3.055 5.357 0.158 1.00 10.00 O ATOM 382 CB TRP A 28 0.337 5.610 -1.533 1.00 10.00 C ATOM 383 CG TRP A 28 0.337 4.429 -2.458 1.00 10.00 C ATOM 384 CD1 TRP A 28 -0.119 4.397 -3.744 1.00 10.00 C ATOM 385 CD2 TRP A 28 0.778 3.099 -2.160 1.00 10.00 C ATOM 386 NE1 TRP A 28 0.031 3.138 -4.269 1.00 10.00 N ATOM 387 CE2 TRP A 28 0.578 2.320 -3.316 1.00 10.00 C ATOM 388 CE3 TRP A 28 1.333 2.492 -1.030 1.00 10.00 C ATOM 389 CZ2 TRP A 28 0.911 0.969 -3.372 1.00 10.00 C ATOM 390 CZ3 TRP A 28 1.664 1.150 -1.086 1.00 10.00 C ATOM 391 CH2 TRP A 28 1.452 0.399 -2.249 1.00 10.00 C ATOM 0 H TRP A 28 1.720 6.534 -3.563 1.00 10.00 H new ATOM 0 HA TRP A 28 1.536 7.185 -0.712 1.00 10.00 H new ATOM 0 HB2 TRP A 28 0.100 5.261 -0.528 1.00 10.00 H new ATOM 0 HB3 TRP A 28 -0.466 6.283 -1.834 1.00 10.00 H new ATOM 0 HD1 TRP A 28 -0.538 5.241 -4.272 1.00 10.00 H new ATOM 0 HE1 TRP A 28 -0.224 2.857 -5.216 1.00 10.00 H new ATOM 0 HE3 TRP A 28 1.501 3.061 -0.128 1.00 10.00 H new ATOM 0 HZ2 TRP A 28 0.749 0.390 -4.269 1.00 10.00 H new ATOM 0 HZ3 TRP A 28 2.094 0.673 -0.217 1.00 10.00 H new ATOM 0 HH2 TRP A 28 1.719 -0.647 -2.261 1.00 10.00 H new ATOM 402 N LEU A 29 3.586 5.003 -1.992 1.00 10.00 N ATOM 403 CA LEU A 29 4.721 4.146 -1.661 1.00 10.00 C ATOM 404 C LEU A 29 5.853 4.989 -1.091 1.00 10.00 C ATOM 405 O LEU A 29 6.540 4.578 -0.156 1.00 10.00 O ATOM 406 CB LEU A 29 5.201 3.364 -2.886 1.00 10.00 C ATOM 407 CG LEU A 29 6.346 2.377 -2.625 1.00 10.00 C ATOM 408 CD1 LEU A 29 5.882 1.242 -1.724 1.00 10.00 C ATOM 409 CD2 LEU A 29 6.891 1.832 -3.936 1.00 10.00 C ATOM 0 H LEU A 29 3.441 5.151 -2.991 1.00 10.00 H new ATOM 0 HA LEU A 29 4.399 3.423 -0.912 1.00 10.00 H new ATOM 0 HB2 LEU A 29 4.356 2.814 -3.300 1.00 10.00 H new ATOM 0 HB3 LEU A 29 5.522 4.075 -3.648 1.00 10.00 H new ATOM 0 HG LEU A 29 7.148 2.911 -2.115 1.00 10.00 H new ATOM 0 HD11 LEU A 29 6.709 0.553 -1.551 1.00 10.00 H new ATOM 0 HD12 LEU A 29 5.544 1.649 -0.771 1.00 10.00 H new ATOM 0 HD13 LEU A 29 5.060 0.710 -2.203 1.00 10.00 H new ATOM 0 HD21 LEU A 29 7.702 1.134 -3.730 1.00 10.00 H new ATOM 0 HD22 LEU A 29 6.096 1.316 -4.474 1.00 10.00 H new ATOM 0 HD23 LEU A 29 7.266 2.655 -4.544 1.00 10.00 H new ATOM 421 N THR A 30 6.020 6.186 -1.641 1.00 10.00 N ATOM 422 CA THR A 30 7.053 7.098 -1.175 1.00 10.00 C ATOM 423 C THR A 30 6.743 7.560 0.251 1.00 10.00 C ATOM 424 O THR A 30 7.626 7.992 0.992 1.00 10.00 O ATOM 425 CB THR A 30 7.198 8.319 -2.125 1.00 10.00 C ATOM 426 OG1 THR A 30 8.396 9.047 -1.825 1.00 10.00 O ATOM 427 CG2 THR A 30 6.000 9.252 -2.024 1.00 10.00 C ATOM 0 H THR A 30 5.453 6.546 -2.409 1.00 10.00 H new ATOM 0 HA THR A 30 8.003 6.564 -1.175 1.00 10.00 H new ATOM 0 HB THR A 30 7.250 7.934 -3.144 1.00 10.00 H new ATOM 0 HG1 THR A 30 8.475 9.812 -2.432 1.00 10.00 H new ATOM 0 HG21 THR A 30 6.137 10.094 -2.702 1.00 10.00 H new ATOM 0 HG22 THR A 30 5.094 8.711 -2.295 1.00 10.00 H new ATOM 0 HG23 THR A 30 5.911 9.620 -1.002 1.00 10.00 H new ATOM 435 N ARG A 31 5.478 7.428 0.635 1.00 10.00 N ATOM 436 CA ARG A 31 5.033 7.810 1.963 1.00 10.00 C ATOM 437 C ARG A 31 5.129 6.617 2.905 1.00 10.00 C ATOM 438 O ARG A 31 5.372 6.773 4.099 1.00 10.00 O ATOM 439 CB ARG A 31 3.602 8.342 1.913 1.00 10.00 C ATOM 440 CG ARG A 31 3.489 9.675 1.188 1.00 10.00 C ATOM 441 CD ARG A 31 3.185 10.815 2.149 1.00 10.00 C ATOM 442 NE ARG A 31 1.785 10.807 2.565 1.00 10.00 N ATOM 443 CZ ARG A 31 0.850 11.599 2.046 1.00 10.00 C ATOM 444 NH1 ARG A 31 1.162 12.464 1.088 1.00 10.00 N ATOM 445 NH2 ARG A 31 -0.398 11.519 2.486 1.00 10.00 N ATOM 0 H ARG A 31 4.740 7.056 0.037 1.00 10.00 H new ATOM 0 HA ARG A 31 5.679 8.604 2.337 1.00 10.00 H new ATOM 0 HB2 ARG A 31 2.965 7.610 1.417 1.00 10.00 H new ATOM 0 HB3 ARG A 31 3.226 8.455 2.930 1.00 10.00 H new ATOM 0 HG2 ARG A 31 4.420 9.882 0.661 1.00 10.00 H new ATOM 0 HG3 ARG A 31 2.703 9.614 0.435 1.00 10.00 H new ATOM 0 HD2 ARG A 31 3.827 10.733 3.026 1.00 10.00 H new ATOM 0 HD3 ARG A 31 3.418 11.767 1.671 1.00 10.00 H new ATOM 0 HE ARG A 31 1.507 10.155 3.298 1.00 10.00 H new ATOM 0 HH11 ARG A 31 2.122 12.523 0.747 1.00 10.00 H new ATOM 0 HH12 ARG A 31 0.442 13.069 0.693 1.00 10.00 H new ATOM 0 HH21 ARG A 31 -0.638 10.852 3.220 1.00 10.00 H new ATOM 0 HH22 ARG A 31 -1.118 12.124 2.091 1.00 10.00 H new ATOM 459 N LEU A 32 4.945 5.420 2.351 1.00 10.00 N ATOM 460 CA LEU A 32 5.028 4.194 3.131 1.00 10.00 C ATOM 461 C LEU A 32 6.449 3.994 3.643 1.00 10.00 C ATOM 462 O LEU A 32 6.665 3.436 4.720 1.00 10.00 O ATOM 463 CB LEU A 32 4.586 2.991 2.292 1.00 10.00 C ATOM 464 CG LEU A 32 4.379 1.691 3.074 1.00 10.00 C ATOM 465 CD1 LEU A 32 3.278 1.861 4.105 1.00 10.00 C ATOM 466 CD2 LEU A 32 4.046 0.544 2.130 1.00 10.00 C ATOM 0 H LEU A 32 4.737 5.277 1.363 1.00 10.00 H new ATOM 0 HA LEU A 32 4.357 4.279 3.986 1.00 10.00 H new ATOM 0 HB2 LEU A 32 3.654 3.244 1.786 1.00 10.00 H new ATOM 0 HB3 LEU A 32 5.332 2.815 1.517 1.00 10.00 H new ATOM 0 HG LEU A 32 5.308 1.453 3.592 1.00 10.00 H new ATOM 0 HD11 LEU A 32 3.144 0.928 4.652 1.00 10.00 H new ATOM 0 HD12 LEU A 32 3.551 2.654 4.802 1.00 10.00 H new ATOM 0 HD13 LEU A 32 2.347 2.124 3.603 1.00 10.00 H new ATOM 0 HD21 LEU A 32 3.903 -0.371 2.705 1.00 10.00 H new ATOM 0 HD22 LEU A 32 3.132 0.776 1.584 1.00 10.00 H new ATOM 0 HD23 LEU A 32 4.865 0.404 1.424 1.00 10.00 H new ATOM 478 N LEU A 33 7.412 4.490 2.874 1.00 10.00 N ATOM 479 CA LEU A 33 8.821 4.397 3.237 1.00 10.00 C ATOM 480 C LEU A 33 9.125 5.317 4.417 1.00 10.00 C ATOM 481 O LEU A 33 10.203 5.265 5.002 1.00 10.00 O ATOM 482 CB LEU A 33 9.698 4.769 2.045 1.00 10.00 C ATOM 483 CG LEU A 33 9.740 3.737 0.913 1.00 10.00 C ATOM 484 CD1 LEU A 33 10.401 4.331 -0.324 1.00 10.00 C ATOM 485 CD2 LEU A 33 10.479 2.480 1.359 1.00 10.00 C ATOM 0 H LEU A 33 7.240 4.965 1.988 1.00 10.00 H new ATOM 0 HA LEU A 33 9.038 3.369 3.528 1.00 10.00 H new ATOM 0 HB2 LEU A 33 9.345 5.716 1.637 1.00 10.00 H new ATOM 0 HB3 LEU A 33 10.715 4.934 2.401 1.00 10.00 H new ATOM 0 HG LEU A 33 8.716 3.462 0.661 1.00 10.00 H new ATOM 0 HD11 LEU A 33 10.423 3.585 -1.119 1.00 10.00 H new ATOM 0 HD12 LEU A 33 9.834 5.200 -0.658 1.00 10.00 H new ATOM 0 HD13 LEU A 33 11.420 4.633 -0.082 1.00 10.00 H new ATOM 0 HD21 LEU A 33 10.498 1.760 0.541 1.00 10.00 H new ATOM 0 HD22 LEU A 33 11.500 2.738 1.639 1.00 10.00 H new ATOM 0 HD23 LEU A 33 9.968 2.042 2.216 1.00 10.00 H new ATOM 497 N GLN A 34 8.172 6.178 4.744 1.00 10.00 N ATOM 498 CA GLN A 34 8.325 7.097 5.859 1.00 10.00 C ATOM 499 C GLN A 34 7.693 6.495 7.105 1.00 10.00 C ATOM 500 O GLN A 34 8.185 6.679 8.217 1.00 10.00 O ATOM 501 CB GLN A 34 7.682 8.448 5.539 1.00 10.00 C ATOM 502 CG GLN A 34 8.029 8.980 4.156 1.00 10.00 C ATOM 503 CD GLN A 34 9.524 9.114 3.933 1.00 10.00 C ATOM 504 OE1 GLN A 34 10.276 9.429 4.855 1.00 10.00 O ATOM 505 NE2 GLN A 34 9.960 8.876 2.705 1.00 10.00 N ATOM 0 H GLN A 34 7.283 6.258 4.251 1.00 10.00 H new ATOM 0 HA GLN A 34 9.388 7.261 6.037 1.00 10.00 H new ATOM 0 HB2 GLN A 34 6.599 8.353 5.621 1.00 10.00 H new ATOM 0 HB3 GLN A 34 7.996 9.176 6.287 1.00 10.00 H new ATOM 0 HG2 GLN A 34 7.612 8.314 3.401 1.00 10.00 H new ATOM 0 HG3 GLN A 34 7.557 9.953 4.018 1.00 10.00 H new ATOM 0 HE21 GLN A 34 9.301 8.618 1.971 1.00 10.00 H new ATOM 0 HE22 GLN A 34 10.955 8.951 2.494 1.00 10.00 H new ATOM 514 N THR A 35 6.606 5.762 6.904 1.00 10.00 N ATOM 515 CA THR A 35 5.895 5.130 8.004 1.00 10.00 C ATOM 516 C THR A 35 6.606 3.855 8.456 1.00 10.00 C ATOM 517 O THR A 35 6.878 3.669 9.644 1.00 10.00 O ATOM 518 CB THR A 35 4.450 4.783 7.601 1.00 10.00 C ATOM 519 OG1 THR A 35 4.016 5.651 6.544 1.00 10.00 O ATOM 520 CG2 THR A 35 3.509 4.911 8.791 1.00 10.00 C ATOM 0 H THR A 35 6.197 5.591 5.985 1.00 10.00 H new ATOM 0 HA THR A 35 5.877 5.843 8.828 1.00 10.00 H new ATOM 0 HB THR A 35 4.430 3.750 7.254 1.00 10.00 H new ATOM 0 HG1 THR A 35 3.097 5.424 6.291 1.00 10.00 H new ATOM 0 HG21 THR A 35 2.494 4.661 8.481 1.00 10.00 H new ATOM 0 HG22 THR A 35 3.826 4.229 9.580 1.00 10.00 H new ATOM 0 HG23 THR A 35 3.532 5.935 9.165 1.00 10.00 H new ATOM 528 N LYS A 36 6.930 2.995 7.495 1.00 10.00 N ATOM 529 CA LYS A 36 7.590 1.725 7.781 1.00 10.00 C ATOM 530 C LYS A 36 9.106 1.862 7.726 1.00 10.00 C ATOM 531 O LYS A 36 9.826 0.864 7.839 1.00 10.00 O ATOM 532 CB LYS A 36 7.140 0.662 6.773 1.00 10.00 C ATOM 533 CG LYS A 36 6.161 -0.353 7.344 1.00 10.00 C ATOM 534 CD LYS A 36 4.777 0.245 7.536 1.00 10.00 C ATOM 535 CE LYS A 36 3.809 -0.773 8.123 1.00 10.00 C ATOM 536 NZ LYS A 36 4.197 -1.182 9.502 1.00 10.00 N ATOM 0 H LYS A 36 6.745 3.156 6.505 1.00 10.00 H new ATOM 0 HA LYS A 36 7.307 1.423 8.789 1.00 10.00 H new ATOM 0 HB2 LYS A 36 6.678 1.157 5.919 1.00 10.00 H new ATOM 0 HB3 LYS A 36 8.018 0.135 6.399 1.00 10.00 H new ATOM 0 HG2 LYS A 36 6.097 -1.212 6.676 1.00 10.00 H new ATOM 0 HG3 LYS A 36 6.534 -0.720 8.300 1.00 10.00 H new ATOM 0 HD2 LYS A 36 4.841 1.111 8.195 1.00 10.00 H new ATOM 0 HD3 LYS A 36 4.397 0.601 6.579 1.00 10.00 H new ATOM 0 HE2 LYS A 36 2.804 -0.350 8.139 1.00 10.00 H new ATOM 0 HE3 LYS A 36 3.774 -1.653 7.480 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 3.416 -1.711 9.940 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 5.043 -1.785 9.460 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 4.403 -0.336 10.070 1.00 10.00 H new ATOM 550 N ASN A 37 9.581 3.097 7.558 1.00 10.00 N ATOM 551 CA ASN A 37 11.017 3.384 7.469 1.00 10.00 C ATOM 552 C ASN A 37 11.570 2.839 6.152 1.00 10.00 C ATOM 553 O ASN A 37 10.865 2.159 5.405 1.00 10.00 O ATOM 554 CB ASN A 37 11.776 2.778 8.663 1.00 10.00 C ATOM 555 CG ASN A 37 13.039 3.544 9.033 1.00 10.00 C ATOM 556 OD1 ASN A 37 13.641 4.230 8.204 1.00 10.00 O ATOM 557 ND2 ASN A 37 13.457 3.423 10.281 1.00 10.00 N ATOM 0 H ASN A 37 8.987 3.923 7.480 1.00 10.00 H new ATOM 0 HA ASN A 37 11.159 4.464 7.498 1.00 10.00 H new ATOM 0 HB2 ASN A 37 11.113 2.748 9.527 1.00 10.00 H new ATOM 0 HB3 ASN A 37 12.041 1.747 8.429 1.00 10.00 H new ATOM 0 HD21 ASN A 37 14.303 3.906 10.585 1.00 10.00 H new ATOM 0 HD22 ASN A 37 12.934 2.847 10.940 1.00 10.00 H new ATOM 564 N TYR A 38 12.826 3.133 5.864 1.00 10.00 N ATOM 565 CA TYR A 38 13.452 2.671 4.635 1.00 10.00 C ATOM 566 C TYR A 38 13.955 1.237 4.792 1.00 10.00 C ATOM 567 O TYR A 38 15.082 0.910 4.418 1.00 10.00 O ATOM 568 CB TYR A 38 14.597 3.608 4.240 1.00 10.00 C ATOM 569 CG TYR A 38 14.124 4.954 3.727 1.00 10.00 C ATOM 570 CD1 TYR A 38 13.636 5.092 2.434 1.00 10.00 C ATOM 571 CD2 TYR A 38 14.161 6.086 4.538 1.00 10.00 C ATOM 572 CE1 TYR A 38 13.199 6.314 1.958 1.00 10.00 C ATOM 573 CE2 TYR A 38 13.725 7.313 4.069 1.00 10.00 C ATOM 574 CZ TYR A 38 13.244 7.421 2.779 1.00 10.00 C ATOM 575 OH TYR A 38 12.806 8.642 2.311 1.00 10.00 O ATOM 0 H TYR A 38 13.434 3.690 6.464 1.00 10.00 H new ATOM 0 HA TYR A 38 12.707 2.682 3.840 1.00 10.00 H new ATOM 0 HB2 TYR A 38 15.244 3.763 5.104 1.00 10.00 H new ATOM 0 HB3 TYR A 38 15.202 3.127 3.471 1.00 10.00 H new ATOM 0 HD1 TYR A 38 13.597 4.228 1.788 1.00 10.00 H new ATOM 0 HD2 TYR A 38 14.535 6.005 5.548 1.00 10.00 H new ATOM 0 HE1 TYR A 38 12.824 6.401 0.949 1.00 10.00 H new ATOM 0 HE2 TYR A 38 13.761 8.182 4.709 1.00 10.00 H new ATOM 0 HH TYR A 38 12.904 9.317 3.015 1.00 10.00 H new ATOM 585 N ASP A 39 13.098 0.387 5.345 1.00 10.00 N ATOM 586 CA ASP A 39 13.426 -1.014 5.558 1.00 10.00 C ATOM 587 C ASP A 39 12.833 -1.848 4.433 1.00 10.00 C ATOM 588 O ASP A 39 11.630 -2.123 4.420 1.00 10.00 O ATOM 589 CB ASP A 39 12.888 -1.500 6.907 1.00 10.00 C ATOM 590 CG ASP A 39 13.593 -2.748 7.406 1.00 10.00 C ATOM 591 OD1 ASP A 39 13.209 -3.867 6.994 1.00 10.00 O ATOM 592 OD2 ASP A 39 14.531 -2.616 8.220 1.00 10.00 O ATOM 0 H ASP A 39 12.163 0.649 5.656 1.00 10.00 H new ATOM 0 HA ASP A 39 14.510 -1.123 5.564 1.00 10.00 H new ATOM 0 HB2 ASP A 39 12.999 -0.706 7.645 1.00 10.00 H new ATOM 0 HB3 ASP A 39 11.821 -1.703 6.816 1.00 10.00 H new ATOM 597 N ILE A 40 13.681 -2.235 3.492 1.00 10.00 N ATOM 598 CA ILE A 40 13.262 -3.021 2.336 1.00 10.00 C ATOM 599 C ILE A 40 12.615 -4.340 2.759 1.00 10.00 C ATOM 600 O ILE A 40 11.592 -4.747 2.203 1.00 10.00 O ATOM 601 CB ILE A 40 14.460 -3.312 1.399 1.00 10.00 C ATOM 602 CG1 ILE A 40 15.197 -2.012 1.058 1.00 10.00 C ATOM 603 CG2 ILE A 40 13.992 -4.007 0.125 1.00 10.00 C ATOM 604 CD1 ILE A 40 16.604 -2.229 0.532 1.00 10.00 C ATOM 0 H ILE A 40 14.677 -2.015 3.506 1.00 10.00 H new ATOM 0 HA ILE A 40 12.523 -2.427 1.798 1.00 10.00 H new ATOM 0 HB ILE A 40 15.149 -3.978 1.919 1.00 10.00 H new ATOM 0 HG12 ILE A 40 14.621 -1.463 0.313 1.00 10.00 H new ATOM 0 HG13 ILE A 40 15.244 -1.387 1.950 1.00 10.00 H new ATOM 0 HG21 ILE A 40 14.849 -4.202 -0.519 1.00 10.00 H new ATOM 0 HG22 ILE A 40 13.509 -4.950 0.381 1.00 10.00 H new ATOM 0 HG23 ILE A 40 13.283 -3.367 -0.399 1.00 10.00 H new ATOM 0 HD11 ILE A 40 17.063 -1.265 0.312 1.00 10.00 H new ATOM 0 HD12 ILE A 40 17.197 -2.751 1.283 1.00 10.00 H new ATOM 0 HD13 ILE A 40 16.564 -2.827 -0.378 1.00 10.00 H new ATOM 616 N GLY A 41 13.195 -4.984 3.767 1.00 10.00 N ATOM 617 CA GLY A 41 12.674 -6.252 4.242 1.00 10.00 C ATOM 618 C GLY A 41 11.273 -6.138 4.813 1.00 10.00 C ATOM 619 O GLY A 41 10.374 -6.894 4.430 1.00 10.00 O ATOM 0 H GLY A 41 14.020 -4.648 4.265 1.00 10.00 H new ATOM 0 HA2 GLY A 41 12.669 -6.968 3.420 1.00 10.00 H new ATOM 0 HA3 GLY A 41 13.341 -6.650 5.007 1.00 10.00 H new ATOM 623 N ALA A 42 11.079 -5.187 5.722 1.00 10.00 N ATOM 624 CA ALA A 42 9.776 -4.978 6.346 1.00 10.00 C ATOM 625 C ALA A 42 8.731 -4.563 5.317 1.00 10.00 C ATOM 626 O ALA A 42 7.594 -5.035 5.360 1.00 10.00 O ATOM 627 CB ALA A 42 9.871 -3.933 7.449 1.00 10.00 C ATOM 0 H ALA A 42 11.807 -4.549 6.043 1.00 10.00 H new ATOM 0 HA ALA A 42 9.463 -5.925 6.785 1.00 10.00 H new ATOM 0 HB1 ALA A 42 8.890 -3.792 7.902 1.00 10.00 H new ATOM 0 HB2 ALA A 42 10.576 -4.269 8.209 1.00 10.00 H new ATOM 0 HB3 ALA A 42 10.215 -2.989 7.027 1.00 10.00 H new ATOM 633 N ALA A 43 9.123 -3.690 4.393 1.00 10.00 N ATOM 634 CA ALA A 43 8.218 -3.205 3.352 1.00 10.00 C ATOM 635 C ALA A 43 7.653 -4.351 2.516 1.00 10.00 C ATOM 636 O ALA A 43 6.444 -4.438 2.312 1.00 10.00 O ATOM 637 CB ALA A 43 8.938 -2.206 2.459 1.00 10.00 C ATOM 0 H ALA A 43 10.065 -3.302 4.343 1.00 10.00 H new ATOM 0 HA ALA A 43 7.379 -2.711 3.843 1.00 10.00 H new ATOM 0 HB1 ALA A 43 8.256 -1.851 1.687 1.00 10.00 H new ATOM 0 HB2 ALA A 43 9.279 -1.362 3.058 1.00 10.00 H new ATOM 0 HB3 ALA A 43 9.796 -2.689 1.991 1.00 10.00 H new ATOM 643 N LEU A 44 8.529 -5.240 2.061 1.00 10.00 N ATOM 644 CA LEU A 44 8.116 -6.377 1.236 1.00 10.00 C ATOM 645 C LEU A 44 7.177 -7.311 2.000 1.00 10.00 C ATOM 646 O LEU A 44 6.219 -7.847 1.439 1.00 10.00 O ATOM 647 CB LEU A 44 9.346 -7.153 0.755 1.00 10.00 C ATOM 648 CG LEU A 44 9.737 -6.910 -0.706 1.00 10.00 C ATOM 649 CD1 LEU A 44 10.100 -5.450 -0.938 1.00 10.00 C ATOM 650 CD2 LEU A 44 10.893 -7.811 -1.106 1.00 10.00 C ATOM 0 H LEU A 44 9.531 -5.198 2.248 1.00 10.00 H new ATOM 0 HA LEU A 44 7.575 -5.985 0.375 1.00 10.00 H new ATOM 0 HB2 LEU A 44 10.193 -6.891 1.390 1.00 10.00 H new ATOM 0 HB3 LEU A 44 9.161 -8.218 0.893 1.00 10.00 H new ATOM 0 HG LEU A 44 8.875 -7.150 -1.329 1.00 10.00 H new ATOM 0 HD11 LEU A 44 10.374 -5.305 -1.983 1.00 10.00 H new ATOM 0 HD12 LEU A 44 9.244 -4.819 -0.696 1.00 10.00 H new ATOM 0 HD13 LEU A 44 10.942 -5.179 -0.301 1.00 10.00 H new ATOM 0 HD21 LEU A 44 11.157 -7.624 -2.147 1.00 10.00 H new ATOM 0 HD22 LEU A 44 11.754 -7.602 -0.471 1.00 10.00 H new ATOM 0 HD23 LEU A 44 10.599 -8.854 -0.988 1.00 10.00 H new ATOM 662 N ASP A 45 7.438 -7.471 3.290 1.00 10.00 N ATOM 663 CA ASP A 45 6.634 -8.351 4.141 1.00 10.00 C ATOM 664 C ASP A 45 5.295 -7.702 4.518 1.00 10.00 C ATOM 665 O ASP A 45 4.417 -8.346 5.091 1.00 10.00 O ATOM 666 CB ASP A 45 7.425 -8.712 5.402 1.00 10.00 C ATOM 667 CG ASP A 45 6.830 -9.882 6.170 1.00 10.00 C ATOM 668 OD1 ASP A 45 6.106 -10.704 5.569 1.00 10.00 O ATOM 669 OD2 ASP A 45 7.098 -9.991 7.386 1.00 10.00 O ATOM 0 H ASP A 45 8.203 -7.003 3.776 1.00 10.00 H new ATOM 0 HA ASP A 45 6.412 -9.258 3.579 1.00 10.00 H new ATOM 0 HB2 ASP A 45 8.451 -8.953 5.123 1.00 10.00 H new ATOM 0 HB3 ASP A 45 7.469 -7.841 6.056 1.00 10.00 H new ATOM 674 N THR A 46 5.135 -6.432 4.179 1.00 10.00 N ATOM 675 CA THR A 46 3.906 -5.708 4.492 1.00 10.00 C ATOM 676 C THR A 46 2.800 -5.991 3.467 1.00 10.00 C ATOM 677 O THR A 46 1.614 -5.893 3.783 1.00 10.00 O ATOM 678 CB THR A 46 4.169 -4.187 4.577 1.00 10.00 C ATOM 679 OG1 THR A 46 5.236 -3.939 5.504 1.00 10.00 O ATOM 680 CG2 THR A 46 2.927 -3.426 5.029 1.00 10.00 C ATOM 0 H THR A 46 5.838 -5.879 3.688 1.00 10.00 H new ATOM 0 HA THR A 46 3.564 -6.065 5.464 1.00 10.00 H new ATOM 0 HB THR A 46 4.439 -3.837 3.581 1.00 10.00 H new ATOM 0 HG1 THR A 46 6.089 -4.205 5.100 1.00 10.00 H new ATOM 0 HG21 THR A 46 3.151 -2.360 5.077 1.00 10.00 H new ATOM 0 HG22 THR A 46 2.118 -3.595 4.319 1.00 10.00 H new ATOM 0 HG23 THR A 46 2.624 -3.778 6.015 1.00 10.00 H new ATOM 688 N ILE A 47 3.180 -6.369 2.252 1.00 10.00 N ATOM 689 CA ILE A 47 2.193 -6.636 1.212 1.00 10.00 C ATOM 690 C ILE A 47 2.203 -8.101 0.785 1.00 10.00 C ATOM 691 O ILE A 47 1.700 -8.438 -0.289 1.00 10.00 O ATOM 692 CB ILE A 47 2.417 -5.742 -0.026 1.00 10.00 C ATOM 693 CG1 ILE A 47 3.854 -5.881 -0.540 1.00 10.00 C ATOM 694 CG2 ILE A 47 2.097 -4.289 0.311 1.00 10.00 C ATOM 695 CD1 ILE A 47 4.051 -5.324 -1.932 1.00 10.00 C ATOM 0 H ILE A 47 4.150 -6.496 1.965 1.00 10.00 H new ATOM 0 HA ILE A 47 1.220 -6.404 1.645 1.00 10.00 H new ATOM 0 HB ILE A 47 1.745 -6.068 -0.819 1.00 10.00 H new ATOM 0 HG12 ILE A 47 4.529 -5.370 0.147 1.00 10.00 H new ATOM 0 HG13 ILE A 47 4.133 -6.935 -0.536 1.00 10.00 H new ATOM 0 HG21 ILE A 47 2.259 -3.667 -0.570 1.00 10.00 H new ATOM 0 HG22 ILE A 47 1.056 -4.209 0.626 1.00 10.00 H new ATOM 0 HG23 ILE A 47 2.747 -3.951 1.118 1.00 10.00 H new ATOM 0 HD11 ILE A 47 5.090 -5.455 -2.233 1.00 10.00 H new ATOM 0 HD12 ILE A 47 3.402 -5.852 -2.630 1.00 10.00 H new ATOM 0 HD13 ILE A 47 3.803 -4.263 -1.938 1.00 10.00 H new ATOM 707 N GLN A 48 2.784 -8.962 1.632 1.00 10.00 N ATOM 708 CA GLN A 48 2.868 -10.412 1.381 1.00 10.00 C ATOM 709 C GLN A 48 3.856 -10.753 0.262 1.00 10.00 C ATOM 710 O GLN A 48 4.715 -11.620 0.432 1.00 10.00 O ATOM 711 CB GLN A 48 1.487 -11.001 1.059 1.00 10.00 C ATOM 712 CG GLN A 48 1.236 -12.350 1.714 1.00 10.00 C ATOM 713 CD GLN A 48 1.951 -13.487 1.016 1.00 10.00 C ATOM 714 OE1 GLN A 48 2.102 -13.492 -0.207 1.00 10.00 O ATOM 715 NE2 GLN A 48 2.415 -14.454 1.788 1.00 10.00 N ATOM 0 H GLN A 48 3.210 -8.674 2.513 1.00 10.00 H new ATOM 0 HA GLN A 48 3.240 -10.863 2.301 1.00 10.00 H new ATOM 0 HB2 GLN A 48 0.717 -10.300 1.382 1.00 10.00 H new ATOM 0 HB3 GLN A 48 1.389 -11.107 -0.021 1.00 10.00 H new ATOM 0 HG2 GLN A 48 1.559 -12.309 2.754 1.00 10.00 H new ATOM 0 HG3 GLN A 48 0.165 -12.551 1.721 1.00 10.00 H new ATOM 0 HE21 GLN A 48 2.270 -14.415 2.797 1.00 10.00 H new ATOM 0 HE22 GLN A 48 2.918 -15.239 1.375 1.00 10.00 H new ATOM 724 N TYR A 49 3.722 -10.080 -0.870 1.00 10.00 N ATOM 725 CA TYR A 49 4.588 -10.310 -2.021 1.00 10.00 C ATOM 726 C TYR A 49 6.042 -9.987 -1.692 1.00 10.00 C ATOM 727 O TYR A 49 6.442 -8.825 -1.671 1.00 10.00 O ATOM 728 CB TYR A 49 4.123 -9.462 -3.208 1.00 10.00 C ATOM 729 CG TYR A 49 2.785 -9.876 -3.774 1.00 10.00 C ATOM 730 CD1 TYR A 49 2.670 -11.008 -4.570 1.00 10.00 C ATOM 731 CD2 TYR A 49 1.636 -9.135 -3.519 1.00 10.00 C ATOM 732 CE1 TYR A 49 1.452 -11.390 -5.096 1.00 10.00 C ATOM 733 CE2 TYR A 49 0.413 -9.511 -4.041 1.00 10.00 C ATOM 734 CZ TYR A 49 0.326 -10.638 -4.827 1.00 10.00 C ATOM 735 OH TYR A 49 -0.889 -11.019 -5.347 1.00 10.00 O ATOM 0 H TYR A 49 3.014 -9.361 -1.019 1.00 10.00 H new ATOM 0 HA TYR A 49 4.524 -11.366 -2.284 1.00 10.00 H new ATOM 0 HB2 TYR A 49 4.067 -8.419 -2.896 1.00 10.00 H new ATOM 0 HB3 TYR A 49 4.873 -9.519 -3.997 1.00 10.00 H new ATOM 0 HD1 TYR A 49 3.548 -11.600 -4.781 1.00 10.00 H new ATOM 0 HD2 TYR A 49 1.701 -8.251 -2.902 1.00 10.00 H new ATOM 0 HE1 TYR A 49 1.381 -12.272 -5.715 1.00 10.00 H new ATOM 0 HE2 TYR A 49 -0.470 -8.924 -3.834 1.00 10.00 H new ATOM 0 HH TYR A 49 -1.580 -10.385 -5.063 1.00 10.00 H new ATOM 745 N SER A 50 6.825 -11.021 -1.425 1.00 10.00 N ATOM 746 CA SER A 50 8.232 -10.846 -1.101 1.00 10.00 C ATOM 747 C SER A 50 9.114 -11.415 -2.211 1.00 10.00 C ATOM 748 O SER A 50 10.133 -10.829 -2.577 1.00 10.00 O ATOM 749 CB SER A 50 8.548 -11.524 0.230 1.00 10.00 C ATOM 750 OG SER A 50 7.506 -11.305 1.172 1.00 10.00 O ATOM 0 H SER A 50 6.509 -11.991 -1.426 1.00 10.00 H new ATOM 0 HA SER A 50 8.440 -9.780 -1.013 1.00 10.00 H new ATOM 0 HB2 SER A 50 8.683 -12.594 0.074 1.00 10.00 H new ATOM 0 HB3 SER A 50 9.488 -11.138 0.625 1.00 10.00 H new ATOM 0 HG SER A 50 6.654 -11.608 0.794 1.00 10.00 H new ATOM 756 N LYS A 51 8.720 -12.565 -2.744 1.00 10.00 N ATOM 757 CA LYS A 51 9.466 -13.203 -3.818 1.00 10.00 C ATOM 758 C LYS A 51 8.777 -12.963 -5.159 1.00 10.00 C ATOM 759 O LYS A 51 9.282 -12.209 -5.991 1.00 10.00 O ATOM 760 CB LYS A 51 9.625 -14.705 -3.555 1.00 10.00 C ATOM 761 CG LYS A 51 10.377 -15.446 -4.657 1.00 10.00 C ATOM 762 CD LYS A 51 10.935 -16.779 -4.175 1.00 10.00 C ATOM 763 CE LYS A 51 9.832 -17.743 -3.761 1.00 10.00 C ATOM 764 NZ LYS A 51 10.305 -19.152 -3.757 1.00 10.00 N ATOM 0 H LYS A 51 7.887 -13.074 -2.449 1.00 10.00 H new ATOM 0 HA LYS A 51 10.461 -12.759 -3.854 1.00 10.00 H new ATOM 0 HB2 LYS A 51 10.151 -14.846 -2.611 1.00 10.00 H new ATOM 0 HB3 LYS A 51 8.637 -15.151 -3.439 1.00 10.00 H new ATOM 0 HG2 LYS A 51 9.707 -15.618 -5.500 1.00 10.00 H new ATOM 0 HG3 LYS A 51 11.194 -14.822 -5.021 1.00 10.00 H new ATOM 0 HD2 LYS A 51 11.532 -17.230 -4.968 1.00 10.00 H new ATOM 0 HD3 LYS A 51 11.603 -16.608 -3.331 1.00 10.00 H new ATOM 0 HE2 LYS A 51 9.471 -17.478 -2.767 1.00 10.00 H new ATOM 0 HE3 LYS A 51 8.988 -17.645 -4.444 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 9.526 -19.779 -3.470 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 10.626 -19.413 -4.711 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 11.094 -19.251 -3.087 1.00 10.00 H new ATOM 778 N HIS A 52 7.623 -13.599 -5.357 1.00 10.00 N ATOM 779 CA HIS A 52 6.859 -13.455 -6.592 1.00 10.00 C ATOM 780 C HIS A 52 5.488 -14.089 -6.422 1.00 10.00 C ATOM 781 O HIS A 52 4.505 -13.552 -6.971 1.00 10.00 O ATOM 782 CB HIS A 52 7.583 -14.118 -7.766 1.00 10.00 C ATOM 783 CG HIS A 52 7.143 -13.608 -9.105 1.00 10.00 C ATOM 784 ND1 HIS A 52 5.924 -13.916 -9.669 1.00 10.00 N ATOM 785 CD2 HIS A 52 7.769 -12.800 -9.992 1.00 10.00 C ATOM 786 CE1 HIS A 52 5.821 -13.319 -10.841 1.00 10.00 C ATOM 787 NE2 HIS A 52 6.929 -12.637 -11.061 1.00 10.00 N ATOM 788 OXT HIS A 52 5.408 -15.131 -5.742 1.00 10.00 O ATOM 0 H HIS A 52 7.196 -14.223 -4.672 1.00 10.00 H new ATOM 0 HA HIS A 52 6.753 -12.391 -6.806 1.00 10.00 H new ATOM 0 HB2 HIS A 52 8.656 -13.956 -7.659 1.00 10.00 H new ATOM 0 HB3 HIS A 52 7.417 -15.194 -7.724 1.00 10.00 H new ATOM 0 HD2 HIS A 52 8.750 -12.364 -9.878 1.00 10.00 H new ATOM 0 HE1 HIS A 52 4.973 -13.378 -11.508 1.00 10.00 H new ATOM 0 HE2 HIS A 52 7.127 -12.079 -11.892 1.00 10.00 H new ATOM 798 N GLY B 1 -18.028 19.687 2.340 1.00 10.00 N ATOM 799 CA GLY B 1 -18.355 18.552 3.232 1.00 10.00 C ATOM 800 C GLY B 1 -19.035 17.426 2.483 1.00 10.00 C ATOM 801 O GLY B 1 -18.639 17.088 1.368 1.00 10.00 O ATOM 0 H1 GLY B 1 -17.059 20.012 2.533 1.00 10.00 H new ATOM 0 H2 GLY B 1 -18.100 19.381 1.349 1.00 10.00 H new ATOM 0 H3 GLY B 1 -18.695 20.466 2.511 1.00 10.00 H new ATOM 0 HA2 GLY B 1 -17.442 18.180 3.697 1.00 10.00 H new ATOM 0 HA3 GLY B 1 -19.004 18.897 4.037 1.00 10.00 H new ATOM 807 N SER B 2 -20.064 16.854 3.087 1.00 10.00 N ATOM 808 CA SER B 2 -20.804 15.762 2.473 1.00 10.00 C ATOM 809 C SER B 2 -22.020 16.288 1.710 1.00 10.00 C ATOM 810 O SER B 2 -22.992 16.743 2.315 1.00 10.00 O ATOM 811 CB SER B 2 -21.246 14.771 3.550 1.00 10.00 C ATOM 812 OG SER B 2 -20.192 14.505 4.463 1.00 10.00 O ATOM 0 H SER B 2 -20.408 17.129 4.007 1.00 10.00 H new ATOM 0 HA SER B 2 -20.151 15.256 1.762 1.00 10.00 H new ATOM 0 HB2 SER B 2 -22.105 15.173 4.088 1.00 10.00 H new ATOM 0 HB3 SER B 2 -21.570 13.841 3.082 1.00 10.00 H new ATOM 0 HG SER B 2 -20.500 13.870 5.143 1.00 10.00 H new ATOM 818 N PRO B 3 -21.977 16.256 0.371 1.00 10.00 N ATOM 819 CA PRO B 3 -23.073 16.724 -0.468 1.00 10.00 C ATOM 820 C PRO B 3 -24.075 15.613 -0.802 1.00 10.00 C ATOM 821 O PRO B 3 -23.683 14.467 -1.026 1.00 10.00 O ATOM 822 CB PRO B 3 -22.339 17.172 -1.726 1.00 10.00 C ATOM 823 CG PRO B 3 -21.183 16.232 -1.842 1.00 10.00 C ATOM 824 CD PRO B 3 -20.847 15.771 -0.442 1.00 10.00 C ATOM 0 HA PRO B 3 -23.670 17.498 0.014 1.00 10.00 H new ATOM 0 HB2 PRO B 3 -22.984 17.117 -2.603 1.00 10.00 H new ATOM 0 HB3 PRO B 3 -22.003 18.205 -1.642 1.00 10.00 H new ATOM 0 HG2 PRO B 3 -21.438 15.383 -2.477 1.00 10.00 H new ATOM 0 HG3 PRO B 3 -20.327 16.728 -2.301 1.00 10.00 H new ATOM 0 HD2 PRO B 3 -20.754 14.686 -0.390 1.00 10.00 H new ATOM 0 HD3 PRO B 3 -19.900 16.189 -0.100 1.00 10.00 H new ATOM 832 N PRO B 4 -25.381 15.935 -0.849 1.00 10.00 N ATOM 833 CA PRO B 4 -26.425 14.953 -1.176 1.00 10.00 C ATOM 834 C PRO B 4 -26.376 14.535 -2.645 1.00 10.00 C ATOM 835 O PRO B 4 -27.131 13.667 -3.081 1.00 10.00 O ATOM 836 CB PRO B 4 -27.737 15.694 -0.877 1.00 10.00 C ATOM 837 CG PRO B 4 -27.341 16.905 -0.105 1.00 10.00 C ATOM 838 CD PRO B 4 -25.958 17.256 -0.568 1.00 10.00 C ATOM 0 HA PRO B 4 -26.308 14.032 -0.605 1.00 10.00 H new ATOM 0 HB2 PRO B 4 -28.253 15.966 -1.798 1.00 10.00 H new ATOM 0 HB3 PRO B 4 -28.420 15.068 -0.303 1.00 10.00 H new ATOM 0 HG2 PRO B 4 -28.034 17.727 -0.286 1.00 10.00 H new ATOM 0 HG3 PRO B 4 -27.355 16.707 0.967 1.00 10.00 H new ATOM 0 HD2 PRO B 4 -25.974 17.890 -1.454 1.00 10.00 H new ATOM 0 HD3 PRO B 4 -25.396 17.792 0.197 1.00 10.00 H new ATOM 846 N GLU B 5 -25.484 15.169 -3.398 1.00 10.00 N ATOM 847 CA GLU B 5 -25.319 14.875 -4.816 1.00 10.00 C ATOM 848 C GLU B 5 -24.542 13.578 -5.008 1.00 10.00 C ATOM 849 O GLU B 5 -24.699 12.891 -6.014 1.00 10.00 O ATOM 850 CB GLU B 5 -24.587 16.022 -5.517 1.00 10.00 C ATOM 851 CG GLU B 5 -25.041 17.403 -5.071 1.00 10.00 C ATOM 852 CD GLU B 5 -26.532 17.609 -5.223 1.00 10.00 C ATOM 853 OE1 GLU B 5 -27.079 17.262 -6.286 1.00 10.00 O ATOM 854 OE2 GLU B 5 -27.164 18.127 -4.277 1.00 10.00 O ATOM 0 H GLU B 5 -24.860 15.895 -3.046 1.00 10.00 H new ATOM 0 HA GLU B 5 -26.310 14.762 -5.256 1.00 10.00 H new ATOM 0 HB2 GLU B 5 -23.517 15.924 -5.333 1.00 10.00 H new ATOM 0 HB3 GLU B 5 -24.735 15.931 -6.593 1.00 10.00 H new ATOM 0 HG2 GLU B 5 -24.763 17.552 -4.028 1.00 10.00 H new ATOM 0 HG3 GLU B 5 -24.513 18.159 -5.653 1.00 10.00 H new ATOM 861 N ALA B 6 -23.703 13.257 -4.032 1.00 10.00 N ATOM 862 CA ALA B 6 -22.897 12.045 -4.082 1.00 10.00 C ATOM 863 C ALA B 6 -23.678 10.858 -3.529 1.00 10.00 C ATOM 864 O ALA B 6 -24.457 11.007 -2.584 1.00 10.00 O ATOM 865 CB ALA B 6 -21.606 12.240 -3.301 1.00 10.00 C ATOM 0 H ALA B 6 -23.563 13.821 -3.194 1.00 10.00 H new ATOM 0 HA ALA B 6 -22.649 11.837 -5.123 1.00 10.00 H new ATOM 0 HB1 ALA B 6 -21.012 11.327 -3.346 1.00 10.00 H new ATOM 0 HB2 ALA B 6 -21.039 13.063 -3.735 1.00 10.00 H new ATOM 0 HB3 ALA B 6 -21.841 12.469 -2.262 1.00 10.00 H new ATOM 871 N ASP B 7 -23.479 9.688 -4.123 1.00 10.00 N ATOM 872 CA ASP B 7 -24.170 8.486 -3.677 1.00 10.00 C ATOM 873 C ASP B 7 -23.648 8.052 -2.315 1.00 10.00 C ATOM 874 O ASP B 7 -22.435 7.965 -2.104 1.00 10.00 O ATOM 875 CB ASP B 7 -24.005 7.349 -4.684 1.00 10.00 C ATOM 876 CG ASP B 7 -25.042 6.262 -4.490 1.00 10.00 C ATOM 877 OD1 ASP B 7 -24.883 5.434 -3.568 1.00 10.00 O ATOM 878 OD2 ASP B 7 -26.032 6.233 -5.258 1.00 10.00 O ATOM 0 H ASP B 7 -22.847 9.546 -4.911 1.00 10.00 H new ATOM 0 HA ASP B 7 -25.231 8.720 -3.596 1.00 10.00 H new ATOM 0 HB2 ASP B 7 -24.082 7.747 -5.696 1.00 10.00 H new ATOM 0 HB3 ASP B 7 -23.008 6.920 -4.586 1.00 10.00 H new ATOM 883 N PRO B 8 -24.560 7.768 -1.375 1.00 10.00 N ATOM 884 CA PRO B 8 -24.194 7.348 -0.021 1.00 10.00 C ATOM 885 C PRO B 8 -23.387 6.053 -0.003 1.00 10.00 C ATOM 886 O PRO B 8 -22.651 5.788 0.945 1.00 10.00 O ATOM 887 CB PRO B 8 -25.542 7.149 0.680 1.00 10.00 C ATOM 888 CG PRO B 8 -26.533 6.995 -0.419 1.00 10.00 C ATOM 889 CD PRO B 8 -26.021 7.836 -1.549 1.00 10.00 C ATOM 0 HA PRO B 8 -23.554 8.085 0.464 1.00 10.00 H new ATOM 0 HB2 PRO B 8 -25.526 6.268 1.322 1.00 10.00 H new ATOM 0 HB3 PRO B 8 -25.786 8.001 1.314 1.00 10.00 H new ATOM 0 HG2 PRO B 8 -26.626 5.951 -0.719 1.00 10.00 H new ATOM 0 HG3 PRO B 8 -27.523 7.325 -0.103 1.00 10.00 H new ATOM 0 HD2 PRO B 8 -26.331 7.443 -2.517 1.00 10.00 H new ATOM 0 HD3 PRO B 8 -26.388 8.861 -1.488 1.00 10.00 H new ATOM 897 N ARG B 9 -23.514 5.255 -1.056 1.00 10.00 N ATOM 898 CA ARG B 9 -22.792 3.995 -1.141 1.00 10.00 C ATOM 899 C ARG B 9 -21.416 4.192 -1.762 1.00 10.00 C ATOM 900 O ARG B 9 -20.545 3.334 -1.649 1.00 10.00 O ATOM 901 CB ARG B 9 -23.594 2.976 -1.943 1.00 10.00 C ATOM 902 CG ARG B 9 -24.841 2.505 -1.223 1.00 10.00 C ATOM 903 CD ARG B 9 -25.923 2.101 -2.206 1.00 10.00 C ATOM 904 NE ARG B 9 -26.358 3.227 -3.033 1.00 10.00 N ATOM 905 CZ ARG B 9 -27.555 3.306 -3.609 1.00 10.00 C ATOM 906 NH1 ARG B 9 -28.448 2.339 -3.433 1.00 10.00 N ATOM 907 NH2 ARG B 9 -27.854 4.356 -4.362 1.00 10.00 N ATOM 0 H ARG B 9 -24.108 5.458 -1.860 1.00 10.00 H new ATOM 0 HA ARG B 9 -22.655 3.616 -0.128 1.00 10.00 H new ATOM 0 HB2 ARG B 9 -23.878 3.416 -2.899 1.00 10.00 H new ATOM 0 HB3 ARG B 9 -22.962 2.116 -2.163 1.00 10.00 H new ATOM 0 HG2 ARG B 9 -24.596 1.659 -0.581 1.00 10.00 H new ATOM 0 HG3 ARG B 9 -25.212 3.300 -0.576 1.00 10.00 H new ATOM 0 HD2 ARG B 9 -25.551 1.302 -2.847 1.00 10.00 H new ATOM 0 HD3 ARG B 9 -26.777 1.700 -1.661 1.00 10.00 H new ATOM 0 HE ARG B 9 -25.705 3.997 -3.177 1.00 10.00 H new ATOM 0 HH11 ARG B 9 -28.218 1.531 -2.854 1.00 10.00 H new ATOM 0 HH12 ARG B 9 -29.364 2.404 -3.877 1.00 10.00 H new ATOM 0 HH21 ARG B 9 -27.168 5.098 -4.498 1.00 10.00 H new ATOM 0 HH22 ARG B 9 -28.770 4.421 -4.806 1.00 10.00 H new ATOM 921 N LEU B 10 -21.221 5.334 -2.406 1.00 10.00 N ATOM 922 CA LEU B 10 -19.942 5.643 -3.034 1.00 10.00 C ATOM 923 C LEU B 10 -18.916 6.014 -1.967 1.00 10.00 C ATOM 924 O LEU B 10 -17.726 5.740 -2.103 1.00 10.00 O ATOM 925 CB LEU B 10 -20.102 6.789 -4.038 1.00 10.00 C ATOM 926 CG LEU B 10 -18.835 7.163 -4.810 1.00 10.00 C ATOM 927 CD1 LEU B 10 -18.541 6.136 -5.893 1.00 10.00 C ATOM 928 CD2 LEU B 10 -18.970 8.554 -5.410 1.00 10.00 C ATOM 0 H LEU B 10 -21.929 6.061 -2.508 1.00 10.00 H new ATOM 0 HA LEU B 10 -19.592 4.761 -3.571 1.00 10.00 H new ATOM 0 HB2 LEU B 10 -20.877 6.517 -4.754 1.00 10.00 H new ATOM 0 HB3 LEU B 10 -20.456 7.671 -3.504 1.00 10.00 H new ATOM 0 HG LEU B 10 -17.997 7.169 -4.113 1.00 10.00 H new ATOM 0 HD11 LEU B 10 -17.636 6.422 -6.429 1.00 10.00 H new ATOM 0 HD12 LEU B 10 -18.398 5.157 -5.437 1.00 10.00 H new ATOM 0 HD13 LEU B 10 -19.378 6.093 -6.590 1.00 10.00 H new ATOM 0 HD21 LEU B 10 -18.060 8.805 -5.956 1.00 10.00 H new ATOM 0 HD22 LEU B 10 -19.820 8.575 -6.092 1.00 10.00 H new ATOM 0 HD23 LEU B 10 -19.127 9.281 -4.613 1.00 10.00 H new ATOM 940 N ILE B 11 -19.399 6.627 -0.896 1.00 10.00 N ATOM 941 CA ILE B 11 -18.538 7.033 0.205 1.00 10.00 C ATOM 942 C ILE B 11 -18.430 5.904 1.233 1.00 10.00 C ATOM 943 O ILE B 11 -17.601 5.945 2.145 1.00 10.00 O ATOM 944 CB ILE B 11 -19.066 8.328 0.873 1.00 10.00 C ATOM 945 CG1 ILE B 11 -17.974 8.987 1.721 1.00 10.00 C ATOM 946 CG2 ILE B 11 -20.299 8.040 1.720 1.00 10.00 C ATOM 947 CD1 ILE B 11 -18.312 10.397 2.157 1.00 10.00 C ATOM 0 H ILE B 11 -20.385 6.854 -0.766 1.00 10.00 H new ATOM 0 HA ILE B 11 -17.545 7.241 -0.194 1.00 10.00 H new ATOM 0 HB ILE B 11 -19.351 9.021 0.082 1.00 10.00 H new ATOM 0 HG12 ILE B 11 -17.794 8.376 2.605 1.00 10.00 H new ATOM 0 HG13 ILE B 11 -17.045 9.005 1.151 1.00 10.00 H new ATOM 0 HG21 ILE B 11 -20.650 8.965 2.178 1.00 10.00 H new ATOM 0 HG22 ILE B 11 -21.085 7.626 1.089 1.00 10.00 H new ATOM 0 HG23 ILE B 11 -20.045 7.323 2.500 1.00 10.00 H new ATOM 0 HD11 ILE B 11 -17.493 10.800 2.753 1.00 10.00 H new ATOM 0 HD12 ILE B 11 -18.463 11.023 1.278 1.00 10.00 H new ATOM 0 HD13 ILE B 11 -19.224 10.384 2.754 1.00 10.00 H new ATOM 959 N GLU B 12 -19.253 4.875 1.047 1.00 10.00 N ATOM 960 CA GLU B 12 -19.275 3.728 1.947 1.00 10.00 C ATOM 961 C GLU B 12 -17.987 2.924 1.850 1.00 10.00 C ATOM 962 O GLU B 12 -17.622 2.213 2.785 1.00 10.00 O ATOM 963 CB GLU B 12 -20.471 2.828 1.645 1.00 10.00 C ATOM 964 CG GLU B 12 -21.703 3.168 2.467 1.00 10.00 C ATOM 965 CD GLU B 12 -21.609 2.670 3.896 1.00 10.00 C ATOM 966 OE1 GLU B 12 -20.535 2.808 4.514 1.00 10.00 O ATOM 967 OE2 GLU B 12 -22.617 2.123 4.399 1.00 10.00 O ATOM 0 H GLU B 12 -19.917 4.814 0.275 1.00 10.00 H new ATOM 0 HA GLU B 12 -19.366 4.111 2.963 1.00 10.00 H new ATOM 0 HB2 GLU B 12 -20.717 2.906 0.586 1.00 10.00 H new ATOM 0 HB3 GLU B 12 -20.193 1.791 1.832 1.00 10.00 H new ATOM 0 HG2 GLU B 12 -21.845 4.249 2.472 1.00 10.00 H new ATOM 0 HG3 GLU B 12 -22.583 2.733 1.992 1.00 10.00 H new ATOM 974 N SER B 13 -17.300 3.041 0.723 1.00 10.00 N ATOM 975 CA SER B 13 -16.053 2.330 0.515 1.00 10.00 C ATOM 976 C SER B 13 -15.022 2.749 1.563 1.00 10.00 C ATOM 977 O SER B 13 -14.188 1.951 1.986 1.00 10.00 O ATOM 978 CB SER B 13 -15.536 2.617 -0.890 1.00 10.00 C ATOM 979 OG SER B 13 -16.614 2.714 -1.809 1.00 10.00 O ATOM 0 H SER B 13 -17.589 3.624 -0.062 1.00 10.00 H new ATOM 0 HA SER B 13 -16.226 1.259 0.619 1.00 10.00 H new ATOM 0 HB2 SER B 13 -14.966 3.546 -0.891 1.00 10.00 H new ATOM 0 HB3 SER B 13 -14.855 1.825 -1.202 1.00 10.00 H new ATOM 0 HG SER B 13 -16.874 3.653 -1.910 1.00 10.00 H new ATOM 985 N LEU B 14 -15.108 4.003 1.995 1.00 10.00 N ATOM 986 CA LEU B 14 -14.194 4.532 2.998 1.00 10.00 C ATOM 987 C LEU B 14 -14.518 3.937 4.363 1.00 10.00 C ATOM 988 O LEU B 14 -13.629 3.467 5.076 1.00 10.00 O ATOM 989 CB LEU B 14 -14.279 6.062 3.059 1.00 10.00 C ATOM 990 CG LEU B 14 -13.459 6.809 2.001 1.00 10.00 C ATOM 991 CD1 LEU B 14 -14.078 6.659 0.619 1.00 10.00 C ATOM 992 CD2 LEU B 14 -13.340 8.280 2.368 1.00 10.00 C ATOM 0 H LEU B 14 -15.803 4.672 1.665 1.00 10.00 H new ATOM 0 HA LEU B 14 -13.178 4.255 2.718 1.00 10.00 H new ATOM 0 HB2 LEU B 14 -15.324 6.355 2.958 1.00 10.00 H new ATOM 0 HB3 LEU B 14 -13.950 6.388 4.046 1.00 10.00 H new ATOM 0 HG LEU B 14 -12.462 6.369 1.974 1.00 10.00 H new ATOM 0 HD11 LEU B 14 -13.475 7.199 -0.110 1.00 10.00 H new ATOM 0 HD12 LEU B 14 -14.114 5.604 0.349 1.00 10.00 H new ATOM 0 HD13 LEU B 14 -15.089 7.067 0.627 1.00 10.00 H new ATOM 0 HD21 LEU B 14 -12.755 8.798 1.608 1.00 10.00 H new ATOM 0 HD22 LEU B 14 -14.335 8.722 2.425 1.00 10.00 H new ATOM 0 HD23 LEU B 14 -12.845 8.375 3.334 1.00 10.00 H new ATOM 1004 N SER B 15 -15.803 3.940 4.710 1.00 10.00 N ATOM 1005 CA SER B 15 -16.253 3.399 5.984 1.00 10.00 C ATOM 1006 C SER B 15 -16.043 1.889 6.029 1.00 10.00 C ATOM 1007 O SER B 15 -15.683 1.338 7.065 1.00 10.00 O ATOM 1008 CB SER B 15 -17.733 3.734 6.204 1.00 10.00 C ATOM 1009 OG SER B 15 -18.280 4.402 5.076 1.00 10.00 O ATOM 0 H SER B 15 -16.550 4.312 4.124 1.00 10.00 H new ATOM 0 HA SER B 15 -15.665 3.853 6.781 1.00 10.00 H new ATOM 0 HB2 SER B 15 -18.292 2.818 6.394 1.00 10.00 H new ATOM 0 HB3 SER B 15 -17.839 4.362 7.089 1.00 10.00 H new ATOM 0 HG SER B 15 -19.166 4.033 4.875 1.00 10.00 H new ATOM 1015 N GLN B 16 -16.256 1.228 4.895 1.00 10.00 N ATOM 1016 CA GLN B 16 -16.095 -0.217 4.806 1.00 10.00 C ATOM 1017 C GLN B 16 -14.662 -0.629 5.130 1.00 10.00 C ATOM 1018 O GLN B 16 -14.438 -1.558 5.904 1.00 10.00 O ATOM 1019 CB GLN B 16 -16.482 -0.719 3.414 1.00 10.00 C ATOM 1020 CG GLN B 16 -16.666 -2.227 3.341 1.00 10.00 C ATOM 1021 CD GLN B 16 -17.687 -2.738 4.342 1.00 10.00 C ATOM 1022 OE1 GLN B 16 -18.650 -2.046 4.675 1.00 10.00 O ATOM 1023 NE2 GLN B 16 -17.482 -3.954 4.826 1.00 10.00 N ATOM 0 H GLN B 16 -16.541 1.673 4.023 1.00 10.00 H new ATOM 0 HA GLN B 16 -16.759 -0.672 5.541 1.00 10.00 H new ATOM 0 HB2 GLN B 16 -17.408 -0.233 3.106 1.00 10.00 H new ATOM 0 HB3 GLN B 16 -15.713 -0.420 2.702 1.00 10.00 H new ATOM 0 HG2 GLN B 16 -16.980 -2.503 2.334 1.00 10.00 H new ATOM 0 HG3 GLN B 16 -15.709 -2.716 3.522 1.00 10.00 H new ATOM 0 HE21 GLN B 16 -16.671 -4.493 4.523 1.00 10.00 H new ATOM 0 HE22 GLN B 16 -18.135 -4.351 5.502 1.00 10.00 H new ATOM 1032 N MET B 17 -13.696 0.072 4.544 1.00 10.00 N ATOM 1033 CA MET B 17 -12.286 -0.220 4.791 1.00 10.00 C ATOM 1034 C MET B 17 -11.965 -0.013 6.263 1.00 10.00 C ATOM 1035 O MET B 17 -11.181 -0.756 6.853 1.00 10.00 O ATOM 1036 CB MET B 17 -11.385 0.667 3.929 1.00 10.00 C ATOM 1037 CG MET B 17 -11.467 0.369 2.441 1.00 10.00 C ATOM 1038 SD MET B 17 -11.085 -1.352 2.052 1.00 10.00 S ATOM 1039 CE MET B 17 -9.314 -1.384 2.324 1.00 10.00 C ATOM 0 H MET B 17 -13.862 0.843 3.897 1.00 10.00 H new ATOM 0 HA MET B 17 -12.098 -1.260 4.523 1.00 10.00 H new ATOM 0 HB2 MET B 17 -11.653 1.710 4.096 1.00 10.00 H new ATOM 0 HB3 MET B 17 -10.353 0.547 4.257 1.00 10.00 H new ATOM 0 HG2 MET B 17 -12.469 0.604 2.082 1.00 10.00 H new ATOM 0 HG3 MET B 17 -10.776 1.020 1.906 1.00 10.00 H new ATOM 0 HE1 MET B 17 -8.846 -2.044 1.594 1.00 10.00 H new ATOM 0 HE2 MET B 17 -8.911 -0.377 2.214 1.00 10.00 H new ATOM 0 HE3 MET B 17 -9.107 -1.750 3.330 1.00 10.00 H new ATOM 1049 N LEU B 18 -12.593 1.000 6.849 1.00 10.00 N ATOM 1050 CA LEU B 18 -12.408 1.312 8.259 1.00 10.00 C ATOM 1051 C LEU B 18 -12.953 0.179 9.123 1.00 10.00 C ATOM 1052 O LEU B 18 -12.323 -0.236 10.097 1.00 10.00 O ATOM 1053 CB LEU B 18 -13.122 2.623 8.592 1.00 10.00 C ATOM 1054 CG LEU B 18 -12.824 3.201 9.975 1.00 10.00 C ATOM 1055 CD1 LEU B 18 -11.374 3.632 10.074 1.00 10.00 C ATOM 1056 CD2 LEU B 18 -13.750 4.368 10.268 1.00 10.00 C ATOM 0 H LEU B 18 -13.239 1.623 6.364 1.00 10.00 H new ATOM 0 HA LEU B 18 -11.344 1.424 8.465 1.00 10.00 H new ATOM 0 HB2 LEU B 18 -12.851 3.365 7.841 1.00 10.00 H new ATOM 0 HB3 LEU B 18 -14.197 2.463 8.508 1.00 10.00 H new ATOM 0 HG LEU B 18 -12.999 2.424 10.719 1.00 10.00 H new ATOM 0 HD11 LEU B 18 -11.183 4.041 11.066 1.00 10.00 H new ATOM 0 HD12 LEU B 18 -10.726 2.772 9.905 1.00 10.00 H new ATOM 0 HD13 LEU B 18 -11.169 4.394 9.322 1.00 10.00 H new ATOM 0 HD21 LEU B 18 -13.527 4.770 11.256 1.00 10.00 H new ATOM 0 HD22 LEU B 18 -13.604 5.146 9.518 1.00 10.00 H new ATOM 0 HD23 LEU B 18 -14.785 4.027 10.240 1.00 10.00 H new ATOM 1068 N SER B 19 -14.128 -0.325 8.750 1.00 10.00 N ATOM 1069 CA SER B 19 -14.765 -1.427 9.468 1.00 10.00 C ATOM 1070 C SER B 19 -13.970 -2.720 9.294 1.00 10.00 C ATOM 1071 O SER B 19 -14.069 -3.637 10.108 1.00 10.00 O ATOM 1072 CB SER B 19 -16.199 -1.624 8.968 1.00 10.00 C ATOM 1073 OG SER B 19 -16.914 -0.400 8.989 1.00 10.00 O ATOM 0 H SER B 19 -14.661 0.015 7.949 1.00 10.00 H new ATOM 0 HA SER B 19 -14.788 -1.176 10.528 1.00 10.00 H new ATOM 0 HB2 SER B 19 -16.183 -2.023 7.954 1.00 10.00 H new ATOM 0 HB3 SER B 19 -16.708 -2.358 9.592 1.00 10.00 H new ATOM 0 HG SER B 19 -16.581 0.186 8.278 1.00 10.00 H new ATOM 1079 N MET B 20 -13.183 -2.787 8.225 1.00 10.00 N ATOM 1080 CA MET B 20 -12.361 -3.959 7.939 1.00 10.00 C ATOM 1081 C MET B 20 -11.076 -3.914 8.753 1.00 10.00 C ATOM 1082 O MET B 20 -10.267 -4.842 8.714 1.00 10.00 O ATOM 1083 CB MET B 20 -12.036 -4.038 6.447 1.00 10.00 C ATOM 1084 CG MET B 20 -13.178 -4.575 5.600 1.00 10.00 C ATOM 1085 SD MET B 20 -13.567 -6.299 5.966 1.00 10.00 S ATOM 1086 CE MET B 20 -12.149 -7.131 5.249 1.00 10.00 C ATOM 0 H MET B 20 -13.097 -2.038 7.538 1.00 10.00 H new ATOM 0 HA MET B 20 -12.924 -4.849 8.218 1.00 10.00 H new ATOM 0 HB2 MET B 20 -11.767 -3.044 6.090 1.00 10.00 H new ATOM 0 HB3 MET B 20 -11.162 -4.674 6.308 1.00 10.00 H new ATOM 0 HG2 MET B 20 -14.065 -3.964 5.765 1.00 10.00 H new ATOM 0 HG3 MET B 20 -12.918 -4.482 4.546 1.00 10.00 H new ATOM 0 HE1 MET B 20 -12.348 -8.201 5.187 1.00 10.00 H new ATOM 0 HE2 MET B 20 -11.964 -6.738 4.249 1.00 10.00 H new ATOM 0 HE3 MET B 20 -11.273 -6.960 5.874 1.00 10.00 H new ATOM 1096 N GLY B 21 -10.885 -2.814 9.469 1.00 10.00 N ATOM 1097 CA GLY B 21 -9.714 -2.662 10.302 1.00 10.00 C ATOM 1098 C GLY B 21 -8.503 -2.222 9.511 1.00 10.00 C ATOM 1099 O GLY B 21 -7.366 -2.541 9.867 1.00 10.00 O ATOM 0 H GLY B 21 -11.526 -2.021 9.486 1.00 10.00 H new ATOM 0 HA2 GLY B 21 -9.919 -1.932 11.085 1.00 10.00 H new ATOM 0 HA3 GLY B 21 -9.498 -3.608 10.798 1.00 10.00 H new ATOM 1103 N PHE B 22 -8.743 -1.499 8.425 1.00 10.00 N ATOM 1104 CA PHE B 22 -7.661 -1.007 7.596 1.00 10.00 C ATOM 1105 C PHE B 22 -7.639 0.509 7.630 1.00 10.00 C ATOM 1106 O PHE B 22 -8.626 1.166 7.299 1.00 10.00 O ATOM 1107 CB PHE B 22 -7.813 -1.495 6.157 1.00 10.00 C ATOM 1108 CG PHE B 22 -6.522 -1.953 5.546 1.00 10.00 C ATOM 1109 CD1 PHE B 22 -6.075 -3.248 5.742 1.00 10.00 C ATOM 1110 CD2 PHE B 22 -5.755 -1.090 4.786 1.00 10.00 C ATOM 1111 CE1 PHE B 22 -4.885 -3.676 5.190 1.00 10.00 C ATOM 1112 CE2 PHE B 22 -4.564 -1.510 4.229 1.00 10.00 C ATOM 1113 CZ PHE B 22 -4.127 -2.804 4.430 1.00 10.00 C ATOM 0 H PHE B 22 -9.676 -1.243 8.102 1.00 10.00 H new ATOM 0 HA PHE B 22 -6.720 -1.392 7.989 1.00 10.00 H new ATOM 0 HB2 PHE B 22 -8.530 -2.316 6.133 1.00 10.00 H new ATOM 0 HB3 PHE B 22 -8.229 -0.691 5.550 1.00 10.00 H new ATOM 0 HD1 PHE B 22 -6.665 -3.932 6.334 1.00 10.00 H new ATOM 0 HD2 PHE B 22 -6.091 -0.076 4.626 1.00 10.00 H new ATOM 0 HE1 PHE B 22 -4.547 -4.689 5.351 1.00 10.00 H new ATOM 0 HE2 PHE B 22 -3.974 -0.827 3.636 1.00 10.00 H new ATOM 0 HZ PHE B 22 -3.195 -3.135 3.995 1.00 10.00 H new ATOM 1123 N SER B 23 -6.509 1.057 8.032 1.00 10.00 N ATOM 1124 CA SER B 23 -6.340 2.490 8.115 1.00 10.00 C ATOM 1125 C SER B 23 -4.939 2.869 7.668 1.00 10.00 C ATOM 1126 O SER B 23 -4.033 2.035 7.673 1.00 10.00 O ATOM 1127 CB SER B 23 -6.598 2.956 9.549 1.00 10.00 C ATOM 1128 OG SER B 23 -6.180 1.975 10.486 1.00 10.00 O ATOM 0 H SER B 23 -5.686 0.521 8.309 1.00 10.00 H new ATOM 0 HA SER B 23 -7.056 2.982 7.457 1.00 10.00 H new ATOM 0 HB2 SER B 23 -6.066 3.890 9.733 1.00 10.00 H new ATOM 0 HB3 SER B 23 -7.660 3.162 9.683 1.00 10.00 H new ATOM 0 HG SER B 23 -6.353 2.296 11.395 1.00 10.00 H new ATOM 1134 N ASP B 24 -4.765 4.114 7.270 1.00 10.00 N ATOM 1135 CA ASP B 24 -3.474 4.579 6.812 1.00 10.00 C ATOM 1136 C ASP B 24 -2.970 5.733 7.663 1.00 10.00 C ATOM 1137 O ASP B 24 -3.573 6.802 7.709 1.00 10.00 O ATOM 1138 CB ASP B 24 -3.534 4.982 5.333 1.00 10.00 C ATOM 1139 CG ASP B 24 -4.650 5.967 4.992 1.00 10.00 C ATOM 1140 OD1 ASP B 24 -5.614 6.106 5.774 1.00 10.00 O ATOM 1141 OD2 ASP B 24 -4.561 6.596 3.918 1.00 10.00 O ATOM 0 H ASP B 24 -5.501 4.820 7.255 1.00 10.00 H new ATOM 0 HA ASP B 24 -2.768 3.755 6.915 1.00 10.00 H new ATOM 0 HB2 ASP B 24 -2.578 5.423 5.050 1.00 10.00 H new ATOM 0 HB3 ASP B 24 -3.662 4.084 4.729 1.00 10.00 H new ATOM 1146 N GLU B 25 -1.850 5.497 8.334 1.00 10.00 N ATOM 1147 CA GLU B 25 -1.234 6.498 9.197 1.00 10.00 C ATOM 1148 C GLU B 25 -0.556 7.577 8.362 1.00 10.00 C ATOM 1149 O GLU B 25 -0.673 8.765 8.651 1.00 10.00 O ATOM 1150 CB GLU B 25 -0.207 5.843 10.130 1.00 10.00 C ATOM 1151 CG GLU B 25 -0.682 4.539 10.753 1.00 10.00 C ATOM 1152 CD GLU B 25 -0.242 3.323 9.965 1.00 10.00 C ATOM 1153 OE1 GLU B 25 -0.552 3.246 8.755 1.00 10.00 O ATOM 1154 OE2 GLU B 25 0.413 2.437 10.549 1.00 10.00 O ATOM 0 H GLU B 25 -1.345 4.612 8.296 1.00 10.00 H new ATOM 0 HA GLU B 25 -2.018 6.957 9.800 1.00 10.00 H new ATOM 0 HB2 GLU B 25 0.709 5.654 9.570 1.00 10.00 H new ATOM 0 HB3 GLU B 25 0.045 6.544 10.926 1.00 10.00 H new ATOM 0 HG2 GLU B 25 -0.299 4.466 11.771 1.00 10.00 H new ATOM 0 HG3 GLU B 25 -1.770 4.549 10.822 1.00 10.00 H new ATOM 1161 N GLY B 26 0.147 7.149 7.320 1.00 10.00 N ATOM 1162 CA GLY B 26 0.833 8.087 6.450 1.00 10.00 C ATOM 1163 C GLY B 26 -0.034 8.527 5.287 1.00 10.00 C ATOM 1164 O GLY B 26 0.443 9.193 4.367 1.00 10.00 O ATOM 0 H GLY B 26 0.255 6.168 7.061 1.00 10.00 H new ATOM 0 HA2 GLY B 26 1.135 8.961 7.027 1.00 10.00 H new ATOM 0 HA3 GLY B 26 1.744 7.626 6.068 1.00 10.00 H new ATOM 1168 N GLY B 27 -1.308 8.150 5.327 1.00 10.00 N ATOM 1169 CA GLY B 27 -2.232 8.514 4.273 1.00 10.00 C ATOM 1170 C GLY B 27 -1.886 7.865 2.948 1.00 10.00 C ATOM 1171 O GLY B 27 -1.848 8.533 1.915 1.00 10.00 O ATOM 0 H GLY B 27 -1.718 7.594 6.078 1.00 10.00 H new ATOM 0 HA2 GLY B 27 -3.242 8.224 4.563 1.00 10.00 H new ATOM 0 HA3 GLY B 27 -2.234 9.597 4.154 1.00 10.00 H new ATOM 1175 N TRP B 28 -1.609 6.566 2.972 1.00 10.00 N ATOM 1176 CA TRP B 28 -1.266 5.842 1.756 1.00 10.00 C ATOM 1177 C TRP B 28 -2.490 5.130 1.160 1.00 10.00 C ATOM 1178 O TRP B 28 -2.553 4.895 -0.047 1.00 10.00 O ATOM 1179 CB TRP B 28 -0.124 4.847 2.022 1.00 10.00 C ATOM 1180 CG TRP B 28 -0.467 3.713 2.944 1.00 10.00 C ATOM 1181 CD1 TRP B 28 -0.446 3.725 4.310 1.00 10.00 C ATOM 1182 CD2 TRP B 28 -0.852 2.387 2.562 1.00 10.00 C ATOM 1183 NE1 TRP B 28 -0.808 2.492 4.799 1.00 10.00 N ATOM 1184 CE2 TRP B 28 -1.061 1.654 3.745 1.00 10.00 C ATOM 1185 CE3 TRP B 28 -1.050 1.751 1.334 1.00 10.00 C ATOM 1186 CZ2 TRP B 28 -1.453 0.315 3.732 1.00 10.00 C ATOM 1187 CZ3 TRP B 28 -1.438 0.425 1.325 1.00 10.00 C ATOM 1188 CH2 TRP B 28 -1.636 -0.280 2.515 1.00 10.00 C ATOM 0 H TRP B 28 -1.615 5.995 3.817 1.00 10.00 H new ATOM 0 HA TRP B 28 -0.922 6.569 1.020 1.00 10.00 H new ATOM 0 HB2 TRP B 28 0.205 4.433 1.069 1.00 10.00 H new ATOM 0 HB3 TRP B 28 0.721 5.392 2.441 1.00 10.00 H new ATOM 0 HD1 TRP B 28 -0.183 4.579 4.917 1.00 10.00 H new ATOM 0 HE1 TRP B 28 -0.877 2.242 5.785 1.00 10.00 H new ATOM 0 HE3 TRP B 28 -0.902 2.287 0.408 1.00 10.00 H new ATOM 0 HZ2 TRP B 28 -1.606 -0.232 4.651 1.00 10.00 H new ATOM 0 HZ3 TRP B 28 -1.591 -0.076 0.381 1.00 10.00 H new ATOM 0 HH2 TRP B 28 -1.940 -1.316 2.472 1.00 10.00 H new ATOM 1199 N LEU B 29 -3.473 4.826 1.997 1.00 10.00 N ATOM 1200 CA LEU B 29 -4.673 4.127 1.550 1.00 10.00 C ATOM 1201 C LEU B 29 -5.634 5.089 0.867 1.00 10.00 C ATOM 1202 O LEU B 29 -6.262 4.748 -0.137 1.00 10.00 O ATOM 1203 CB LEU B 29 -5.364 3.438 2.727 1.00 10.00 C ATOM 1204 CG LEU B 29 -6.587 2.585 2.366 1.00 10.00 C ATOM 1205 CD1 LEU B 29 -6.166 1.339 1.607 1.00 10.00 C ATOM 1206 CD2 LEU B 29 -7.362 2.214 3.621 1.00 10.00 C ATOM 0 H LEU B 29 -3.464 5.053 2.991 1.00 10.00 H new ATOM 0 HA LEU B 29 -4.373 3.367 0.828 1.00 10.00 H new ATOM 0 HB2 LEU B 29 -4.636 2.803 3.232 1.00 10.00 H new ATOM 0 HB3 LEU B 29 -5.673 4.201 3.442 1.00 10.00 H new ATOM 0 HG LEU B 29 -7.239 3.172 1.719 1.00 10.00 H new ATOM 0 HD11 LEU B 29 -7.048 0.748 1.360 1.00 10.00 H new ATOM 0 HD12 LEU B 29 -5.654 1.628 0.689 1.00 10.00 H new ATOM 0 HD13 LEU B 29 -5.493 0.746 2.226 1.00 10.00 H new ATOM 0 HD21 LEU B 29 -8.227 1.609 3.349 1.00 10.00 H new ATOM 0 HD22 LEU B 29 -6.718 1.645 4.292 1.00 10.00 H new ATOM 0 HD23 LEU B 29 -7.698 3.121 4.123 1.00 10.00 H new ATOM 1218 N THR B 30 -5.744 6.297 1.414 1.00 10.00 N ATOM 1219 CA THR B 30 -6.618 7.317 0.846 1.00 10.00 C ATOM 1220 C THR B 30 -6.208 7.625 -0.601 1.00 10.00 C ATOM 1221 O THR B 30 -7.032 8.026 -1.422 1.00 10.00 O ATOM 1222 CB THR B 30 -6.608 8.613 1.703 1.00 10.00 C ATOM 1223 OG1 THR B 30 -7.483 9.599 1.135 1.00 10.00 O ATOM 1224 CG2 THR B 30 -5.207 9.195 1.820 1.00 10.00 C ATOM 0 H THR B 30 -5.239 6.592 2.249 1.00 10.00 H new ATOM 0 HA THR B 30 -7.635 6.926 0.848 1.00 10.00 H new ATOM 0 HB THR B 30 -6.957 8.344 2.700 1.00 10.00 H new ATOM 0 HG1 THR B 30 -7.466 10.408 1.687 1.00 10.00 H new ATOM 0 HG21 THR B 30 -5.239 10.100 2.426 1.00 10.00 H new ATOM 0 HG22 THR B 30 -4.548 8.466 2.291 1.00 10.00 H new ATOM 0 HG23 THR B 30 -4.829 9.436 0.826 1.00 10.00 H new ATOM 1232 N ARG B 31 -4.933 7.405 -0.913 1.00 10.00 N ATOM 1233 CA ARG B 31 -4.420 7.642 -2.258 1.00 10.00 C ATOM 1234 C ARG B 31 -4.594 6.386 -3.109 1.00 10.00 C ATOM 1235 O ARG B 31 -4.785 6.457 -4.327 1.00 10.00 O ATOM 1236 CB ARG B 31 -2.941 8.036 -2.196 1.00 10.00 C ATOM 1237 CG ARG B 31 -2.613 8.966 -1.040 1.00 10.00 C ATOM 1238 CD ARG B 31 -2.187 10.342 -1.521 1.00 10.00 C ATOM 1239 NE ARG B 31 -0.735 10.457 -1.626 1.00 10.00 N ATOM 1240 CZ ARG B 31 -0.101 11.561 -2.021 1.00 10.00 C ATOM 1241 NH1 ARG B 31 -0.786 12.646 -2.371 1.00 10.00 N ATOM 1242 NH2 ARG B 31 1.221 11.576 -2.077 1.00 10.00 N ATOM 0 H ARG B 31 -4.236 7.063 -0.251 1.00 10.00 H new ATOM 0 HA ARG B 31 -4.981 8.459 -2.713 1.00 10.00 H new ATOM 0 HB2 ARG B 31 -2.335 7.134 -2.110 1.00 10.00 H new ATOM 0 HB3 ARG B 31 -2.662 8.519 -3.132 1.00 10.00 H new ATOM 0 HG2 ARG B 31 -3.485 9.062 -0.393 1.00 10.00 H new ATOM 0 HG3 ARG B 31 -1.816 8.529 -0.438 1.00 10.00 H new ATOM 0 HD2 ARG B 31 -2.638 10.543 -2.493 1.00 10.00 H new ATOM 0 HD3 ARG B 31 -2.562 11.099 -0.833 1.00 10.00 H new ATOM 0 HE ARG B 31 -0.171 9.643 -1.382 1.00 10.00 H new ATOM 0 HH11 ARG B 31 -1.805 12.638 -2.338 1.00 10.00 H new ATOM 0 HH12 ARG B 31 -0.292 13.486 -2.672 1.00 10.00 H new ATOM 0 HH21 ARG B 31 1.752 10.744 -1.818 1.00 10.00 H new ATOM 0 HH22 ARG B 31 1.709 12.419 -2.379 1.00 10.00 H new ATOM 1256 N LEU B 32 -4.533 5.234 -2.451 1.00 10.00 N ATOM 1257 CA LEU B 32 -4.685 3.945 -3.113 1.00 10.00 C ATOM 1258 C LEU B 32 -6.082 3.821 -3.713 1.00 10.00 C ATOM 1259 O LEU B 32 -6.249 3.369 -4.850 1.00 10.00 O ATOM 1260 CB LEU B 32 -4.431 2.812 -2.112 1.00 10.00 C ATOM 1261 CG LEU B 32 -4.347 1.404 -2.707 1.00 10.00 C ATOM 1262 CD1 LEU B 32 -3.203 0.630 -2.075 1.00 10.00 C ATOM 1263 CD2 LEU B 32 -5.656 0.657 -2.509 1.00 10.00 C ATOM 0 H LEU B 32 -4.377 5.168 -1.445 1.00 10.00 H new ATOM 0 HA LEU B 32 -3.955 3.872 -3.920 1.00 10.00 H new ATOM 0 HB2 LEU B 32 -3.499 3.020 -1.586 1.00 10.00 H new ATOM 0 HB3 LEU B 32 -5.227 2.825 -1.368 1.00 10.00 H new ATOM 0 HG LEU B 32 -4.161 1.497 -3.777 1.00 10.00 H new ATOM 0 HD11 LEU B 32 -3.156 -0.369 -2.508 1.00 10.00 H new ATOM 0 HD12 LEU B 32 -2.264 1.151 -2.262 1.00 10.00 H new ATOM 0 HD13 LEU B 32 -3.367 0.552 -1.000 1.00 10.00 H new ATOM 0 HD21 LEU B 32 -5.574 -0.341 -2.939 1.00 10.00 H new ATOM 0 HD22 LEU B 32 -5.871 0.576 -1.444 1.00 10.00 H new ATOM 0 HD23 LEU B 32 -6.463 1.200 -3.002 1.00 10.00 H new ATOM 1275 N LEU B 33 -7.077 4.262 -2.951 1.00 10.00 N ATOM 1276 CA LEU B 33 -8.467 4.207 -3.386 1.00 10.00 C ATOM 1277 C LEU B 33 -8.740 5.205 -4.510 1.00 10.00 C ATOM 1278 O LEU B 33 -9.749 5.120 -5.201 1.00 10.00 O ATOM 1279 CB LEU B 33 -9.404 4.489 -2.207 1.00 10.00 C ATOM 1280 CG LEU B 33 -9.361 3.465 -1.075 1.00 10.00 C ATOM 1281 CD1 LEU B 33 -10.020 4.026 0.175 1.00 10.00 C ATOM 1282 CD2 LEU B 33 -10.041 2.170 -1.499 1.00 10.00 C ATOM 0 H LEU B 33 -6.945 4.664 -2.023 1.00 10.00 H new ATOM 0 HA LEU B 33 -8.654 3.203 -3.767 1.00 10.00 H new ATOM 0 HB2 LEU B 33 -9.159 5.469 -1.797 1.00 10.00 H new ATOM 0 HB3 LEU B 33 -10.426 4.547 -2.583 1.00 10.00 H new ATOM 0 HG LEU B 33 -8.317 3.248 -0.848 1.00 10.00 H new ATOM 0 HD11 LEU B 33 -9.981 3.283 0.972 1.00 10.00 H new ATOM 0 HD12 LEU B 33 -9.493 4.926 0.492 1.00 10.00 H new ATOM 0 HD13 LEU B 33 -11.060 4.272 -0.041 1.00 10.00 H new ATOM 0 HD21 LEU B 33 -10.000 1.452 -0.679 1.00 10.00 H new ATOM 0 HD22 LEU B 33 -11.082 2.372 -1.753 1.00 10.00 H new ATOM 0 HD23 LEU B 33 -9.528 1.758 -2.368 1.00 10.00 H new ATOM 1294 N GLN B 34 -7.835 6.154 -4.692 1.00 10.00 N ATOM 1295 CA GLN B 34 -7.996 7.154 -5.735 1.00 10.00 C ATOM 1296 C GLN B 34 -7.298 6.717 -7.015 1.00 10.00 C ATOM 1297 O GLN B 34 -7.601 7.211 -8.101 1.00 10.00 O ATOM 1298 CB GLN B 34 -7.445 8.503 -5.275 1.00 10.00 C ATOM 1299 CG GLN B 34 -8.235 9.122 -4.138 1.00 10.00 C ATOM 1300 CD GLN B 34 -9.714 9.230 -4.450 1.00 10.00 C ATOM 1301 OE1 GLN B 34 -10.107 9.438 -5.596 1.00 10.00 O ATOM 1302 NE2 GLN B 34 -10.548 9.080 -3.431 1.00 10.00 N ATOM 0 H GLN B 34 -6.986 6.253 -4.135 1.00 10.00 H new ATOM 0 HA GLN B 34 -9.062 7.260 -5.938 1.00 10.00 H new ATOM 0 HB2 GLN B 34 -6.409 8.375 -4.960 1.00 10.00 H new ATOM 0 HB3 GLN B 34 -7.439 9.192 -6.120 1.00 10.00 H new ATOM 0 HG2 GLN B 34 -8.100 8.523 -3.238 1.00 10.00 H new ATOM 0 HG3 GLN B 34 -7.839 10.114 -3.923 1.00 10.00 H new ATOM 0 HE21 GLN B 34 -10.183 8.909 -2.494 1.00 10.00 H new ATOM 0 HE22 GLN B 34 -11.555 9.136 -3.584 1.00 10.00 H new ATOM 1311 N THR B 35 -6.368 5.781 -6.885 1.00 10.00 N ATOM 1312 CA THR B 35 -5.623 5.290 -8.031 1.00 10.00 C ATOM 1313 C THR B 35 -6.199 3.977 -8.558 1.00 10.00 C ATOM 1314 O THR B 35 -6.261 3.761 -9.765 1.00 10.00 O ATOM 1315 CB THR B 35 -4.135 5.104 -7.683 1.00 10.00 C ATOM 1316 OG1 THR B 35 -4.001 4.646 -6.327 1.00 10.00 O ATOM 1317 CG2 THR B 35 -3.372 6.409 -7.860 1.00 10.00 C ATOM 0 H THR B 35 -6.113 5.348 -5.997 1.00 10.00 H new ATOM 0 HA THR B 35 -5.713 6.042 -8.815 1.00 10.00 H new ATOM 0 HB THR B 35 -3.716 4.360 -8.361 1.00 10.00 H new ATOM 0 HG1 THR B 35 -4.176 5.389 -5.712 1.00 10.00 H new ATOM 0 HG21 THR B 35 -2.323 6.254 -7.609 1.00 10.00 H new ATOM 0 HG22 THR B 35 -3.452 6.740 -8.896 1.00 10.00 H new ATOM 0 HG23 THR B 35 -3.794 7.169 -7.203 1.00 10.00 H new ATOM 1325 N LYS B 36 -6.635 3.107 -7.655 1.00 10.00 N ATOM 1326 CA LYS B 36 -7.201 1.823 -8.055 1.00 10.00 C ATOM 1327 C LYS B 36 -8.716 1.819 -7.890 1.00 10.00 C ATOM 1328 O LYS B 36 -9.351 0.765 -7.962 1.00 10.00 O ATOM 1329 CB LYS B 36 -6.573 0.684 -7.249 1.00 10.00 C ATOM 1330 CG LYS B 36 -5.099 0.478 -7.553 1.00 10.00 C ATOM 1331 CD LYS B 36 -4.251 0.566 -6.295 1.00 10.00 C ATOM 1332 CE LYS B 36 -2.811 0.926 -6.614 1.00 10.00 C ATOM 1333 NZ LYS B 36 -2.703 2.286 -7.207 1.00 10.00 N ATOM 0 H LYS B 36 -6.608 3.265 -6.648 1.00 10.00 H new ATOM 0 HA LYS B 36 -6.974 1.669 -9.110 1.00 10.00 H new ATOM 0 HB2 LYS B 36 -6.693 0.891 -6.186 1.00 10.00 H new ATOM 0 HB3 LYS B 36 -7.113 -0.240 -7.456 1.00 10.00 H new ATOM 0 HG2 LYS B 36 -4.956 -0.496 -8.021 1.00 10.00 H new ATOM 0 HG3 LYS B 36 -4.766 1.229 -8.270 1.00 10.00 H new ATOM 0 HD2 LYS B 36 -4.673 1.313 -5.623 1.00 10.00 H new ATOM 0 HD3 LYS B 36 -4.280 -0.388 -5.769 1.00 10.00 H new ATOM 0 HE2 LYS B 36 -2.213 0.877 -5.704 1.00 10.00 H new ATOM 0 HE3 LYS B 36 -2.397 0.193 -7.307 1.00 10.00 H new ATOM 0 HZ1 LYS B 36 -1.725 2.628 -7.116 1.00 10.00 H new ATOM 0 HZ2 LYS B 36 -2.964 2.248 -8.213 1.00 10.00 H new ATOM 0 HZ3 LYS B 36 -3.344 2.935 -6.707 1.00 10.00 H new ATOM 1347 N ASN B 37 -9.275 3.010 -7.676 1.00 10.00 N ATOM 1348 CA ASN B 37 -10.720 3.197 -7.506 1.00 10.00 C ATOM 1349 C ASN B 37 -11.202 2.631 -6.169 1.00 10.00 C ATOM 1350 O ASN B 37 -10.433 2.029 -5.417 1.00 10.00 O ATOM 1351 CB ASN B 37 -11.498 2.568 -8.669 1.00 10.00 C ATOM 1352 CG ASN B 37 -12.695 3.402 -9.087 1.00 10.00 C ATOM 1353 OD1 ASN B 37 -13.328 4.066 -8.265 1.00 10.00 O ATOM 1354 ND2 ASN B 37 -13.005 3.381 -10.372 1.00 10.00 N ATOM 0 H ASN B 37 -8.739 3.876 -7.615 1.00 10.00 H new ATOM 0 HA ASN B 37 -10.913 4.270 -7.506 1.00 10.00 H new ATOM 0 HB2 ASN B 37 -10.831 2.443 -9.522 1.00 10.00 H new ATOM 0 HB3 ASN B 37 -11.836 1.573 -8.380 1.00 10.00 H new ATOM 0 HD21 ASN B 37 -13.794 3.928 -10.715 1.00 10.00 H new ATOM 0 HD22 ASN B 37 -12.455 2.817 -11.020 1.00 10.00 H new ATOM 1361 N TYR B 38 -12.487 2.827 -5.887 1.00 10.00 N ATOM 1362 CA TYR B 38 -13.093 2.368 -4.638 1.00 10.00 C ATOM 1363 C TYR B 38 -13.551 0.913 -4.746 1.00 10.00 C ATOM 1364 O TYR B 38 -14.659 0.572 -4.331 1.00 10.00 O ATOM 1365 CB TYR B 38 -14.294 3.252 -4.277 1.00 10.00 C ATOM 1366 CG TYR B 38 -13.995 4.736 -4.256 1.00 10.00 C ATOM 1367 CD1 TYR B 38 -13.314 5.311 -3.192 1.00 10.00 C ATOM 1368 CD2 TYR B 38 -14.406 5.562 -5.295 1.00 10.00 C ATOM 1369 CE1 TYR B 38 -13.051 6.667 -3.165 1.00 10.00 C ATOM 1370 CE2 TYR B 38 -14.144 6.917 -5.275 1.00 10.00 C ATOM 1371 CZ TYR B 38 -13.467 7.466 -4.211 1.00 10.00 C ATOM 1372 OH TYR B 38 -13.206 8.819 -4.193 1.00 10.00 O ATOM 0 H TYR B 38 -13.135 3.305 -6.513 1.00 10.00 H new ATOM 0 HA TYR B 38 -12.336 2.438 -3.857 1.00 10.00 H new ATOM 0 HB2 TYR B 38 -15.095 3.065 -4.992 1.00 10.00 H new ATOM 0 HB3 TYR B 38 -14.667 2.955 -3.297 1.00 10.00 H new ATOM 0 HD1 TYR B 38 -12.985 4.689 -2.373 1.00 10.00 H new ATOM 0 HD2 TYR B 38 -14.939 5.137 -6.132 1.00 10.00 H new ATOM 0 HE1 TYR B 38 -12.522 7.100 -2.329 1.00 10.00 H new ATOM 0 HE2 TYR B 38 -14.469 7.544 -6.092 1.00 10.00 H new ATOM 0 HH TYR B 38 -13.566 9.232 -5.005 1.00 10.00 H new ATOM 1382 N ASP B 39 -12.701 0.061 -5.300 1.00 10.00 N ATOM 1383 CA ASP B 39 -13.034 -1.353 -5.444 1.00 10.00 C ATOM 1384 C ASP B 39 -12.366 -2.166 -4.341 1.00 10.00 C ATOM 1385 O ASP B 39 -11.145 -2.334 -4.331 1.00 10.00 O ATOM 1386 CB ASP B 39 -12.609 -1.880 -6.820 1.00 10.00 C ATOM 1387 CG ASP B 39 -13.179 -3.259 -7.106 1.00 10.00 C ATOM 1388 OD1 ASP B 39 -12.555 -4.262 -6.707 1.00 10.00 O ATOM 1389 OD2 ASP B 39 -14.262 -3.345 -7.725 1.00 10.00 O ATOM 0 H ASP B 39 -11.781 0.319 -5.656 1.00 10.00 H new ATOM 0 HA ASP B 39 -14.116 -1.458 -5.358 1.00 10.00 H new ATOM 0 HB2 ASP B 39 -12.939 -1.185 -7.592 1.00 10.00 H new ATOM 0 HB3 ASP B 39 -11.521 -1.920 -6.872 1.00 10.00 H new ATOM 1394 N ILE B 40 -13.174 -2.662 -3.413 1.00 10.00 N ATOM 1395 CA ILE B 40 -12.677 -3.438 -2.280 1.00 10.00 C ATOM 1396 C ILE B 40 -12.045 -4.751 -2.736 1.00 10.00 C ATOM 1397 O ILE B 40 -11.008 -5.167 -2.213 1.00 10.00 O ATOM 1398 CB ILE B 40 -13.811 -3.746 -1.278 1.00 10.00 C ATOM 1399 CG1 ILE B 40 -14.623 -2.481 -0.976 1.00 10.00 C ATOM 1400 CG2 ILE B 40 -13.243 -4.331 0.008 1.00 10.00 C ATOM 1401 CD1 ILE B 40 -15.940 -2.757 -0.281 1.00 10.00 C ATOM 0 H ILE B 40 -14.187 -2.540 -3.422 1.00 10.00 H new ATOM 0 HA ILE B 40 -11.916 -2.830 -1.790 1.00 10.00 H new ATOM 0 HB ILE B 40 -14.476 -4.483 -1.730 1.00 10.00 H new ATOM 0 HG12 ILE B 40 -14.025 -1.816 -0.353 1.00 10.00 H new ATOM 0 HG13 ILE B 40 -14.818 -1.953 -1.910 1.00 10.00 H new ATOM 0 HG21 ILE B 40 -14.056 -4.542 0.702 1.00 10.00 H new ATOM 0 HG22 ILE B 40 -12.709 -5.254 -0.217 1.00 10.00 H new ATOM 0 HG23 ILE B 40 -12.556 -3.616 0.461 1.00 10.00 H new ATOM 0 HD11 ILE B 40 -16.460 -1.816 -0.099 1.00 10.00 H new ATOM 0 HD12 ILE B 40 -16.557 -3.397 -0.912 1.00 10.00 H new ATOM 0 HD13 ILE B 40 -15.752 -3.257 0.669 1.00 10.00 H new ATOM 1413 N GLY B 41 -12.668 -5.389 -3.723 1.00 10.00 N ATOM 1414 CA GLY B 41 -12.164 -6.653 -4.234 1.00 10.00 C ATOM 1415 C GLY B 41 -10.732 -6.549 -4.723 1.00 10.00 C ATOM 1416 O GLY B 41 -9.868 -7.330 -4.321 1.00 10.00 O ATOM 0 H GLY B 41 -13.516 -5.052 -4.180 1.00 10.00 H new ATOM 0 HA2 GLY B 41 -12.224 -7.408 -3.450 1.00 10.00 H new ATOM 0 HA3 GLY B 41 -12.801 -6.991 -5.052 1.00 10.00 H new ATOM 1420 N ALA B 42 -10.481 -5.573 -5.581 1.00 10.00 N ATOM 1421 CA ALA B 42 -9.152 -5.356 -6.129 1.00 10.00 C ATOM 1422 C ALA B 42 -8.169 -4.933 -5.041 1.00 10.00 C ATOM 1423 O ALA B 42 -7.015 -5.363 -5.037 1.00 10.00 O ATOM 1424 CB ALA B 42 -9.204 -4.310 -7.231 1.00 10.00 C ATOM 0 H ALA B 42 -11.185 -4.915 -5.914 1.00 10.00 H new ATOM 0 HA ALA B 42 -8.801 -6.298 -6.550 1.00 10.00 H new ATOM 0 HB1 ALA B 42 -8.203 -4.156 -7.634 1.00 10.00 H new ATOM 0 HB2 ALA B 42 -9.866 -4.652 -8.026 1.00 10.00 H new ATOM 0 HB3 ALA B 42 -9.580 -3.371 -6.824 1.00 10.00 H new ATOM 1430 N ALA B 43 -8.636 -4.096 -4.122 1.00 10.00 N ATOM 1431 CA ALA B 43 -7.807 -3.598 -3.027 1.00 10.00 C ATOM 1432 C ALA B 43 -7.187 -4.734 -2.217 1.00 10.00 C ATOM 1433 O ALA B 43 -5.970 -4.768 -2.014 1.00 10.00 O ATOM 1434 CB ALA B 43 -8.623 -2.683 -2.119 1.00 10.00 C ATOM 0 H ALA B 43 -9.593 -3.744 -4.113 1.00 10.00 H new ATOM 0 HA ALA B 43 -6.989 -3.028 -3.469 1.00 10.00 H new ATOM 0 HB1 ALA B 43 -7.993 -2.319 -1.308 1.00 10.00 H new ATOM 0 HB2 ALA B 43 -8.996 -1.837 -2.696 1.00 10.00 H new ATOM 0 HB3 ALA B 43 -9.464 -3.238 -1.704 1.00 10.00 H new ATOM 1440 N LEU B 44 -8.021 -5.669 -1.779 1.00 10.00 N ATOM 1441 CA LEU B 44 -7.559 -6.804 -0.979 1.00 10.00 C ATOM 1442 C LEU B 44 -6.603 -7.693 -1.770 1.00 10.00 C ATOM 1443 O LEU B 44 -5.553 -8.095 -1.268 1.00 10.00 O ATOM 1444 CB LEU B 44 -8.757 -7.632 -0.495 1.00 10.00 C ATOM 1445 CG LEU B 44 -9.282 -7.279 0.903 1.00 10.00 C ATOM 1446 CD1 LEU B 44 -9.717 -5.821 0.976 1.00 10.00 C ATOM 1447 CD2 LEU B 44 -10.439 -8.192 1.282 1.00 10.00 C ATOM 0 H LEU B 44 -9.024 -5.666 -1.963 1.00 10.00 H new ATOM 0 HA LEU B 44 -7.020 -6.407 -0.119 1.00 10.00 H new ATOM 0 HB2 LEU B 44 -9.571 -7.514 -1.210 1.00 10.00 H new ATOM 0 HB3 LEU B 44 -8.476 -8.685 -0.503 1.00 10.00 H new ATOM 0 HG LEU B 44 -8.468 -7.426 1.613 1.00 10.00 H new ATOM 0 HD11 LEU B 44 -10.084 -5.601 1.978 1.00 10.00 H new ATOM 0 HD12 LEU B 44 -8.868 -5.176 0.751 1.00 10.00 H new ATOM 0 HD13 LEU B 44 -10.511 -5.641 0.251 1.00 10.00 H new ATOM 0 HD21 LEU B 44 -10.800 -7.929 2.276 1.00 10.00 H new ATOM 0 HD22 LEU B 44 -11.247 -8.074 0.560 1.00 10.00 H new ATOM 0 HD23 LEU B 44 -10.100 -9.228 1.282 1.00 10.00 H new ATOM 1459 N ASP B 45 -6.969 -7.983 -3.013 1.00 10.00 N ATOM 1460 CA ASP B 45 -6.161 -8.832 -3.889 1.00 10.00 C ATOM 1461 C ASP B 45 -4.773 -8.247 -4.131 1.00 10.00 C ATOM 1462 O ASP B 45 -3.785 -8.979 -4.212 1.00 10.00 O ATOM 1463 CB ASP B 45 -6.873 -9.026 -5.231 1.00 10.00 C ATOM 1464 CG ASP B 45 -5.984 -9.660 -6.281 1.00 10.00 C ATOM 1465 OD1 ASP B 45 -5.883 -10.903 -6.313 1.00 10.00 O ATOM 1466 OD2 ASP B 45 -5.390 -8.914 -7.092 1.00 10.00 O ATOM 0 H ASP B 45 -7.828 -7.640 -3.443 1.00 10.00 H new ATOM 0 HA ASP B 45 -6.038 -9.792 -3.388 1.00 10.00 H new ATOM 0 HB2 ASP B 45 -7.754 -9.650 -5.083 1.00 10.00 H new ATOM 0 HB3 ASP B 45 -7.224 -8.060 -5.594 1.00 10.00 H new ATOM 1471 N THR B 46 -4.707 -6.931 -4.230 1.00 10.00 N ATOM 1472 CA THR B 46 -3.449 -6.240 -4.477 1.00 10.00 C ATOM 1473 C THR B 46 -2.424 -6.498 -3.366 1.00 10.00 C ATOM 1474 O THR B 46 -1.226 -6.586 -3.635 1.00 10.00 O ATOM 1475 CB THR B 46 -3.683 -4.722 -4.631 1.00 10.00 C ATOM 1476 OG1 THR B 46 -4.639 -4.487 -5.675 1.00 10.00 O ATOM 1477 CG2 THR B 46 -2.392 -3.988 -4.963 1.00 10.00 C ATOM 0 H THR B 46 -5.515 -6.314 -4.143 1.00 10.00 H new ATOM 0 HA THR B 46 -3.043 -6.639 -5.407 1.00 10.00 H new ATOM 0 HB THR B 46 -4.058 -4.343 -3.680 1.00 10.00 H new ATOM 0 HG1 THR B 46 -5.541 -4.462 -5.293 1.00 10.00 H new ATOM 0 HG21 THR B 46 -2.595 -2.922 -5.064 1.00 10.00 H new ATOM 0 HG22 THR B 46 -1.668 -4.145 -4.163 1.00 10.00 H new ATOM 0 HG23 THR B 46 -1.987 -4.370 -5.900 1.00 10.00 H new ATOM 1485 N ILE B 47 -2.892 -6.645 -2.129 1.00 10.00 N ATOM 1486 CA ILE B 47 -1.987 -6.874 -1.008 1.00 10.00 C ATOM 1487 C ILE B 47 -2.010 -8.323 -0.528 1.00 10.00 C ATOM 1488 O ILE B 47 -1.390 -8.653 0.486 1.00 10.00 O ATOM 1489 CB ILE B 47 -2.314 -5.949 0.184 1.00 10.00 C ATOM 1490 CG1 ILE B 47 -3.769 -6.130 0.623 1.00 10.00 C ATOM 1491 CG2 ILE B 47 -2.041 -4.496 -0.182 1.00 10.00 C ATOM 1492 CD1 ILE B 47 -4.086 -5.502 1.960 1.00 10.00 C ATOM 0 H ILE B 47 -3.881 -6.610 -1.880 1.00 10.00 H new ATOM 0 HA ILE B 47 -0.989 -6.647 -1.383 1.00 10.00 H new ATOM 0 HB ILE B 47 -1.669 -6.221 1.020 1.00 10.00 H new ATOM 0 HG12 ILE B 47 -4.423 -5.699 -0.135 1.00 10.00 H new ATOM 0 HG13 ILE B 47 -3.995 -7.195 0.670 1.00 10.00 H new ATOM 0 HG21 ILE B 47 -2.276 -3.856 0.668 1.00 10.00 H new ATOM 0 HG22 ILE B 47 -0.990 -4.378 -0.445 1.00 10.00 H new ATOM 0 HG23 ILE B 47 -2.661 -4.212 -1.032 1.00 10.00 H new ATOM 0 HD11 ILE B 47 -5.135 -5.672 2.202 1.00 10.00 H new ATOM 0 HD12 ILE B 47 -3.458 -5.950 2.730 1.00 10.00 H new ATOM 0 HD13 ILE B 47 -3.894 -4.430 1.913 1.00 10.00 H new ATOM 1504 N GLN B 48 -2.741 -9.174 -1.251 1.00 10.00 N ATOM 1505 CA GLN B 48 -2.868 -10.607 -0.935 1.00 10.00 C ATOM 1506 C GLN B 48 -3.720 -10.862 0.306 1.00 10.00 C ATOM 1507 O GLN B 48 -4.517 -11.799 0.328 1.00 10.00 O ATOM 1508 CB GLN B 48 -1.500 -11.272 -0.755 1.00 10.00 C ATOM 1509 CG GLN B 48 -1.033 -12.047 -1.972 1.00 10.00 C ATOM 1510 CD GLN B 48 -2.049 -13.072 -2.444 1.00 10.00 C ATOM 1511 OE1 GLN B 48 -2.787 -13.655 -1.647 1.00 10.00 O ATOM 1512 NE2 GLN B 48 -2.102 -13.293 -3.749 1.00 10.00 N ATOM 0 H GLN B 48 -3.267 -8.891 -2.078 1.00 10.00 H new ATOM 0 HA GLN B 48 -3.373 -11.052 -1.792 1.00 10.00 H new ATOM 0 HB2 GLN B 48 -0.762 -10.506 -0.518 1.00 10.00 H new ATOM 0 HB3 GLN B 48 -1.544 -11.947 0.100 1.00 10.00 H new ATOM 0 HG2 GLN B 48 -0.824 -11.349 -2.783 1.00 10.00 H new ATOM 0 HG3 GLN B 48 -0.096 -12.552 -1.737 1.00 10.00 H new ATOM 0 HE21 GLN B 48 -1.475 -12.791 -4.377 1.00 10.00 H new ATOM 0 HE22 GLN B 48 -2.770 -13.965 -4.126 1.00 10.00 H new ATOM 1521 N TYR B 49 -3.536 -10.043 1.334 1.00 10.00 N ATOM 1522 CA TYR B 49 -4.277 -10.181 2.582 1.00 10.00 C ATOM 1523 C TYR B 49 -5.772 -9.943 2.369 1.00 10.00 C ATOM 1524 O TYR B 49 -6.276 -8.841 2.577 1.00 10.00 O ATOM 1525 CB TYR B 49 -3.726 -9.210 3.633 1.00 10.00 C ATOM 1526 CG TYR B 49 -2.419 -9.656 4.253 1.00 10.00 C ATOM 1527 CD1 TYR B 49 -2.409 -10.503 5.353 1.00 10.00 C ATOM 1528 CD2 TYR B 49 -1.196 -9.229 3.743 1.00 10.00 C ATOM 1529 CE1 TYR B 49 -1.223 -10.913 5.927 1.00 10.00 C ATOM 1530 CE2 TYR B 49 -0.003 -9.637 4.314 1.00 10.00 C ATOM 1531 CZ TYR B 49 -0.023 -10.480 5.405 1.00 10.00 C ATOM 1532 OH TYR B 49 1.163 -10.895 5.977 1.00 10.00 O ATOM 0 H TYR B 49 -2.873 -9.268 1.327 1.00 10.00 H new ATOM 0 HA TYR B 49 -4.149 -11.203 2.940 1.00 10.00 H new ATOM 0 HB2 TYR B 49 -3.583 -8.233 3.172 1.00 10.00 H new ATOM 0 HB3 TYR B 49 -4.467 -9.085 4.422 1.00 10.00 H new ATOM 0 HD1 TYR B 49 -3.346 -10.847 5.767 1.00 10.00 H new ATOM 0 HD2 TYR B 49 -1.178 -8.569 2.888 1.00 10.00 H new ATOM 0 HE1 TYR B 49 -1.235 -11.571 6.783 1.00 10.00 H new ATOM 0 HE2 TYR B 49 0.938 -9.297 3.907 1.00 10.00 H new ATOM 0 HH TYR B 49 1.917 -10.501 5.490 1.00 10.00 H new ATOM 1542 N SER B 50 -6.468 -10.983 1.932 1.00 10.00 N ATOM 1543 CA SER B 50 -7.897 -10.902 1.693 1.00 10.00 C ATOM 1544 C SER B 50 -8.658 -11.746 2.712 1.00 10.00 C ATOM 1545 O SER B 50 -9.829 -11.495 2.996 1.00 10.00 O ATOM 1546 CB SER B 50 -8.213 -11.369 0.272 1.00 10.00 C ATOM 1547 OG SER B 50 -7.273 -10.846 -0.653 1.00 10.00 O ATOM 0 H SER B 50 -6.060 -11.897 1.736 1.00 10.00 H new ATOM 0 HA SER B 50 -8.214 -9.865 1.803 1.00 10.00 H new ATOM 0 HB2 SER B 50 -8.202 -12.458 0.232 1.00 10.00 H new ATOM 0 HB3 SER B 50 -9.218 -11.050 -0.005 1.00 10.00 H new ATOM 0 HG SER B 50 -7.493 -11.159 -1.555 1.00 10.00 H new ATOM 1553 N LYS B 51 -7.980 -12.745 3.267 1.00 10.00 N ATOM 1554 CA LYS B 51 -8.584 -13.631 4.250 1.00 10.00 C ATOM 1555 C LYS B 51 -7.802 -13.579 5.558 1.00 10.00 C ATOM 1556 O LYS B 51 -8.320 -13.142 6.583 1.00 10.00 O ATOM 1557 CB LYS B 51 -8.633 -15.070 3.726 1.00 10.00 C ATOM 1558 CG LYS B 51 -9.409 -15.226 2.427 1.00 10.00 C ATOM 1559 CD LYS B 51 -9.450 -16.676 1.970 1.00 10.00 C ATOM 1560 CE LYS B 51 -10.504 -17.473 2.724 1.00 10.00 C ATOM 1561 NZ LYS B 51 -11.885 -17.005 2.422 1.00 10.00 N ATOM 0 H LYS B 51 -7.007 -12.960 3.050 1.00 10.00 H new ATOM 0 HA LYS B 51 -9.604 -13.294 4.432 1.00 10.00 H new ATOM 0 HB2 LYS B 51 -7.614 -15.426 3.574 1.00 10.00 H new ATOM 0 HB3 LYS B 51 -9.084 -15.708 4.486 1.00 10.00 H new ATOM 0 HG2 LYS B 51 -10.426 -14.858 2.564 1.00 10.00 H new ATOM 0 HG3 LYS B 51 -8.949 -14.613 1.652 1.00 10.00 H new ATOM 0 HD2 LYS B 51 -9.660 -16.715 0.901 1.00 10.00 H new ATOM 0 HD3 LYS B 51 -8.472 -17.133 2.120 1.00 10.00 H new ATOM 0 HE2 LYS B 51 -10.415 -18.528 2.464 1.00 10.00 H new ATOM 0 HE3 LYS B 51 -10.321 -17.392 3.795 1.00 10.00 H new ATOM 0 HZ1 LYS B 51 -12.565 -17.758 2.650 1.00 10.00 H new ATOM 0 HZ2 LYS B 51 -12.098 -16.162 2.992 1.00 10.00 H new ATOM 0 HZ3 LYS B 51 -11.958 -16.767 1.412 1.00 10.00 H new ATOM 1575 N HIS B 52 -6.548 -14.011 5.506 1.00 10.00 N ATOM 1576 CA HIS B 52 -5.687 -14.016 6.680 1.00 10.00 C ATOM 1577 C HIS B 52 -4.231 -14.083 6.246 1.00 10.00 C ATOM 1578 O HIS B 52 -3.350 -13.748 7.061 1.00 10.00 O ATOM 1579 CB HIS B 52 -6.009 -15.205 7.590 1.00 10.00 C ATOM 1580 CG HIS B 52 -5.847 -14.903 9.046 1.00 10.00 C ATOM 1581 ND1 HIS B 52 -4.732 -14.289 9.570 1.00 10.00 N ATOM 1582 CD2 HIS B 52 -6.671 -15.134 10.095 1.00 10.00 C ATOM 1583 CE1 HIS B 52 -4.882 -14.146 10.873 1.00 10.00 C ATOM 1584 NE2 HIS B 52 -6.049 -14.654 11.217 1.00 10.00 N ATOM 1585 OXT HIS B 52 -3.982 -14.479 5.086 1.00 10.00 O ATOM 0 H HIS B 52 -6.104 -14.364 4.658 1.00 10.00 H new ATOM 0 HA HIS B 52 -5.862 -13.097 7.240 1.00 10.00 H new ATOM 0 HB2 HIS B 52 -7.034 -15.526 7.406 1.00 10.00 H new ATOM 0 HB3 HIS B 52 -5.361 -16.040 7.326 1.00 10.00 H new ATOM 0 HD1 HIS B 52 -3.917 -13.991 9.034 1.00 10.00 H new ATOM 0 HD2 HIS B 52 -7.640 -15.609 10.055 1.00 10.00 H new ATOM 0 HE1 HIS B 52 -4.169 -13.690 11.544 1.00 10.00 H new