USER MOD reduce.3.24.130724 H: found=0, std=0, add=977, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 973 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 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= -0.0204 X(o=-0.02,f=-0.071) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.204 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 24:sc=-0.00519 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 ASN : amide:sc= -1.67! X(o=-1.7!,f=-1.9) USER MOD Single : A 61 TYR OH : rot 30:sc= 0 USER MOD Single : A 62 GLN :FLIP amide:sc= -4.81! C(o=-5.9!,f=-4.8!) USER MOD Single : A 64 THR OG1 : rot 23:sc= -1.74! USER MOD Single : A 65 HIS :FLIP no HD1:sc= -1.41 F(o=-2.5!,f=-1.4) USER MOD Single : A 68 ASN : amide:sc= -1.56 K(o=-1.6,f=-3.6!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 30:sc= 0.223 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0.056) USER MOD Single : A 74 THR OG1 : rot 35:sc= -0.839! USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0692 X(o=-0.069,f=-0.53) USER MOD Single : A 87 TYR OH : rot -4:sc= 0.0232 USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.0531 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 28:sc= -0.36 USER MOD Single : A 98 TYR OH : rot 180:sc= 0.958 USER MOD Single : A 103 THR OG1 : rot 180:sc= -1.66 USER MOD Single : A 105 GLN : amide:sc= -0.402 K(o=-0.4,f=-2) USER MOD Single : A 106 THR OG1 : rot 120:sc= -1.3 USER MOD Single : A 108 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0593) USER MOD Single : A 120 THR OG1 : rot 159:sc= 1.33 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.488 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.139 29.954 -55.276 1.00 0.00 N ATOM 2 CA GLY A 1 -16.046 29.306 -56.573 1.00 0.00 C ATOM 3 C GLY A 1 -15.505 27.881 -56.437 1.00 0.00 C ATOM 4 O GLY A 1 -14.306 27.684 -56.251 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.508 30.919 -55.396 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.780 29.412 -54.662 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.196 29.996 -54.841 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.029 29.282 -57.043 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.394 29.885 -57.227 1.00 0.00 H new ATOM 8 N SER A 2 -16.417 26.925 -56.534 1.00 0.00 N ATOM 9 CA SER A 2 -16.047 25.524 -56.424 1.00 0.00 C ATOM 10 C SER A 2 -15.445 25.249 -55.044 1.00 0.00 C ATOM 11 O SER A 2 -15.159 26.178 -54.291 1.00 0.00 O ATOM 12 CB SER A 2 -15.059 25.128 -57.522 1.00 0.00 C ATOM 13 OG SER A 2 -15.607 25.311 -58.825 1.00 0.00 O ATOM 0 H SER A 2 -17.411 27.093 -56.688 1.00 0.00 H new ATOM 0 HA SER A 2 -16.947 24.922 -56.548 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.151 25.723 -57.424 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.772 24.084 -57.393 1.00 0.00 H new ATOM 0 HG SER A 2 -14.945 25.049 -59.498 1.00 0.00 H new ATOM 19 N SER A 3 -15.270 23.968 -54.755 1.00 0.00 N ATOM 20 CA SER A 3 -14.708 23.558 -53.479 1.00 0.00 C ATOM 21 C SER A 3 -14.553 22.037 -53.440 1.00 0.00 C ATOM 22 O SER A 3 -15.033 21.337 -54.330 1.00 0.00 O ATOM 23 CB SER A 3 -15.579 24.033 -52.315 1.00 0.00 C ATOM 24 OG SER A 3 -16.961 23.765 -52.538 1.00 0.00 O ATOM 0 H SER A 3 -15.508 23.200 -55.383 1.00 0.00 H new ATOM 0 HA SER A 3 -13.726 24.020 -53.374 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.258 23.540 -51.397 1.00 0.00 H new ATOM 0 HB3 SER A 3 -15.436 25.104 -52.169 1.00 0.00 H new ATOM 0 HG SER A 3 -17.483 24.082 -51.772 1.00 0.00 H new ATOM 30 N GLY A 4 -13.880 21.569 -52.398 1.00 0.00 N ATOM 31 CA GLY A 4 -13.656 20.143 -52.231 1.00 0.00 C ATOM 32 C GLY A 4 -12.218 19.863 -51.788 1.00 0.00 C ATOM 33 O GLY A 4 -11.288 20.544 -52.218 1.00 0.00 O ATOM 0 H GLY A 4 -13.483 22.152 -51.661 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.352 19.746 -51.492 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.858 19.627 -53.169 1.00 0.00 H new ATOM 37 N SER A 5 -12.081 18.859 -50.935 1.00 0.00 N ATOM 38 CA SER A 5 -10.773 18.480 -50.429 1.00 0.00 C ATOM 39 C SER A 5 -10.910 17.322 -49.439 1.00 0.00 C ATOM 40 O SER A 5 -12.020 16.958 -49.053 1.00 0.00 O ATOM 41 CB SER A 5 -10.074 19.667 -49.764 1.00 0.00 C ATOM 42 OG SER A 5 -8.858 20.009 -50.423 1.00 0.00 O ATOM 0 H SER A 5 -12.855 18.296 -50.581 1.00 0.00 H new ATOM 0 HA SER A 5 -10.161 18.159 -51.272 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.742 20.528 -49.766 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.866 19.427 -48.721 1.00 0.00 H new ATOM 0 HG SER A 5 -8.443 20.772 -49.969 1.00 0.00 H new ATOM 48 N SER A 6 -9.766 16.775 -49.055 1.00 0.00 N ATOM 49 CA SER A 6 -9.745 15.665 -48.116 1.00 0.00 C ATOM 50 C SER A 6 -8.464 15.712 -47.280 1.00 0.00 C ATOM 51 O SER A 6 -7.568 16.508 -47.555 1.00 0.00 O ATOM 52 CB SER A 6 -9.853 14.325 -48.846 1.00 0.00 C ATOM 53 OG SER A 6 -10.925 13.530 -48.345 1.00 0.00 O ATOM 0 H SER A 6 -8.847 17.079 -49.377 1.00 0.00 H new ATOM 0 HA SER A 6 -10.607 15.759 -47.455 1.00 0.00 H new ATOM 0 HB2 SER A 6 -10.001 14.503 -49.911 1.00 0.00 H new ATOM 0 HB3 SER A 6 -8.916 13.778 -48.741 1.00 0.00 H new ATOM 0 HG SER A 6 -10.962 12.683 -48.837 1.00 0.00 H new ATOM 59 N GLY A 7 -8.420 14.849 -46.276 1.00 0.00 N ATOM 60 CA GLY A 7 -7.265 14.782 -45.397 1.00 0.00 C ATOM 61 C GLY A 7 -7.201 13.434 -44.677 1.00 0.00 C ATOM 62 O GLY A 7 -8.009 12.545 -44.942 1.00 0.00 O ATOM 0 H GLY A 7 -9.166 14.190 -46.052 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.354 14.933 -45.976 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.314 15.588 -44.664 1.00 0.00 H new ATOM 66 N ARG A 8 -6.233 13.324 -43.779 1.00 0.00 N ATOM 67 CA ARG A 8 -6.054 12.099 -43.018 1.00 0.00 C ATOM 68 C ARG A 8 -5.651 12.423 -41.578 1.00 0.00 C ATOM 69 O ARG A 8 -5.020 13.448 -41.322 1.00 0.00 O ATOM 70 CB ARG A 8 -4.983 11.209 -43.652 1.00 0.00 C ATOM 71 CG ARG A 8 -3.583 11.632 -43.204 1.00 0.00 C ATOM 72 CD ARG A 8 -3.100 10.776 -42.031 1.00 0.00 C ATOM 73 NE ARG A 8 -1.766 10.211 -42.333 1.00 0.00 N ATOM 74 CZ ARG A 8 -1.229 9.165 -41.688 1.00 0.00 C ATOM 75 NH1 ARG A 8 -1.910 8.565 -40.703 1.00 0.00 N ATOM 76 NH2 ARG A 8 -0.012 8.721 -42.029 1.00 0.00 N ATOM 0 H ARG A 8 -5.564 14.063 -43.561 1.00 0.00 H new ATOM 0 HA ARG A 8 -7.004 11.564 -43.022 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -5.159 10.169 -43.375 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -5.054 11.266 -44.738 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -2.887 11.539 -44.038 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -3.592 12.682 -42.913 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -3.052 11.380 -41.125 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -3.810 9.971 -41.840 1.00 0.00 H new ATOM 0 HE ARG A 8 -1.221 10.644 -43.078 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -2.837 8.904 -40.444 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -1.502 7.769 -40.212 1.00 0.00 H new ATOM 0 HH21 ARG A 8 0.506 9.179 -42.779 1.00 0.00 H new ATOM 0 HH22 ARG A 8 0.397 7.925 -41.538 1.00 0.00 H new ATOM 90 N ILE A 9 -6.031 11.531 -40.676 1.00 0.00 N ATOM 91 CA ILE A 9 -5.717 11.709 -39.268 1.00 0.00 C ATOM 92 C ILE A 9 -4.588 10.753 -38.877 1.00 0.00 C ATOM 93 O ILE A 9 -4.658 9.557 -39.156 1.00 0.00 O ATOM 94 CB ILE A 9 -6.978 11.553 -38.414 1.00 0.00 C ATOM 95 CG1 ILE A 9 -8.062 12.540 -38.852 1.00 0.00 C ATOM 96 CG2 ILE A 9 -6.651 11.685 -36.925 1.00 0.00 C ATOM 97 CD1 ILE A 9 -7.826 13.922 -38.238 1.00 0.00 C ATOM 0 H ILE A 9 -6.554 10.682 -40.892 1.00 0.00 H new ATOM 0 HA ILE A 9 -5.357 12.721 -39.083 1.00 0.00 H new ATOM 0 HB ILE A 9 -7.374 10.549 -38.569 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -8.070 12.618 -39.939 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -9.041 12.167 -38.552 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -7.564 11.570 -36.340 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -5.938 10.912 -36.639 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -6.218 12.667 -36.733 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -8.610 14.604 -38.565 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -7.843 13.845 -37.151 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.857 14.302 -38.560 1.00 0.00 H new ATOM 109 N GLY A 10 -3.574 11.317 -38.237 1.00 0.00 N ATOM 110 CA GLY A 10 -2.431 10.530 -37.805 1.00 0.00 C ATOM 111 C GLY A 10 -1.455 11.382 -36.992 1.00 0.00 C ATOM 112 O GLY A 10 -1.058 12.463 -37.425 1.00 0.00 O ATOM 0 H GLY A 10 -3.520 12.309 -38.007 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -2.772 9.687 -37.204 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -1.921 10.116 -38.674 1.00 0.00 H new ATOM 116 N ASP A 11 -1.096 10.864 -35.827 1.00 0.00 N ATOM 117 CA ASP A 11 -0.174 11.563 -34.948 1.00 0.00 C ATOM 118 C ASP A 11 0.214 10.645 -33.788 1.00 0.00 C ATOM 119 O ASP A 11 -0.372 9.578 -33.613 1.00 0.00 O ATOM 120 CB ASP A 11 -0.818 12.821 -34.362 1.00 0.00 C ATOM 121 CG ASP A 11 -1.979 12.563 -33.399 1.00 0.00 C ATOM 122 OD1 ASP A 11 -1.685 12.266 -32.221 1.00 0.00 O ATOM 123 OD2 ASP A 11 -3.135 12.669 -33.863 1.00 0.00 O ATOM 0 H ASP A 11 -1.427 9.967 -35.471 1.00 0.00 H new ATOM 0 HA ASP A 11 0.701 11.846 -35.534 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -0.052 13.393 -33.839 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -1.177 13.443 -35.182 1.00 0.00 H new ATOM 128 N GLY A 12 1.199 11.094 -33.024 1.00 0.00 N ATOM 129 CA GLY A 12 1.672 10.326 -31.885 1.00 0.00 C ATOM 130 C GLY A 12 2.743 11.097 -31.110 1.00 0.00 C ATOM 131 O GLY A 12 3.228 12.128 -31.574 1.00 0.00 O ATOM 0 H GLY A 12 1.682 11.980 -33.172 1.00 0.00 H new ATOM 0 HA2 GLY A 12 0.836 10.095 -31.225 1.00 0.00 H new ATOM 0 HA3 GLY A 12 2.080 9.375 -32.227 1.00 0.00 H new ATOM 135 N SER A 13 3.082 10.567 -29.944 1.00 0.00 N ATOM 136 CA SER A 13 4.086 11.193 -29.101 1.00 0.00 C ATOM 137 C SER A 13 4.574 10.200 -28.044 1.00 0.00 C ATOM 138 O SER A 13 4.058 10.174 -26.927 1.00 0.00 O ATOM 139 CB SER A 13 3.537 12.454 -28.432 1.00 0.00 C ATOM 140 OG SER A 13 4.424 13.560 -28.567 1.00 0.00 O ATOM 0 H SER A 13 2.679 9.711 -29.563 1.00 0.00 H new ATOM 0 HA SER A 13 4.926 11.486 -29.731 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.573 12.707 -28.872 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.363 12.256 -27.374 1.00 0.00 H new ATOM 0 HG SER A 13 4.036 14.346 -28.128 1.00 0.00 H new ATOM 146 N PRO A 14 5.588 9.386 -28.443 1.00 0.00 N ATOM 147 CA PRO A 14 6.150 8.395 -27.542 1.00 0.00 C ATOM 148 C PRO A 14 7.046 9.054 -26.491 1.00 0.00 C ATOM 149 O PRO A 14 7.422 10.217 -26.632 1.00 0.00 O ATOM 150 CB PRO A 14 6.902 7.428 -28.442 1.00 0.00 C ATOM 151 CG PRO A 14 7.123 8.164 -29.753 1.00 0.00 C ATOM 152 CD PRO A 14 6.223 9.389 -29.757 1.00 0.00 C ATOM 0 HA PRO A 14 5.388 7.871 -26.965 1.00 0.00 H new ATOM 0 HB2 PRO A 14 7.851 7.135 -27.994 1.00 0.00 H new ATOM 0 HB3 PRO A 14 6.329 6.514 -28.599 1.00 0.00 H new ATOM 0 HG2 PRO A 14 8.168 8.458 -29.855 1.00 0.00 H new ATOM 0 HG3 PRO A 14 6.890 7.516 -30.598 1.00 0.00 H new ATOM 0 HD2 PRO A 14 6.797 10.302 -29.917 1.00 0.00 H new ATOM 0 HD3 PRO A 14 5.482 9.334 -30.555 1.00 0.00 H new ATOM 160 N SER A 15 7.363 8.282 -25.462 1.00 0.00 N ATOM 161 CA SER A 15 8.208 8.776 -24.389 1.00 0.00 C ATOM 162 C SER A 15 9.376 7.815 -24.157 1.00 0.00 C ATOM 163 O SER A 15 9.374 6.696 -24.668 1.00 0.00 O ATOM 164 CB SER A 15 7.408 8.960 -23.098 1.00 0.00 C ATOM 165 OG SER A 15 7.179 10.335 -22.802 1.00 0.00 O ATOM 0 H SER A 15 7.050 7.318 -25.349 1.00 0.00 H new ATOM 0 HA SER A 15 8.600 9.749 -24.684 1.00 0.00 H new ATOM 0 HB2 SER A 15 6.452 8.445 -23.188 1.00 0.00 H new ATOM 0 HB3 SER A 15 7.944 8.496 -22.270 1.00 0.00 H new ATOM 0 HG SER A 15 6.664 10.409 -21.972 1.00 0.00 H new ATOM 171 N HIS A 16 10.345 8.287 -23.387 1.00 0.00 N ATOM 172 CA HIS A 16 11.517 7.484 -23.082 1.00 0.00 C ATOM 173 C HIS A 16 11.865 7.627 -21.599 1.00 0.00 C ATOM 174 O HIS A 16 11.645 8.682 -21.005 1.00 0.00 O ATOM 175 CB HIS A 16 12.682 7.851 -24.002 1.00 0.00 C ATOM 176 CG HIS A 16 12.455 7.495 -25.452 1.00 0.00 C ATOM 177 ND1 HIS A 16 12.170 6.208 -25.873 1.00 0.00 N ATOM 178 CD2 HIS A 16 12.471 8.272 -26.573 1.00 0.00 C ATOM 179 CE1 HIS A 16 12.025 6.221 -27.190 1.00 0.00 C ATOM 180 NE2 HIS A 16 12.213 7.501 -27.622 1.00 0.00 N ATOM 0 H HIS A 16 10.343 9.216 -22.965 1.00 0.00 H new ATOM 0 HA HIS A 16 11.300 6.432 -23.269 1.00 0.00 H new ATOM 0 HB2 HIS A 16 12.868 8.922 -23.926 1.00 0.00 H new ATOM 0 HB3 HIS A 16 13.582 7.346 -23.651 1.00 0.00 H new ATOM 0 HD2 HIS A 16 12.661 9.335 -26.602 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.798 5.368 -27.812 1.00 0.00 H new ATOM 0 HE2 HIS A 16 12.163 7.814 -28.592 1.00 0.00 H new ATOM 188 N PRO A 17 12.417 6.523 -21.029 1.00 0.00 N ATOM 189 CA PRO A 17 12.798 6.515 -19.626 1.00 0.00 C ATOM 190 C PRO A 17 14.083 7.315 -19.403 1.00 0.00 C ATOM 191 O PRO A 17 14.852 7.535 -20.338 1.00 0.00 O ATOM 192 CB PRO A 17 12.943 5.046 -19.266 1.00 0.00 C ATOM 193 CG PRO A 17 13.093 4.306 -20.585 1.00 0.00 C ATOM 194 CD PRO A 17 12.692 5.256 -21.701 1.00 0.00 C ATOM 0 HA PRO A 17 12.058 6.997 -18.986 1.00 0.00 H new ATOM 0 HB2 PRO A 17 13.811 4.884 -18.627 1.00 0.00 H new ATOM 0 HB3 PRO A 17 12.072 4.691 -18.716 1.00 0.00 H new ATOM 0 HG2 PRO A 17 14.121 3.971 -20.720 1.00 0.00 H new ATOM 0 HG3 PRO A 17 12.464 3.416 -20.597 1.00 0.00 H new ATOM 0 HD2 PRO A 17 13.490 5.363 -22.436 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.814 4.892 -22.234 1.00 0.00 H new ATOM 202 N PRO A 18 14.282 7.739 -18.126 1.00 0.00 N ATOM 203 CA PRO A 18 15.460 8.509 -17.768 1.00 0.00 C ATOM 204 C PRO A 18 16.700 7.615 -17.701 1.00 0.00 C ATOM 205 O PRO A 18 16.586 6.400 -17.547 1.00 0.00 O ATOM 206 CB PRO A 18 15.119 9.153 -16.434 1.00 0.00 C ATOM 207 CG PRO A 18 13.954 8.355 -15.872 1.00 0.00 C ATOM 208 CD PRO A 18 13.393 7.497 -16.994 1.00 0.00 C ATOM 0 HA PRO A 18 15.707 9.268 -18.510 1.00 0.00 H new ATOM 0 HB2 PRO A 18 15.973 9.126 -15.758 1.00 0.00 H new ATOM 0 HB3 PRO A 18 14.848 10.201 -16.564 1.00 0.00 H new ATOM 0 HG2 PRO A 18 14.284 7.730 -15.042 1.00 0.00 H new ATOM 0 HG3 PRO A 18 13.186 9.023 -15.482 1.00 0.00 H new ATOM 0 HD2 PRO A 18 13.381 6.443 -16.718 1.00 0.00 H new ATOM 0 HD3 PRO A 18 12.366 7.776 -17.230 1.00 0.00 H new ATOM 216 N ILE A 19 17.856 8.252 -17.819 1.00 0.00 N ATOM 217 CA ILE A 19 19.116 7.529 -17.773 1.00 0.00 C ATOM 218 C ILE A 19 19.540 7.343 -16.315 1.00 0.00 C ATOM 219 O ILE A 19 20.616 7.784 -15.916 1.00 0.00 O ATOM 220 CB ILE A 19 20.168 8.232 -18.634 1.00 0.00 C ATOM 221 CG1 ILE A 19 19.775 8.204 -20.112 1.00 0.00 C ATOM 222 CG2 ILE A 19 21.557 7.635 -18.399 1.00 0.00 C ATOM 223 CD1 ILE A 19 20.498 9.303 -20.893 1.00 0.00 C ATOM 0 H ILE A 19 17.947 9.260 -17.946 1.00 0.00 H new ATOM 0 HA ILE A 19 19.000 6.533 -18.201 1.00 0.00 H new ATOM 0 HB ILE A 19 20.212 9.279 -18.332 1.00 0.00 H new ATOM 0 HG12 ILE A 19 20.018 7.231 -20.538 1.00 0.00 H new ATOM 0 HG13 ILE A 19 18.697 8.334 -20.208 1.00 0.00 H new ATOM 0 HG21 ILE A 19 22.286 8.152 -19.023 1.00 0.00 H new ATOM 0 HG22 ILE A 19 21.830 7.751 -17.350 1.00 0.00 H new ATOM 0 HG23 ILE A 19 21.546 6.576 -18.656 1.00 0.00 H new ATOM 0 HD11 ILE A 19 20.201 9.261 -21.941 1.00 0.00 H new ATOM 0 HD12 ILE A 19 20.234 10.277 -20.480 1.00 0.00 H new ATOM 0 HD13 ILE A 19 21.575 9.156 -20.815 1.00 0.00 H new ATOM 235 N LEU A 20 18.671 6.688 -15.559 1.00 0.00 N ATOM 236 CA LEU A 20 18.941 6.438 -14.153 1.00 0.00 C ATOM 237 C LEU A 20 19.612 7.668 -13.540 1.00 0.00 C ATOM 238 O LEU A 20 18.959 8.685 -13.308 1.00 0.00 O ATOM 239 CB LEU A 20 19.748 5.149 -13.984 1.00 0.00 C ATOM 240 CG LEU A 20 20.082 4.750 -12.545 1.00 0.00 C ATOM 241 CD1 LEU A 20 18.849 4.193 -11.831 1.00 0.00 C ATOM 242 CD2 LEU A 20 21.258 3.772 -12.506 1.00 0.00 C ATOM 0 H LEU A 20 17.779 6.323 -15.894 1.00 0.00 H new ATOM 0 HA LEU A 20 18.010 6.278 -13.609 1.00 0.00 H new ATOM 0 HB2 LEU A 20 19.193 4.333 -14.447 1.00 0.00 H new ATOM 0 HB3 LEU A 20 20.681 5.253 -14.537 1.00 0.00 H new ATOM 0 HG LEU A 20 20.390 5.645 -12.005 1.00 0.00 H new ATOM 0 HD11 LEU A 20 19.113 3.917 -10.810 1.00 0.00 H new ATOM 0 HD12 LEU A 20 18.067 4.952 -11.811 1.00 0.00 H new ATOM 0 HD13 LEU A 20 18.487 3.313 -12.363 1.00 0.00 H new ATOM 0 HD21 LEU A 20 21.475 3.505 -11.472 1.00 0.00 H new ATOM 0 HD22 LEU A 20 21.003 2.873 -13.067 1.00 0.00 H new ATOM 0 HD23 LEU A 20 22.136 4.240 -12.951 1.00 0.00 H new ATOM 254 N GLU A 21 20.908 7.536 -13.296 1.00 0.00 N ATOM 255 CA GLU A 21 21.674 8.625 -12.715 1.00 0.00 C ATOM 256 C GLU A 21 21.194 8.911 -11.290 1.00 0.00 C ATOM 257 O GLU A 21 20.045 9.301 -11.086 1.00 0.00 O ATOM 258 CB GLU A 21 21.590 9.881 -13.584 1.00 0.00 C ATOM 259 CG GLU A 21 22.716 10.859 -13.246 1.00 0.00 C ATOM 260 CD GLU A 21 22.965 11.830 -14.402 1.00 0.00 C ATOM 261 OE1 GLU A 21 23.351 11.337 -15.484 1.00 0.00 O ATOM 262 OE2 GLU A 21 22.764 13.043 -14.177 1.00 0.00 O ATOM 0 H GLU A 21 21.446 6.692 -13.490 1.00 0.00 H new ATOM 0 HA GLU A 21 22.721 8.323 -12.672 1.00 0.00 H new ATOM 0 HB2 GLU A 21 21.648 9.604 -14.637 1.00 0.00 H new ATOM 0 HB3 GLU A 21 20.625 10.366 -13.435 1.00 0.00 H new ATOM 0 HG2 GLU A 21 22.459 11.418 -12.346 1.00 0.00 H new ATOM 0 HG3 GLU A 21 23.630 10.306 -13.028 1.00 0.00 H new ATOM 269 N ARG A 22 22.097 8.706 -10.343 1.00 0.00 N ATOM 270 CA ARG A 22 21.780 8.938 -8.944 1.00 0.00 C ATOM 271 C ARG A 22 22.776 9.922 -8.329 1.00 0.00 C ATOM 272 O ARG A 22 23.810 9.516 -7.801 1.00 0.00 O ATOM 273 CB ARG A 22 21.809 7.630 -8.149 1.00 0.00 C ATOM 274 CG ARG A 22 21.370 7.859 -6.702 1.00 0.00 C ATOM 275 CD ARG A 22 22.343 7.199 -5.723 1.00 0.00 C ATOM 276 NE ARG A 22 21.726 7.104 -4.381 1.00 0.00 N ATOM 277 CZ ARG A 22 22.131 6.257 -3.426 1.00 0.00 C ATOM 278 NH1 ARG A 22 23.156 5.425 -3.658 1.00 0.00 N ATOM 279 NH2 ARG A 22 21.511 6.240 -2.238 1.00 0.00 N ATOM 0 H ARG A 22 23.048 8.382 -10.517 1.00 0.00 H new ATOM 0 HA ARG A 22 20.775 9.357 -8.897 1.00 0.00 H new ATOM 0 HB2 ARG A 22 21.152 6.899 -8.621 1.00 0.00 H new ATOM 0 HB3 ARG A 22 22.816 7.212 -8.166 1.00 0.00 H new ATOM 0 HG2 ARG A 22 21.315 8.929 -6.500 1.00 0.00 H new ATOM 0 HG3 ARG A 22 20.369 7.454 -6.554 1.00 0.00 H new ATOM 0 HD2 ARG A 22 22.612 6.205 -6.080 1.00 0.00 H new ATOM 0 HD3 ARG A 22 23.265 7.778 -5.668 1.00 0.00 H new ATOM 0 HE ARG A 22 20.943 7.723 -4.170 1.00 0.00 H new ATOM 0 HH11 ARG A 22 23.628 5.437 -4.562 1.00 0.00 H new ATOM 0 HH12 ARG A 22 23.464 4.780 -2.930 1.00 0.00 H new ATOM 0 HH21 ARG A 22 20.730 6.872 -2.061 1.00 0.00 H new ATOM 0 HH22 ARG A 22 21.820 5.595 -1.511 1.00 0.00 H new ATOM 293 N THR A 23 22.430 11.198 -8.418 1.00 0.00 N ATOM 294 CA THR A 23 23.282 12.244 -7.878 1.00 0.00 C ATOM 295 C THR A 23 23.153 12.302 -6.354 1.00 0.00 C ATOM 296 O THR A 23 24.146 12.181 -5.638 1.00 0.00 O ATOM 297 CB THR A 23 22.914 13.558 -8.569 1.00 0.00 C ATOM 298 OG1 THR A 23 23.624 13.512 -9.803 1.00 0.00 O ATOM 299 CG2 THR A 23 23.492 14.780 -7.852 1.00 0.00 C ATOM 0 H THR A 23 21.571 11.531 -8.856 1.00 0.00 H new ATOM 0 HA THR A 23 24.334 12.039 -8.077 1.00 0.00 H new ATOM 0 HB THR A 23 21.829 13.648 -8.621 1.00 0.00 H new ATOM 0 HG1 THR A 23 23.441 14.326 -10.316 1.00 0.00 H new ATOM 0 HG21 THR A 23 23.201 15.686 -8.384 1.00 0.00 H new ATOM 0 HG22 THR A 23 23.108 14.819 -6.832 1.00 0.00 H new ATOM 0 HG23 THR A 23 24.579 14.707 -7.828 1.00 0.00 H new ATOM 307 N LEU A 24 21.921 12.487 -5.903 1.00 0.00 N ATOM 308 CA LEU A 24 21.649 12.563 -4.478 1.00 0.00 C ATOM 309 C LEU A 24 20.563 11.548 -4.116 1.00 0.00 C ATOM 310 O LEU A 24 19.657 11.293 -4.908 1.00 0.00 O ATOM 311 CB LEU A 24 21.309 13.999 -4.073 1.00 0.00 C ATOM 312 CG LEU A 24 22.193 14.617 -2.988 1.00 0.00 C ATOM 313 CD1 LEU A 24 22.083 13.832 -1.679 1.00 0.00 C ATOM 314 CD2 LEU A 24 23.642 14.737 -3.464 1.00 0.00 C ATOM 0 H LEU A 24 21.100 12.587 -6.500 1.00 0.00 H new ATOM 0 HA LEU A 24 22.538 12.297 -3.906 1.00 0.00 H new ATOM 0 HB2 LEU A 24 21.364 14.629 -4.961 1.00 0.00 H new ATOM 0 HB3 LEU A 24 20.275 14.023 -3.729 1.00 0.00 H new ATOM 0 HG LEU A 24 21.835 15.627 -2.789 1.00 0.00 H new ATOM 0 HD11 LEU A 24 22.721 14.292 -0.924 1.00 0.00 H new ATOM 0 HD12 LEU A 24 21.049 13.842 -1.335 1.00 0.00 H new ATOM 0 HD13 LEU A 24 22.401 12.803 -1.844 1.00 0.00 H new ATOM 0 HD21 LEU A 24 24.249 15.179 -2.674 1.00 0.00 H new ATOM 0 HD22 LEU A 24 24.028 13.747 -3.707 1.00 0.00 H new ATOM 0 HD23 LEU A 24 23.683 15.370 -4.350 1.00 0.00 H new ATOM 326 N ASP A 25 20.689 10.996 -2.918 1.00 0.00 N ATOM 327 CA ASP A 25 19.729 10.015 -2.441 1.00 0.00 C ATOM 328 C ASP A 25 18.358 10.677 -2.298 1.00 0.00 C ATOM 329 O ASP A 25 18.249 11.902 -2.329 1.00 0.00 O ATOM 330 CB ASP A 25 20.136 9.468 -1.071 1.00 0.00 C ATOM 331 CG ASP A 25 21.643 9.318 -0.855 1.00 0.00 C ATOM 332 OD1 ASP A 25 22.275 8.657 -1.708 1.00 0.00 O ATOM 333 OD2 ASP A 25 22.129 9.867 0.157 1.00 0.00 O ATOM 0 H ASP A 25 21.442 11.210 -2.263 1.00 0.00 H new ATOM 0 HA ASP A 25 19.696 9.197 -3.161 1.00 0.00 H new ATOM 0 HB2 ASP A 25 19.738 10.128 -0.300 1.00 0.00 H new ATOM 0 HB3 ASP A 25 19.666 8.495 -0.931 1.00 0.00 H new ATOM 338 N ASP A 26 17.344 9.838 -2.145 1.00 0.00 N ATOM 339 CA ASP A 26 15.984 10.326 -1.997 1.00 0.00 C ATOM 340 C ASP A 26 15.004 9.180 -2.258 1.00 0.00 C ATOM 341 O ASP A 26 15.341 8.214 -2.940 1.00 0.00 O ATOM 342 CB ASP A 26 15.686 11.441 -3.002 1.00 0.00 C ATOM 343 CG ASP A 26 16.493 11.373 -4.300 1.00 0.00 C ATOM 344 OD1 ASP A 26 16.924 10.250 -4.642 1.00 0.00 O ATOM 345 OD2 ASP A 26 16.659 12.444 -4.922 1.00 0.00 O ATOM 0 H ASP A 26 17.438 8.823 -2.120 1.00 0.00 H new ATOM 0 HA ASP A 26 15.874 10.714 -0.984 1.00 0.00 H new ATOM 0 HB2 ASP A 26 14.625 11.413 -3.249 1.00 0.00 H new ATOM 0 HB3 ASP A 26 15.876 12.402 -2.523 1.00 0.00 H new ATOM 350 N VAL A 27 13.810 9.327 -1.703 1.00 0.00 N ATOM 351 CA VAL A 27 12.779 8.317 -1.867 1.00 0.00 C ATOM 352 C VAL A 27 12.797 7.805 -3.309 1.00 0.00 C ATOM 353 O VAL A 27 13.310 8.477 -4.203 1.00 0.00 O ATOM 354 CB VAL A 27 11.420 8.883 -1.451 1.00 0.00 C ATOM 355 CG1 VAL A 27 11.312 8.987 0.072 1.00 0.00 C ATOM 356 CG2 VAL A 27 11.165 10.239 -2.113 1.00 0.00 C ATOM 0 H VAL A 27 13.534 10.131 -1.139 1.00 0.00 H new ATOM 0 HA VAL A 27 12.974 7.464 -1.217 1.00 0.00 H new ATOM 0 HB VAL A 27 10.650 8.192 -1.795 1.00 0.00 H new ATOM 0 HG11 VAL A 27 10.336 9.392 0.341 1.00 0.00 H new ATOM 0 HG12 VAL A 27 11.428 7.997 0.513 1.00 0.00 H new ATOM 0 HG13 VAL A 27 12.095 9.646 0.448 1.00 0.00 H new ATOM 0 HG21 VAL A 27 10.192 10.619 -1.801 1.00 0.00 H new ATOM 0 HG22 VAL A 27 11.943 10.942 -1.814 1.00 0.00 H new ATOM 0 HG23 VAL A 27 11.178 10.123 -3.197 1.00 0.00 H new ATOM 366 N PRO A 28 12.216 6.590 -3.496 1.00 0.00 N ATOM 367 CA PRO A 28 12.161 5.981 -4.814 1.00 0.00 C ATOM 368 C PRO A 28 11.103 6.659 -5.687 1.00 0.00 C ATOM 369 O PRO A 28 10.302 7.452 -5.195 1.00 0.00 O ATOM 370 CB PRO A 28 11.867 4.512 -4.557 1.00 0.00 C ATOM 371 CG PRO A 28 11.309 4.440 -3.144 1.00 0.00 C ATOM 372 CD PRO A 28 11.599 5.766 -2.460 1.00 0.00 C ATOM 0 HA PRO A 28 13.092 6.095 -5.370 1.00 0.00 H new ATOM 0 HB2 PRO A 28 11.150 4.125 -5.281 1.00 0.00 H new ATOM 0 HB3 PRO A 28 12.771 3.910 -4.651 1.00 0.00 H new ATOM 0 HG2 PRO A 28 10.236 4.249 -3.167 1.00 0.00 H new ATOM 0 HG3 PRO A 28 11.768 3.618 -2.594 1.00 0.00 H new ATOM 0 HD2 PRO A 28 10.685 6.224 -2.081 1.00 0.00 H new ATOM 0 HD3 PRO A 28 12.267 5.635 -1.608 1.00 0.00 H new ATOM 380 N GLY A 29 11.135 6.322 -6.968 1.00 0.00 N ATOM 381 CA GLY A 29 10.189 6.888 -7.914 1.00 0.00 C ATOM 382 C GLY A 29 8.888 6.083 -7.937 1.00 0.00 C ATOM 383 O GLY A 29 8.665 5.231 -7.078 1.00 0.00 O ATOM 0 H GLY A 29 11.801 5.664 -7.373 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.976 7.923 -7.646 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.630 6.902 -8.911 1.00 0.00 H new ATOM 387 N PRO A 30 8.041 6.388 -8.957 1.00 0.00 N ATOM 388 CA PRO A 30 6.768 5.703 -9.103 1.00 0.00 C ATOM 389 C PRO A 30 6.967 4.287 -9.647 1.00 0.00 C ATOM 390 O PRO A 30 7.734 4.081 -10.587 1.00 0.00 O ATOM 391 CB PRO A 30 5.950 6.586 -10.031 1.00 0.00 C ATOM 392 CG PRO A 30 6.949 7.488 -10.737 1.00 0.00 C ATOM 393 CD PRO A 30 8.271 7.391 -9.993 1.00 0.00 C ATOM 0 HA PRO A 30 6.254 5.564 -8.152 1.00 0.00 H new ATOM 0 HB2 PRO A 30 5.391 5.986 -10.749 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.222 7.173 -9.471 1.00 0.00 H new ATOM 0 HG2 PRO A 30 7.072 7.182 -11.776 1.00 0.00 H new ATOM 0 HG3 PRO A 30 6.592 8.518 -10.748 1.00 0.00 H new ATOM 0 HD2 PRO A 30 9.080 7.093 -10.660 1.00 0.00 H new ATOM 0 HD3 PRO A 30 8.553 8.351 -9.559 1.00 0.00 H new ATOM 401 N PRO A 31 6.245 3.322 -9.017 1.00 0.00 N ATOM 402 CA PRO A 31 6.334 1.931 -9.428 1.00 0.00 C ATOM 403 C PRO A 31 5.575 1.696 -10.735 1.00 0.00 C ATOM 404 O PRO A 31 4.345 1.710 -10.754 1.00 0.00 O ATOM 405 CB PRO A 31 5.769 1.139 -8.261 1.00 0.00 C ATOM 406 CG PRO A 31 4.960 2.128 -7.439 1.00 0.00 C ATOM 407 CD PRO A 31 5.327 3.529 -7.901 1.00 0.00 C ATOM 0 HA PRO A 31 7.356 1.620 -9.644 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.143 0.319 -8.612 1.00 0.00 H new ATOM 0 HB3 PRO A 31 6.568 0.698 -7.665 1.00 0.00 H new ATOM 0 HG2 PRO A 31 3.893 1.950 -7.570 1.00 0.00 H new ATOM 0 HG3 PRO A 31 5.175 2.008 -6.377 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.444 4.087 -8.213 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.799 4.099 -7.101 1.00 0.00 H new ATOM 415 N MET A 32 6.339 1.485 -11.797 1.00 0.00 N ATOM 416 CA MET A 32 5.753 1.246 -13.105 1.00 0.00 C ATOM 417 C MET A 32 5.485 -0.244 -13.323 1.00 0.00 C ATOM 418 O MET A 32 6.033 -1.087 -12.614 1.00 0.00 O ATOM 419 CB MET A 32 6.701 1.759 -14.191 1.00 0.00 C ATOM 420 CG MET A 32 8.076 1.098 -14.074 1.00 0.00 C ATOM 421 SD MET A 32 8.969 1.270 -15.610 1.00 0.00 S ATOM 422 CE MET A 32 10.580 0.698 -15.098 1.00 0.00 C ATOM 0 H MET A 32 7.359 1.475 -11.778 1.00 0.00 H new ATOM 0 HA MET A 32 4.803 1.778 -13.159 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.278 1.555 -15.175 1.00 0.00 H new ATOM 0 HB3 MET A 32 6.805 2.841 -14.107 1.00 0.00 H new ATOM 0 HG2 MET A 32 8.641 1.556 -13.262 1.00 0.00 H new ATOM 0 HG3 MET A 32 7.961 0.043 -13.827 1.00 0.00 H new ATOM 0 HE1 MET A 32 11.267 0.740 -15.943 1.00 0.00 H new ATOM 0 HE2 MET A 32 10.954 1.334 -14.295 1.00 0.00 H new ATOM 0 HE3 MET A 32 10.505 -0.330 -14.742 1.00 0.00 H new ATOM 432 N GLY A 33 4.643 -0.524 -14.307 1.00 0.00 N ATOM 433 CA GLY A 33 4.296 -1.898 -14.627 1.00 0.00 C ATOM 434 C GLY A 33 3.084 -2.361 -13.815 1.00 0.00 C ATOM 435 O GLY A 33 3.089 -3.457 -13.257 1.00 0.00 O ATOM 0 H GLY A 33 4.191 0.178 -14.893 1.00 0.00 H new ATOM 0 HA2 GLY A 33 4.079 -1.983 -15.692 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.146 -2.549 -14.422 1.00 0.00 H new ATOM 439 N ILE A 34 2.076 -1.503 -13.775 1.00 0.00 N ATOM 440 CA ILE A 34 0.860 -1.810 -13.041 1.00 0.00 C ATOM 441 C ILE A 34 -0.145 -2.474 -13.983 1.00 0.00 C ATOM 442 O ILE A 34 -0.536 -1.890 -14.992 1.00 0.00 O ATOM 443 CB ILE A 34 0.320 -0.556 -12.350 1.00 0.00 C ATOM 444 CG1 ILE A 34 1.461 0.305 -11.805 1.00 0.00 C ATOM 445 CG2 ILE A 34 -0.692 -0.921 -11.263 1.00 0.00 C ATOM 446 CD1 ILE A 34 2.330 -0.491 -10.829 1.00 0.00 C ATOM 0 H ILE A 34 2.076 -0.595 -14.239 1.00 0.00 H new ATOM 0 HA ILE A 34 1.067 -2.522 -12.242 1.00 0.00 H new ATOM 0 HB ILE A 34 -0.208 0.042 -13.093 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.074 0.668 -12.630 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.052 1.181 -11.302 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -1.060 -0.011 -10.788 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -1.527 -1.460 -11.710 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -0.211 -1.552 -10.515 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.134 0.144 -10.456 1.00 0.00 H new ATOM 0 HD12 ILE A 34 1.719 -0.832 -9.993 1.00 0.00 H new ATOM 0 HD13 ILE A 34 2.757 -1.353 -11.342 1.00 0.00 H new ATOM 458 N LEU A 35 -0.535 -3.688 -13.620 1.00 0.00 N ATOM 459 CA LEU A 35 -1.487 -4.438 -14.421 1.00 0.00 C ATOM 460 C LEU A 35 -2.390 -5.258 -13.496 1.00 0.00 C ATOM 461 O LEU A 35 -1.970 -5.664 -12.413 1.00 0.00 O ATOM 462 CB LEU A 35 -0.759 -5.278 -15.472 1.00 0.00 C ATOM 463 CG LEU A 35 -0.011 -4.496 -16.554 1.00 0.00 C ATOM 464 CD1 LEU A 35 0.795 -5.437 -17.452 1.00 0.00 C ATOM 465 CD2 LEU A 35 -0.971 -3.618 -17.359 1.00 0.00 C ATOM 0 H LEU A 35 -0.209 -4.170 -12.782 1.00 0.00 H new ATOM 0 HA LEU A 35 -2.132 -3.760 -14.980 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -0.046 -5.925 -14.961 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -1.487 -5.927 -15.958 1.00 0.00 H new ATOM 0 HG LEU A 35 0.700 -3.830 -16.064 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.317 -4.856 -18.212 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.522 -5.982 -16.849 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.121 -6.145 -17.935 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -0.414 -3.073 -18.121 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.723 -4.245 -17.838 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.462 -2.909 -16.692 1.00 0.00 H new ATOM 477 N PHE A 36 -3.612 -5.477 -13.957 1.00 0.00 N ATOM 478 CA PHE A 36 -4.577 -6.242 -13.185 1.00 0.00 C ATOM 479 C PHE A 36 -4.929 -7.553 -13.891 1.00 0.00 C ATOM 480 O PHE A 36 -5.879 -7.608 -14.669 1.00 0.00 O ATOM 481 CB PHE A 36 -5.839 -5.384 -13.071 1.00 0.00 C ATOM 482 CG PHE A 36 -5.683 -4.165 -12.159 1.00 0.00 C ATOM 483 CD1 PHE A 36 -5.858 -4.294 -10.816 1.00 0.00 C ATOM 484 CD2 PHE A 36 -5.369 -2.954 -12.690 1.00 0.00 C ATOM 485 CE1 PHE A 36 -5.713 -3.164 -9.970 1.00 0.00 C ATOM 486 CE2 PHE A 36 -5.224 -1.823 -11.844 1.00 0.00 C ATOM 487 CZ PHE A 36 -5.399 -1.952 -10.501 1.00 0.00 C ATOM 0 H PHE A 36 -3.957 -5.138 -14.855 1.00 0.00 H new ATOM 0 HA PHE A 36 -4.161 -6.487 -12.208 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -6.127 -5.046 -14.066 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -6.654 -6.003 -12.696 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -6.107 -5.256 -10.394 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -5.230 -2.852 -13.756 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.852 -3.267 -8.904 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -4.975 -0.861 -12.266 1.00 0.00 H new ATOM 0 HZ PHE A 36 -5.289 -1.092 -9.857 1.00 0.00 H new ATOM 497 N PRO A 37 -4.122 -8.604 -13.585 1.00 0.00 N ATOM 498 CA PRO A 37 -4.338 -9.912 -14.181 1.00 0.00 C ATOM 499 C PRO A 37 -5.545 -10.609 -13.549 1.00 0.00 C ATOM 500 O PRO A 37 -6.329 -11.253 -14.245 1.00 0.00 O ATOM 501 CB PRO A 37 -3.036 -10.664 -13.962 1.00 0.00 C ATOM 502 CG PRO A 37 -2.308 -9.924 -12.851 1.00 0.00 C ATOM 503 CD PRO A 37 -2.987 -8.576 -12.667 1.00 0.00 C ATOM 0 HA PRO A 37 -4.576 -9.857 -15.243 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -3.226 -11.700 -13.682 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -2.439 -10.685 -14.874 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -2.341 -10.498 -11.925 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -1.257 -9.790 -13.106 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.314 -8.435 -11.637 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.309 -7.756 -12.901 1.00 0.00 H new ATOM 511 N GLU A 38 -5.656 -10.458 -12.238 1.00 0.00 N ATOM 512 CA GLU A 38 -6.753 -11.066 -11.504 1.00 0.00 C ATOM 513 C GLU A 38 -7.589 -9.988 -10.810 1.00 0.00 C ATOM 514 O GLU A 38 -7.085 -9.264 -9.952 1.00 0.00 O ATOM 515 CB GLU A 38 -6.237 -12.094 -10.496 1.00 0.00 C ATOM 516 CG GLU A 38 -7.356 -12.554 -9.560 1.00 0.00 C ATOM 517 CD GLU A 38 -6.822 -13.519 -8.500 1.00 0.00 C ATOM 518 OE1 GLU A 38 -6.374 -14.614 -8.903 1.00 0.00 O ATOM 519 OE2 GLU A 38 -6.874 -13.140 -7.310 1.00 0.00 O ATOM 0 H GLU A 38 -5.004 -9.923 -11.664 1.00 0.00 H new ATOM 0 HA GLU A 38 -7.391 -11.592 -12.214 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -5.825 -12.953 -11.026 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -5.425 -11.660 -9.912 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -7.808 -11.689 -9.075 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.141 -13.041 -10.138 1.00 0.00 H new ATOM 526 N VAL A 39 -8.851 -9.915 -11.207 1.00 0.00 N ATOM 527 CA VAL A 39 -9.760 -8.938 -10.634 1.00 0.00 C ATOM 528 C VAL A 39 -11.152 -9.560 -10.501 1.00 0.00 C ATOM 529 O VAL A 39 -11.765 -9.937 -11.499 1.00 0.00 O ATOM 530 CB VAL A 39 -9.754 -7.660 -11.475 1.00 0.00 C ATOM 531 CG1 VAL A 39 -10.851 -6.697 -11.017 1.00 0.00 C ATOM 532 CG2 VAL A 39 -8.381 -6.986 -11.438 1.00 0.00 C ATOM 0 H VAL A 39 -9.265 -10.517 -11.919 1.00 0.00 H new ATOM 0 HA VAL A 39 -9.434 -8.654 -9.634 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.963 -7.938 -12.508 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -10.825 -5.797 -11.631 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -11.824 -7.178 -11.120 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.687 -6.429 -9.973 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -8.404 -6.080 -12.044 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.130 -6.728 -10.409 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -7.630 -7.669 -11.835 1.00 0.00 H new ATOM 542 N ARG A 40 -11.611 -9.646 -9.261 1.00 0.00 N ATOM 543 CA ARG A 40 -12.919 -10.216 -8.986 1.00 0.00 C ATOM 544 C ARG A 40 -13.892 -9.121 -8.543 1.00 0.00 C ATOM 545 O ARG A 40 -13.603 -7.934 -8.687 1.00 0.00 O ATOM 546 CB ARG A 40 -12.836 -11.286 -7.896 1.00 0.00 C ATOM 547 CG ARG A 40 -11.528 -12.074 -8.000 1.00 0.00 C ATOM 548 CD ARG A 40 -11.459 -12.849 -9.317 1.00 0.00 C ATOM 549 NE ARG A 40 -10.231 -13.674 -9.355 1.00 0.00 N ATOM 550 CZ ARG A 40 -10.084 -14.768 -10.115 1.00 0.00 C ATOM 551 NH1 ARG A 40 -11.087 -15.175 -10.905 1.00 0.00 N ATOM 552 NH2 ARG A 40 -8.934 -15.455 -10.085 1.00 0.00 N ATOM 0 H ARG A 40 -11.101 -9.331 -8.436 1.00 0.00 H new ATOM 0 HA ARG A 40 -13.279 -10.678 -9.905 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -12.905 -10.817 -6.915 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -13.683 -11.967 -7.984 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -10.681 -11.391 -7.931 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -11.449 -12.766 -7.162 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -12.338 -13.485 -9.420 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -11.467 -12.155 -10.158 1.00 0.00 H new ATOM 0 HE ARG A 40 -9.447 -13.392 -8.766 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -11.962 -14.652 -10.928 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -10.975 -16.008 -11.483 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -8.170 -15.145 -9.484 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -8.822 -16.288 -10.663 1.00 0.00 H new ATOM 566 N THR A 41 -15.024 -9.559 -8.013 1.00 0.00 N ATOM 567 CA THR A 41 -16.041 -8.631 -7.548 1.00 0.00 C ATOM 568 C THR A 41 -15.601 -7.968 -6.241 1.00 0.00 C ATOM 569 O THR A 41 -15.167 -6.817 -6.240 1.00 0.00 O ATOM 570 CB THR A 41 -17.360 -9.397 -7.426 1.00 0.00 C ATOM 571 OG1 THR A 41 -16.959 -10.743 -7.187 1.00 0.00 O ATOM 572 CG2 THR A 41 -18.122 -9.465 -8.752 1.00 0.00 C ATOM 0 H THR A 41 -15.260 -10.544 -7.895 1.00 0.00 H new ATOM 0 HA THR A 41 -16.186 -7.816 -8.257 1.00 0.00 H new ATOM 0 HB THR A 41 -17.987 -8.923 -6.671 1.00 0.00 H new ATOM 0 HG1 THR A 41 -17.753 -11.309 -7.093 1.00 0.00 H new ATOM 0 HG21 THR A 41 -19.050 -10.019 -8.610 1.00 0.00 H new ATOM 0 HG22 THR A 41 -18.351 -8.455 -9.093 1.00 0.00 H new ATOM 0 HG23 THR A 41 -17.509 -9.969 -9.499 1.00 0.00 H new ATOM 580 N THR A 42 -15.728 -8.723 -5.160 1.00 0.00 N ATOM 581 CA THR A 42 -15.348 -8.224 -3.849 1.00 0.00 C ATOM 582 C THR A 42 -13.900 -8.603 -3.533 1.00 0.00 C ATOM 583 O THR A 42 -13.540 -8.775 -2.369 1.00 0.00 O ATOM 584 CB THR A 42 -16.354 -8.761 -2.829 1.00 0.00 C ATOM 585 OG1 THR A 42 -16.113 -10.165 -2.810 1.00 0.00 O ATOM 586 CG2 THR A 42 -17.801 -8.637 -3.312 1.00 0.00 C ATOM 0 H THR A 42 -16.089 -9.677 -5.165 1.00 0.00 H new ATOM 0 HA THR A 42 -15.380 -7.135 -3.816 1.00 0.00 H new ATOM 0 HB THR A 42 -16.239 -8.223 -1.888 1.00 0.00 H new ATOM 0 HG1 THR A 42 -16.722 -10.593 -2.172 1.00 0.00 H new ATOM 0 HG21 THR A 42 -18.474 -9.032 -2.551 1.00 0.00 H new ATOM 0 HG22 THR A 42 -18.035 -7.588 -3.494 1.00 0.00 H new ATOM 0 HG23 THR A 42 -17.926 -9.202 -4.236 1.00 0.00 H new ATOM 594 N SER A 43 -13.109 -8.723 -4.589 1.00 0.00 N ATOM 595 CA SER A 43 -11.708 -9.079 -4.438 1.00 0.00 C ATOM 596 C SER A 43 -10.978 -8.907 -5.771 1.00 0.00 C ATOM 597 O SER A 43 -11.560 -9.123 -6.834 1.00 0.00 O ATOM 598 CB SER A 43 -11.556 -10.514 -3.930 1.00 0.00 C ATOM 599 OG SER A 43 -10.212 -10.810 -3.561 1.00 0.00 O ATOM 0 H SER A 43 -13.411 -8.580 -5.553 1.00 0.00 H new ATOM 0 HA SER A 43 -11.263 -8.412 -3.699 1.00 0.00 H new ATOM 0 HB2 SER A 43 -12.210 -10.666 -3.071 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.881 -11.209 -4.704 1.00 0.00 H new ATOM 0 HG SER A 43 -9.743 -9.979 -3.339 1.00 0.00 H new ATOM 605 N VAL A 44 -9.715 -8.520 -5.673 1.00 0.00 N ATOM 606 CA VAL A 44 -8.900 -8.317 -6.858 1.00 0.00 C ATOM 607 C VAL A 44 -7.430 -8.558 -6.508 1.00 0.00 C ATOM 608 O VAL A 44 -7.082 -8.702 -5.337 1.00 0.00 O ATOM 609 CB VAL A 44 -9.156 -6.925 -7.437 1.00 0.00 C ATOM 610 CG1 VAL A 44 -10.652 -6.605 -7.455 1.00 0.00 C ATOM 611 CG2 VAL A 44 -8.376 -5.858 -6.666 1.00 0.00 C ATOM 0 H VAL A 44 -9.236 -8.342 -4.790 1.00 0.00 H new ATOM 0 HA VAL A 44 -9.171 -9.032 -7.635 1.00 0.00 H new ATOM 0 HB VAL A 44 -8.800 -6.920 -8.467 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -10.806 -5.610 -7.871 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -11.174 -7.340 -8.068 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -11.043 -6.638 -6.438 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.576 -4.878 -7.098 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -8.687 -5.864 -5.621 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.309 -6.071 -6.728 1.00 0.00 H new ATOM 621 N ARG A 45 -6.606 -8.594 -7.545 1.00 0.00 N ATOM 622 CA ARG A 45 -5.181 -8.815 -7.361 1.00 0.00 C ATOM 623 C ARG A 45 -4.398 -8.233 -8.540 1.00 0.00 C ATOM 624 O ARG A 45 -4.518 -8.712 -9.667 1.00 0.00 O ATOM 625 CB ARG A 45 -4.867 -10.307 -7.235 1.00 0.00 C ATOM 626 CG ARG A 45 -3.378 -10.532 -6.964 1.00 0.00 C ATOM 627 CD ARG A 45 -2.844 -11.710 -7.782 1.00 0.00 C ATOM 628 NE ARG A 45 -3.277 -11.585 -9.192 1.00 0.00 N ATOM 629 CZ ARG A 45 -3.169 -12.564 -10.100 1.00 0.00 C ATOM 630 NH1 ARG A 45 -2.643 -13.746 -9.752 1.00 0.00 N ATOM 631 NH2 ARG A 45 -3.588 -12.361 -11.357 1.00 0.00 N ATOM 0 H ARG A 45 -6.897 -8.474 -8.515 1.00 0.00 H new ATOM 0 HA ARG A 45 -4.883 -8.314 -6.440 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -5.457 -10.740 -6.427 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -5.156 -10.822 -8.151 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -2.819 -9.630 -7.212 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -3.223 -10.722 -5.902 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.756 -11.737 -7.728 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -3.207 -12.649 -7.363 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.683 -10.698 -9.491 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -2.325 -13.901 -8.795 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -2.561 -14.491 -10.444 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -3.989 -11.461 -11.622 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -3.506 -13.106 -12.049 1.00 0.00 H new ATOM 645 N LEU A 46 -3.613 -7.209 -8.240 1.00 0.00 N ATOM 646 CA LEU A 46 -2.810 -6.557 -9.261 1.00 0.00 C ATOM 647 C LEU A 46 -1.338 -6.915 -9.051 1.00 0.00 C ATOM 648 O LEU A 46 -0.977 -7.505 -8.034 1.00 0.00 O ATOM 649 CB LEU A 46 -3.081 -5.051 -9.275 1.00 0.00 C ATOM 650 CG LEU A 46 -2.179 -4.199 -8.379 1.00 0.00 C ATOM 651 CD1 LEU A 46 -2.128 -2.752 -8.871 1.00 0.00 C ATOM 652 CD2 LEU A 46 -2.615 -4.292 -6.916 1.00 0.00 C ATOM 0 H LEU A 46 -3.516 -6.814 -7.304 1.00 0.00 H new ATOM 0 HA LEU A 46 -3.088 -6.917 -10.252 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.983 -4.694 -10.300 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.116 -4.885 -8.977 1.00 0.00 H new ATOM 0 HG LEU A 46 -1.165 -4.595 -8.439 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -1.480 -2.168 -8.217 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.735 -2.727 -9.887 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -3.132 -2.328 -8.860 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -1.958 -3.678 -6.301 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -3.641 -3.936 -6.819 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.558 -5.329 -6.584 1.00 0.00 H new ATOM 664 N ILE A 47 -0.526 -6.544 -10.031 1.00 0.00 N ATOM 665 CA ILE A 47 0.899 -6.819 -9.966 1.00 0.00 C ATOM 666 C ILE A 47 1.671 -5.615 -10.511 1.00 0.00 C ATOM 667 O ILE A 47 1.403 -5.150 -11.618 1.00 0.00 O ATOM 668 CB ILE A 47 1.224 -8.132 -10.680 1.00 0.00 C ATOM 669 CG1 ILE A 47 1.380 -7.914 -12.186 1.00 0.00 C ATOM 670 CG2 ILE A 47 0.179 -9.203 -10.361 1.00 0.00 C ATOM 671 CD1 ILE A 47 0.093 -7.353 -12.795 1.00 0.00 C ATOM 0 H ILE A 47 -0.828 -6.055 -10.874 1.00 0.00 H new ATOM 0 HA ILE A 47 1.214 -6.959 -8.932 1.00 0.00 H new ATOM 0 HB ILE A 47 2.182 -8.495 -10.307 1.00 0.00 H new ATOM 0 HG12 ILE A 47 2.205 -7.227 -12.374 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.634 -8.857 -12.669 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.434 -10.126 -10.881 1.00 0.00 H new ATOM 0 HG22 ILE A 47 0.161 -9.385 -9.286 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -0.803 -8.862 -10.688 1.00 0.00 H new ATOM 0 HD11 ILE A 47 0.231 -7.207 -13.866 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -0.725 -8.054 -12.626 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -0.145 -6.398 -12.327 1.00 0.00 H new ATOM 683 N TRP A 48 2.615 -5.145 -9.709 1.00 0.00 N ATOM 684 CA TRP A 48 3.428 -4.005 -10.096 1.00 0.00 C ATOM 685 C TRP A 48 4.884 -4.467 -10.172 1.00 0.00 C ATOM 686 O TRP A 48 5.173 -5.651 -10.008 1.00 0.00 O ATOM 687 CB TRP A 48 3.221 -2.832 -9.136 1.00 0.00 C ATOM 688 CG TRP A 48 3.735 -3.091 -7.718 1.00 0.00 C ATOM 689 CD1 TRP A 48 4.875 -2.660 -7.162 1.00 0.00 C ATOM 690 CD2 TRP A 48 3.076 -3.864 -6.692 1.00 0.00 C ATOM 691 NE1 TRP A 48 4.999 -3.096 -5.859 1.00 0.00 N ATOM 692 CE2 TRP A 48 3.870 -3.851 -5.564 1.00 0.00 C ATOM 693 CE3 TRP A 48 1.849 -4.550 -6.717 1.00 0.00 C ATOM 694 CZ2 TRP A 48 3.525 -4.508 -4.376 1.00 0.00 C ATOM 695 CZ3 TRP A 48 1.519 -5.201 -5.523 1.00 0.00 C ATOM 696 CH2 TRP A 48 2.307 -5.198 -4.378 1.00 0.00 C ATOM 0 H TRP A 48 2.835 -5.534 -8.792 1.00 0.00 H new ATOM 0 HA TRP A 48 3.130 -3.633 -11.076 1.00 0.00 H new ATOM 0 HB2 TRP A 48 3.724 -1.953 -9.539 1.00 0.00 H new ATOM 0 HB3 TRP A 48 2.158 -2.597 -9.089 1.00 0.00 H new ATOM 0 HD1 TRP A 48 5.605 -2.048 -7.670 1.00 0.00 H new ATOM 0 HE1 TRP A 48 5.776 -2.900 -5.228 1.00 0.00 H new ATOM 0 HE3 TRP A 48 1.212 -4.573 -7.589 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 4.164 -4.484 -3.506 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 0.586 -5.744 -5.489 1.00 0.00 H new ATOM 0 HH2 TRP A 48 1.981 -5.726 -3.494 1.00 0.00 H new ATOM 707 N GLN A 49 5.764 -3.507 -10.421 1.00 0.00 N ATOM 708 CA GLN A 49 7.183 -3.801 -10.520 1.00 0.00 C ATOM 709 C GLN A 49 7.997 -2.741 -9.774 1.00 0.00 C ATOM 710 O GLN A 49 7.494 -1.658 -9.482 1.00 0.00 O ATOM 711 CB GLN A 49 7.622 -3.900 -11.982 1.00 0.00 C ATOM 712 CG GLN A 49 7.674 -5.358 -12.441 1.00 0.00 C ATOM 713 CD GLN A 49 8.436 -5.491 -13.762 1.00 0.00 C ATOM 714 OE1 GLN A 49 9.565 -5.949 -13.813 1.00 0.00 O ATOM 715 NE2 GLN A 49 7.756 -5.065 -14.823 1.00 0.00 N ATOM 0 H GLN A 49 5.521 -2.526 -10.557 1.00 0.00 H new ATOM 0 HA GLN A 49 7.367 -4.769 -10.054 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.930 -3.341 -12.612 1.00 0.00 H new ATOM 0 HB3 GLN A 49 8.604 -3.442 -12.103 1.00 0.00 H new ATOM 0 HG2 GLN A 49 8.156 -5.967 -11.676 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.661 -5.741 -12.561 1.00 0.00 H new ATOM 0 HE21 GLN A 49 6.813 -4.692 -14.709 1.00 0.00 H new ATOM 0 HE22 GLN A 49 8.177 -5.111 -15.751 1.00 0.00 H new ATOM 724 N PRO A 50 9.275 -3.101 -9.479 1.00 0.00 N ATOM 725 CA PRO A 50 10.164 -2.194 -8.773 1.00 0.00 C ATOM 726 C PRO A 50 10.655 -1.078 -9.696 1.00 0.00 C ATOM 727 O PRO A 50 10.782 -1.276 -10.903 1.00 0.00 O ATOM 728 CB PRO A 50 11.290 -3.073 -8.252 1.00 0.00 C ATOM 729 CG PRO A 50 11.236 -4.350 -9.074 1.00 0.00 C ATOM 730 CD PRO A 50 9.906 -4.376 -9.809 1.00 0.00 C ATOM 0 HA PRO A 50 9.670 -1.675 -7.952 1.00 0.00 H new ATOM 0 HB2 PRO A 50 12.255 -2.578 -8.362 1.00 0.00 H new ATOM 0 HB3 PRO A 50 11.160 -3.286 -7.191 1.00 0.00 H new ATOM 0 HG2 PRO A 50 12.064 -4.383 -9.782 1.00 0.00 H new ATOM 0 HG3 PRO A 50 11.333 -5.223 -8.429 1.00 0.00 H new ATOM 0 HD2 PRO A 50 10.050 -4.480 -10.884 1.00 0.00 H new ATOM 0 HD3 PRO A 50 9.292 -5.217 -9.487 1.00 0.00 H new ATOM 738 N PRO A 51 10.925 0.103 -9.077 1.00 0.00 N ATOM 739 CA PRO A 51 11.400 1.251 -9.831 1.00 0.00 C ATOM 740 C PRO A 51 12.869 1.081 -10.223 1.00 0.00 C ATOM 741 O PRO A 51 13.725 0.880 -9.363 1.00 0.00 O ATOM 742 CB PRO A 51 11.162 2.445 -8.919 1.00 0.00 C ATOM 743 CG PRO A 51 10.998 1.874 -7.520 1.00 0.00 C ATOM 744 CD PRO A 51 10.787 0.375 -7.650 1.00 0.00 C ATOM 0 HA PRO A 51 10.876 1.379 -10.778 1.00 0.00 H new ATOM 0 HB2 PRO A 51 11.999 3.142 -8.961 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.272 2.997 -9.222 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.881 2.084 -6.916 1.00 0.00 H new ATOM 0 HG3 PRO A 51 10.149 2.337 -7.016 1.00 0.00 H new ATOM 0 HD2 PRO A 51 11.523 -0.180 -7.068 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.803 0.081 -7.284 1.00 0.00 H new ATOM 752 N ALA A 52 13.115 1.168 -11.522 1.00 0.00 N ATOM 753 CA ALA A 52 14.466 1.026 -12.038 1.00 0.00 C ATOM 754 C ALA A 52 15.412 1.918 -11.232 1.00 0.00 C ATOM 755 O ALA A 52 16.599 1.620 -11.111 1.00 0.00 O ATOM 756 CB ALA A 52 14.479 1.361 -13.531 1.00 0.00 C ATOM 0 H ALA A 52 12.402 1.335 -12.232 1.00 0.00 H new ATOM 0 HA ALA A 52 14.812 -0.002 -11.931 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.492 1.255 -13.919 1.00 0.00 H new ATOM 0 HB2 ALA A 52 13.814 0.680 -14.062 1.00 0.00 H new ATOM 0 HB3 ALA A 52 14.140 2.387 -13.677 1.00 0.00 H new ATOM 762 N ALA A 53 14.850 2.994 -10.700 1.00 0.00 N ATOM 763 CA ALA A 53 15.629 3.930 -9.908 1.00 0.00 C ATOM 764 C ALA A 53 15.085 3.959 -8.478 1.00 0.00 C ATOM 765 O ALA A 53 14.258 4.804 -8.142 1.00 0.00 O ATOM 766 CB ALA A 53 15.597 5.309 -10.571 1.00 0.00 C ATOM 0 H ALA A 53 13.865 3.238 -10.802 1.00 0.00 H new ATOM 0 HA ALA A 53 16.671 3.615 -9.858 1.00 0.00 H new ATOM 0 HB1 ALA A 53 16.181 6.012 -9.977 1.00 0.00 H new ATOM 0 HB2 ALA A 53 16.020 5.241 -11.573 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.566 5.658 -10.636 1.00 0.00 H new ATOM 772 N PRO A 54 15.585 2.999 -7.655 1.00 0.00 N ATOM 773 CA PRO A 54 15.158 2.906 -6.269 1.00 0.00 C ATOM 774 C PRO A 54 15.795 4.011 -5.424 1.00 0.00 C ATOM 775 O PRO A 54 15.174 4.519 -4.491 1.00 0.00 O ATOM 776 CB PRO A 54 15.565 1.510 -5.825 1.00 0.00 C ATOM 777 CG PRO A 54 16.613 1.044 -6.823 1.00 0.00 C ATOM 778 CD PRO A 54 16.566 1.981 -8.019 1.00 0.00 C ATOM 0 HA PRO A 54 14.084 3.051 -6.149 1.00 0.00 H new ATOM 0 HB2 PRO A 54 15.969 1.524 -4.813 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.707 0.837 -5.817 1.00 0.00 H new ATOM 0 HG2 PRO A 54 17.604 1.054 -6.369 1.00 0.00 H new ATOM 0 HG3 PRO A 54 16.415 0.018 -7.134 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.543 2.424 -8.213 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.270 1.452 -8.925 1.00 0.00 H new ATOM 786 N ASN A 55 17.024 4.351 -5.781 1.00 0.00 N ATOM 787 CA ASN A 55 17.751 5.387 -5.067 1.00 0.00 C ATOM 788 C ASN A 55 17.506 5.234 -3.565 1.00 0.00 C ATOM 789 O ASN A 55 17.287 6.221 -2.864 1.00 0.00 O ATOM 790 CB ASN A 55 17.276 6.781 -5.484 1.00 0.00 C ATOM 791 CG ASN A 55 16.821 6.791 -6.945 1.00 0.00 C ATOM 792 OD1 ASN A 55 17.615 6.864 -7.868 1.00 0.00 O ATOM 793 ND2 ASN A 55 15.503 6.713 -7.101 1.00 0.00 N ATOM 0 H ASN A 55 17.535 3.928 -6.555 1.00 0.00 H new ATOM 0 HA ASN A 55 18.809 5.280 -5.305 1.00 0.00 H new ATOM 0 HB2 ASN A 55 16.454 7.096 -4.841 1.00 0.00 H new ATOM 0 HB3 ASN A 55 18.083 7.501 -5.346 1.00 0.00 H new ATOM 0 HD21 ASN A 55 15.100 6.712 -8.038 1.00 0.00 H new ATOM 0 HD22 ASN A 55 14.895 6.654 -6.284 1.00 0.00 H new ATOM 800 N GLY A 56 17.549 3.989 -3.115 1.00 0.00 N ATOM 801 CA GLY A 56 17.334 3.693 -1.708 1.00 0.00 C ATOM 802 C GLY A 56 16.852 2.254 -1.518 1.00 0.00 C ATOM 803 O GLY A 56 15.940 1.804 -2.211 1.00 0.00 O ATOM 0 H GLY A 56 17.730 3.173 -3.700 1.00 0.00 H new ATOM 0 HA2 GLY A 56 18.261 3.846 -1.155 1.00 0.00 H new ATOM 0 HA3 GLY A 56 16.599 4.384 -1.296 1.00 0.00 H new ATOM 807 N ILE A 57 17.484 1.571 -0.575 1.00 0.00 N ATOM 808 CA ILE A 57 17.131 0.192 -0.285 1.00 0.00 C ATOM 809 C ILE A 57 15.669 0.128 0.161 1.00 0.00 C ATOM 810 O ILE A 57 15.319 0.627 1.230 1.00 0.00 O ATOM 811 CB ILE A 57 18.109 -0.410 0.726 1.00 0.00 C ATOM 812 CG1 ILE A 57 19.386 -0.890 0.034 1.00 0.00 C ATOM 813 CG2 ILE A 57 17.443 -1.524 1.537 1.00 0.00 C ATOM 814 CD1 ILE A 57 19.825 0.095 -1.051 1.00 0.00 C ATOM 0 H ILE A 57 18.239 1.947 -0.002 1.00 0.00 H new ATOM 0 HA ILE A 57 17.219 -0.421 -1.182 1.00 0.00 H new ATOM 0 HB ILE A 57 18.398 0.371 1.429 1.00 0.00 H new ATOM 0 HG12 ILE A 57 20.182 -1.004 0.770 1.00 0.00 H new ATOM 0 HG13 ILE A 57 19.217 -1.872 -0.408 1.00 0.00 H new ATOM 0 HG21 ILE A 57 18.160 -1.935 2.248 1.00 0.00 H new ATOM 0 HG22 ILE A 57 16.587 -1.119 2.077 1.00 0.00 H new ATOM 0 HG23 ILE A 57 17.107 -2.313 0.864 1.00 0.00 H new ATOM 0 HD11 ILE A 57 20.735 -0.270 -1.527 1.00 0.00 H new ATOM 0 HD12 ILE A 57 19.037 0.188 -1.798 1.00 0.00 H new ATOM 0 HD13 ILE A 57 20.016 1.070 -0.602 1.00 0.00 H new ATOM 826 N ILE A 58 14.853 -0.490 -0.681 1.00 0.00 N ATOM 827 CA ILE A 58 13.437 -0.626 -0.387 1.00 0.00 C ATOM 828 C ILE A 58 13.265 -1.356 0.947 1.00 0.00 C ATOM 829 O ILE A 58 13.952 -2.340 1.213 1.00 0.00 O ATOM 830 CB ILE A 58 12.709 -1.297 -1.554 1.00 0.00 C ATOM 831 CG1 ILE A 58 12.943 -0.532 -2.858 1.00 0.00 C ATOM 832 CG2 ILE A 58 11.220 -1.466 -1.247 1.00 0.00 C ATOM 833 CD1 ILE A 58 12.356 0.879 -2.779 1.00 0.00 C ATOM 0 H ILE A 58 15.146 -0.902 -1.567 1.00 0.00 H new ATOM 0 HA ILE A 58 12.975 0.355 -0.276 1.00 0.00 H new ATOM 0 HB ILE A 58 13.125 -2.296 -1.688 1.00 0.00 H new ATOM 0 HG12 ILE A 58 14.012 -0.474 -3.063 1.00 0.00 H new ATOM 0 HG13 ILE A 58 12.488 -1.073 -3.688 1.00 0.00 H new ATOM 0 HG21 ILE A 58 10.726 -1.945 -2.092 1.00 0.00 H new ATOM 0 HG22 ILE A 58 11.100 -2.085 -0.358 1.00 0.00 H new ATOM 0 HG23 ILE A 58 10.771 -0.488 -1.071 1.00 0.00 H new ATOM 0 HD11 ILE A 58 12.536 1.401 -3.719 1.00 0.00 H new ATOM 0 HD12 ILE A 58 11.283 0.817 -2.598 1.00 0.00 H new ATOM 0 HD13 ILE A 58 12.830 1.425 -1.964 1.00 0.00 H new ATOM 845 N LEU A 59 12.343 -0.845 1.750 1.00 0.00 N ATOM 846 CA LEU A 59 12.072 -1.436 3.049 1.00 0.00 C ATOM 847 C LEU A 59 10.691 -2.095 3.027 1.00 0.00 C ATOM 848 O LEU A 59 10.415 -2.995 3.819 1.00 0.00 O ATOM 849 CB LEU A 59 12.238 -0.394 4.157 1.00 0.00 C ATOM 850 CG LEU A 59 13.534 0.418 4.125 1.00 0.00 C ATOM 851 CD1 LEU A 59 13.552 1.467 5.239 1.00 0.00 C ATOM 852 CD2 LEU A 59 14.757 -0.499 4.181 1.00 0.00 C ATOM 0 H LEU A 59 11.774 -0.028 1.526 1.00 0.00 H new ATOM 0 HA LEU A 59 12.797 -2.220 3.269 1.00 0.00 H new ATOM 0 HB2 LEU A 59 11.398 0.298 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 59 12.175 -0.902 5.119 1.00 0.00 H new ATOM 0 HG LEU A 59 13.577 0.955 3.177 1.00 0.00 H new ATOM 0 HD11 LEU A 59 14.484 2.030 5.194 1.00 0.00 H new ATOM 0 HD12 LEU A 59 12.710 2.148 5.111 1.00 0.00 H new ATOM 0 HD13 LEU A 59 13.474 0.971 6.207 1.00 0.00 H new ATOM 0 HD21 LEU A 59 15.665 0.104 4.157 1.00 0.00 H new ATOM 0 HD22 LEU A 59 14.733 -1.082 5.102 1.00 0.00 H new ATOM 0 HD23 LEU A 59 14.746 -1.173 3.324 1.00 0.00 H new ATOM 864 N ALA A 60 9.859 -1.621 2.111 1.00 0.00 N ATOM 865 CA ALA A 60 8.514 -2.153 1.975 1.00 0.00 C ATOM 866 C ALA A 60 7.743 -1.322 0.947 1.00 0.00 C ATOM 867 O ALA A 60 8.324 -0.482 0.261 1.00 0.00 O ATOM 868 CB ALA A 60 7.830 -2.168 3.343 1.00 0.00 C ATOM 0 H ALA A 60 10.091 -0.874 1.456 1.00 0.00 H new ATOM 0 HA ALA A 60 8.543 -3.181 1.614 1.00 0.00 H new ATOM 0 HB1 ALA A 60 6.821 -2.567 3.241 1.00 0.00 H new ATOM 0 HB2 ALA A 60 8.401 -2.795 4.028 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.780 -1.153 3.736 1.00 0.00 H new ATOM 874 N TYR A 61 6.446 -1.585 0.873 1.00 0.00 N ATOM 875 CA TYR A 61 5.590 -0.872 -0.060 1.00 0.00 C ATOM 876 C TYR A 61 4.219 -0.593 0.558 1.00 0.00 C ATOM 877 O TYR A 61 3.907 -1.095 1.637 1.00 0.00 O ATOM 878 CB TYR A 61 5.415 -1.799 -1.264 1.00 0.00 C ATOM 879 CG TYR A 61 6.576 -1.752 -2.259 1.00 0.00 C ATOM 880 CD1 TYR A 61 7.756 -2.409 -1.974 1.00 0.00 C ATOM 881 CD2 TYR A 61 6.444 -1.054 -3.443 1.00 0.00 C ATOM 882 CE1 TYR A 61 8.849 -2.366 -2.910 1.00 0.00 C ATOM 883 CE2 TYR A 61 7.537 -1.011 -4.379 1.00 0.00 C ATOM 884 CZ TYR A 61 8.685 -1.669 -4.067 1.00 0.00 C ATOM 885 OH TYR A 61 9.718 -1.628 -4.951 1.00 0.00 O ATOM 0 H TYR A 61 5.968 -2.282 1.444 1.00 0.00 H new ATOM 0 HA TYR A 61 6.032 0.087 -0.332 1.00 0.00 H new ATOM 0 HB2 TYR A 61 5.297 -2.822 -0.908 1.00 0.00 H new ATOM 0 HB3 TYR A 61 4.494 -1.534 -1.783 1.00 0.00 H new ATOM 0 HD1 TYR A 61 7.859 -2.956 -1.048 1.00 0.00 H new ATOM 0 HD2 TYR A 61 5.521 -0.540 -3.667 1.00 0.00 H new ATOM 0 HE1 TYR A 61 9.778 -2.875 -2.699 1.00 0.00 H new ATOM 0 HE2 TYR A 61 7.447 -0.468 -5.308 1.00 0.00 H new ATOM 0 HH TYR A 61 10.245 -2.451 -4.877 1.00 0.00 H new ATOM 895 N GLN A 62 3.436 0.205 -0.152 1.00 0.00 N ATOM 896 CA GLN A 62 2.105 0.557 0.313 1.00 0.00 C ATOM 897 C GLN A 62 1.101 0.471 -0.838 1.00 0.00 C ATOM 898 O GLN A 62 1.393 0.896 -1.955 1.00 0.00 O ATOM 899 CB GLN A 62 2.095 1.949 0.946 1.00 0.00 C ATOM 900 CG GLN A 62 0.677 2.360 1.346 1.00 0.00 C ATOM 901 CD GLN A 62 0.690 3.659 2.154 1.00 0.00 C ATOM 902 OE1 GLN A 62 0.056 4.669 1.564 1.00 0.00 O flip ATOM 903 NE2 GLN A 62 1.238 3.740 3.241 1.00 0.00 N flip ATOM 0 H GLN A 62 3.698 0.618 -1.047 1.00 0.00 H new ATOM 0 HA GLN A 62 1.810 -0.157 1.082 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.741 1.958 1.824 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.503 2.675 0.243 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.066 2.489 0.452 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.217 1.566 1.934 1.00 0.00 H new ATOM 0 HE21 GLN A 62 1.707 2.926 3.637 1.00 0.00 H new ATOM 0 HE22 GLN A 62 1.227 4.622 3.753 1.00 0.00 H new ATOM 912 N ILE A 63 -0.062 -0.083 -0.526 1.00 0.00 N ATOM 913 CA ILE A 63 -1.112 -0.230 -1.520 1.00 0.00 C ATOM 914 C ILE A 63 -2.419 0.336 -0.963 1.00 0.00 C ATOM 915 O ILE A 63 -2.998 -0.226 -0.035 1.00 0.00 O ATOM 916 CB ILE A 63 -1.217 -1.686 -1.976 1.00 0.00 C ATOM 917 CG1 ILE A 63 -0.588 -1.876 -3.358 1.00 0.00 C ATOM 918 CG2 ILE A 63 -2.668 -2.170 -1.936 1.00 0.00 C ATOM 919 CD1 ILE A 63 0.246 -3.158 -3.410 1.00 0.00 C ATOM 0 H ILE A 63 -0.300 -0.435 0.401 1.00 0.00 H new ATOM 0 HA ILE A 63 -0.872 0.344 -2.415 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.652 -2.303 -1.278 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.371 -1.916 -4.115 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.042 -1.019 -3.596 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -2.714 -3.208 -2.265 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -3.049 -2.095 -0.917 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.276 -1.552 -2.597 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.682 -3.269 -4.403 1.00 0.00 H new ATOM 0 HD12 ILE A 63 1.043 -3.104 -2.668 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.392 -4.016 -3.196 1.00 0.00 H new ATOM 931 N THR A 64 -2.847 1.443 -1.553 1.00 0.00 N ATOM 932 CA THR A 64 -4.076 2.091 -1.128 1.00 0.00 C ATOM 933 C THR A 64 -5.188 1.851 -2.151 1.00 0.00 C ATOM 934 O THR A 64 -5.003 2.093 -3.342 1.00 0.00 O ATOM 935 CB THR A 64 -3.773 3.573 -0.896 1.00 0.00 C ATOM 936 OG1 THR A 64 -3.651 4.111 -2.210 1.00 0.00 O ATOM 937 CG2 THR A 64 -2.394 3.798 -0.272 1.00 0.00 C ATOM 0 H THR A 64 -2.364 1.907 -2.322 1.00 0.00 H new ATOM 0 HA THR A 64 -4.442 1.669 -0.192 1.00 0.00 H new ATOM 0 HB THR A 64 -4.538 4.004 -0.250 1.00 0.00 H new ATOM 0 HG1 THR A 64 -4.134 3.540 -2.843 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.229 4.866 -0.129 1.00 0.00 H new ATOM 0 HG22 THR A 64 -2.343 3.290 0.691 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.626 3.398 -0.934 1.00 0.00 H new ATOM 945 N HIS A 65 -6.318 1.378 -1.648 1.00 0.00 N ATOM 946 CA HIS A 65 -7.460 1.102 -2.503 1.00 0.00 C ATOM 947 C HIS A 65 -8.675 1.889 -2.007 1.00 0.00 C ATOM 948 O HIS A 65 -8.902 1.992 -0.802 1.00 0.00 O ATOM 949 CB HIS A 65 -7.724 -0.403 -2.590 1.00 0.00 C ATOM 950 CG HIS A 65 -7.919 -1.070 -1.249 1.00 0.00 C ATOM 951 ND1 HIS A 65 -7.022 -1.664 -0.411 1.00 0.00 N flip ATOM 952 CD2 HIS A 65 -9.156 -1.178 -0.638 1.00 0.00 C flip ATOM 953 CE1 HIS A 65 -7.675 -2.109 0.656 1.00 0.00 C flip ATOM 954 NE2 HIS A 65 -8.998 -1.808 0.516 1.00 0.00 N flip ATOM 0 H HIS A 65 -6.468 1.179 -0.659 1.00 0.00 H new ATOM 0 HA HIS A 65 -7.246 1.433 -3.519 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -8.611 -0.571 -3.201 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -6.889 -0.879 -3.103 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -10.091 -0.811 -1.035 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -7.232 -2.624 1.496 1.00 0.00 H new ATOM 0 HE2 HIS A 65 -9.737 -2.030 1.184 1.00 0.00 H new ATOM 962 N ARG A 66 -9.424 2.423 -2.960 1.00 0.00 N ATOM 963 CA ARG A 66 -10.610 3.197 -2.635 1.00 0.00 C ATOM 964 C ARG A 66 -11.520 3.312 -3.859 1.00 0.00 C ATOM 965 O ARG A 66 -11.050 3.264 -4.994 1.00 0.00 O ATOM 966 CB ARG A 66 -10.236 4.600 -2.152 1.00 0.00 C ATOM 967 CG ARG A 66 -9.656 5.437 -3.295 1.00 0.00 C ATOM 968 CD ARG A 66 -8.650 6.462 -2.767 1.00 0.00 C ATOM 969 NE ARG A 66 -8.971 7.806 -3.298 1.00 0.00 N ATOM 970 CZ ARG A 66 -8.117 8.838 -3.296 1.00 0.00 C ATOM 971 NH1 ARG A 66 -6.885 8.687 -2.792 1.00 0.00 N ATOM 972 NH2 ARG A 66 -8.495 10.021 -3.799 1.00 0.00 N ATOM 0 H ARG A 66 -9.233 2.335 -3.958 1.00 0.00 H new ATOM 0 HA ARG A 66 -11.136 2.678 -1.834 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -11.117 5.095 -1.745 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -9.509 4.528 -1.343 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -9.169 4.783 -4.019 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -10.462 5.950 -3.820 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -8.672 6.478 -1.677 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -7.640 6.177 -3.061 1.00 0.00 H new ATOM 0 HE ARG A 66 -9.901 7.956 -3.690 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -6.597 7.786 -2.410 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -6.235 9.473 -2.791 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -9.433 10.136 -4.183 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -7.845 10.807 -3.798 1.00 0.00 H new ATOM 986 N LEU A 67 -12.808 3.462 -3.586 1.00 0.00 N ATOM 987 CA LEU A 67 -13.790 3.584 -4.651 1.00 0.00 C ATOM 988 C LEU A 67 -13.689 4.979 -5.273 1.00 0.00 C ATOM 989 O LEU A 67 -14.065 5.969 -4.649 1.00 0.00 O ATOM 990 CB LEU A 67 -15.188 3.241 -4.133 1.00 0.00 C ATOM 991 CG LEU A 67 -15.566 1.758 -4.156 1.00 0.00 C ATOM 992 CD1 LEU A 67 -17.060 1.570 -3.887 1.00 0.00 C ATOM 993 CD2 LEU A 67 -15.132 1.102 -5.468 1.00 0.00 C ATOM 0 H LEU A 67 -13.195 3.502 -2.643 1.00 0.00 H new ATOM 0 HA LEU A 67 -13.584 2.865 -5.444 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -15.273 3.601 -3.108 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -15.919 3.791 -4.726 1.00 0.00 H new ATOM 0 HG LEU A 67 -15.028 1.255 -3.352 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -17.303 0.508 -3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -17.308 1.979 -2.907 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -17.636 2.089 -4.653 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -15.412 0.049 -5.458 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -15.623 1.601 -6.304 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -14.051 1.189 -5.578 1.00 0.00 H new ATOM 1005 N ASN A 68 -13.182 5.011 -6.497 1.00 0.00 N ATOM 1006 CA ASN A 68 -13.027 6.267 -7.210 1.00 0.00 C ATOM 1007 C ASN A 68 -14.328 7.067 -7.111 1.00 0.00 C ATOM 1008 O ASN A 68 -14.317 8.292 -7.229 1.00 0.00 O ATOM 1009 CB ASN A 68 -12.732 6.026 -8.692 1.00 0.00 C ATOM 1010 CG ASN A 68 -11.723 7.046 -9.223 1.00 0.00 C ATOM 1011 OD1 ASN A 68 -10.989 7.676 -8.480 1.00 0.00 O ATOM 1012 ND2 ASN A 68 -11.729 7.174 -10.547 1.00 0.00 N ATOM 0 H ASN A 68 -12.873 4.187 -7.013 1.00 0.00 H new ATOM 0 HA ASN A 68 -12.196 6.810 -6.761 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -12.342 5.018 -8.829 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -13.656 6.091 -9.266 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -11.093 7.831 -10.999 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -12.370 6.615 -11.110 1.00 0.00 H new ATOM 1019 N THR A 69 -15.416 6.343 -6.896 1.00 0.00 N ATOM 1020 CA THR A 69 -16.721 6.971 -6.779 1.00 0.00 C ATOM 1021 C THR A 69 -17.461 6.439 -5.550 1.00 0.00 C ATOM 1022 O THR A 69 -16.842 5.905 -4.631 1.00 0.00 O ATOM 1023 CB THR A 69 -17.476 6.739 -8.090 1.00 0.00 C ATOM 1024 OG1 THR A 69 -17.664 5.327 -8.137 1.00 0.00 O ATOM 1025 CG2 THR A 69 -16.619 7.042 -9.321 1.00 0.00 C ATOM 0 H THR A 69 -15.421 5.328 -6.800 1.00 0.00 H new ATOM 0 HA THR A 69 -16.630 8.046 -6.625 1.00 0.00 H new ATOM 0 HB THR A 69 -18.371 7.361 -8.109 1.00 0.00 H new ATOM 0 HG1 THR A 69 -18.148 5.088 -8.955 1.00 0.00 H new ATOM 0 HG21 THR A 69 -17.202 6.861 -10.224 1.00 0.00 H new ATOM 0 HG22 THR A 69 -16.302 8.085 -9.296 1.00 0.00 H new ATOM 0 HG23 THR A 69 -15.741 6.396 -9.321 1.00 0.00 H new ATOM 1033 N THR A 70 -18.776 6.603 -5.573 1.00 0.00 N ATOM 1034 CA THR A 70 -19.606 6.147 -4.472 1.00 0.00 C ATOM 1035 C THR A 70 -19.106 6.729 -3.149 1.00 0.00 C ATOM 1036 O THR A 70 -18.067 7.386 -3.110 1.00 0.00 O ATOM 1037 CB THR A 70 -19.623 4.617 -4.496 1.00 0.00 C ATOM 1038 OG1 THR A 70 -20.943 4.278 -4.081 1.00 0.00 O ATOM 1039 CG2 THR A 70 -18.725 4.005 -3.418 1.00 0.00 C ATOM 0 H THR A 70 -19.287 7.045 -6.337 1.00 0.00 H new ATOM 0 HA THR A 70 -20.632 6.500 -4.577 1.00 0.00 H new ATOM 0 HB THR A 70 -19.304 4.266 -5.477 1.00 0.00 H new ATOM 0 HG1 THR A 70 -21.042 3.303 -4.070 1.00 0.00 H new ATOM 0 HG21 THR A 70 -18.773 2.918 -3.478 1.00 0.00 H new ATOM 0 HG22 THR A 70 -17.697 4.332 -3.572 1.00 0.00 H new ATOM 0 HG23 THR A 70 -19.065 4.329 -2.434 1.00 0.00 H new ATOM 1047 N THR A 71 -19.868 6.466 -2.098 1.00 0.00 N ATOM 1048 CA THR A 71 -19.515 6.956 -0.776 1.00 0.00 C ATOM 1049 C THR A 71 -17.998 6.910 -0.578 1.00 0.00 C ATOM 1050 O THR A 71 -17.364 5.890 -0.844 1.00 0.00 O ATOM 1051 CB THR A 71 -20.287 6.132 0.256 1.00 0.00 C ATOM 1052 OG1 THR A 71 -19.863 4.793 0.018 1.00 0.00 O ATOM 1053 CG2 THR A 71 -21.791 6.102 -0.026 1.00 0.00 C ATOM 0 H THR A 71 -20.729 5.920 -2.135 1.00 0.00 H new ATOM 0 HA THR A 71 -19.796 8.002 -0.654 1.00 0.00 H new ATOM 0 HB THR A 71 -20.112 6.540 1.251 1.00 0.00 H new ATOM 0 HG1 THR A 71 -18.945 4.797 -0.325 1.00 0.00 H new ATOM 0 HG21 THR A 71 -22.292 5.504 0.735 1.00 0.00 H new ATOM 0 HG22 THR A 71 -22.185 7.118 -0.007 1.00 0.00 H new ATOM 0 HG23 THR A 71 -21.968 5.662 -1.007 1.00 0.00 H new ATOM 1061 N ALA A 72 -17.460 8.028 -0.113 1.00 0.00 N ATOM 1062 CA ALA A 72 -16.030 8.128 0.123 1.00 0.00 C ATOM 1063 C ALA A 72 -15.773 8.251 1.627 1.00 0.00 C ATOM 1064 O ALA A 72 -16.468 8.993 2.320 1.00 0.00 O ATOM 1065 CB ALA A 72 -15.464 9.312 -0.663 1.00 0.00 C ATOM 0 H ALA A 72 -17.989 8.872 0.107 1.00 0.00 H new ATOM 0 HA ALA A 72 -15.520 7.230 -0.227 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -14.391 9.387 -0.486 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -15.646 9.163 -1.727 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -15.951 10.231 -0.337 1.00 0.00 H new ATOM 1071 N ASN A 73 -14.775 7.512 2.087 1.00 0.00 N ATOM 1072 CA ASN A 73 -14.418 7.529 3.495 1.00 0.00 C ATOM 1073 C ASN A 73 -13.048 6.872 3.678 1.00 0.00 C ATOM 1074 O ASN A 73 -12.951 5.651 3.788 1.00 0.00 O ATOM 1075 CB ASN A 73 -15.433 6.745 4.330 1.00 0.00 C ATOM 1076 CG ASN A 73 -15.936 7.581 5.509 1.00 0.00 C ATOM 1077 OD1 ASN A 73 -16.781 8.450 5.371 1.00 0.00 O ATOM 1078 ND2 ASN A 73 -15.371 7.270 6.672 1.00 0.00 N ATOM 0 H ASN A 73 -14.202 6.897 1.509 1.00 0.00 H new ATOM 0 HA ASN A 73 -14.403 8.567 3.826 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -16.275 6.450 3.703 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -14.974 5.828 4.699 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -15.639 7.771 7.519 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -14.669 6.531 6.717 1.00 0.00 H new ATOM 1085 N THR A 74 -12.024 7.712 3.704 1.00 0.00 N ATOM 1086 CA THR A 74 -10.664 7.228 3.871 1.00 0.00 C ATOM 1087 C THR A 74 -10.379 6.089 2.891 1.00 0.00 C ATOM 1088 O THR A 74 -11.284 5.611 2.209 1.00 0.00 O ATOM 1089 CB THR A 74 -10.481 6.830 5.337 1.00 0.00 C ATOM 1090 OG1 THR A 74 -11.599 5.990 5.611 1.00 0.00 O ATOM 1091 CG2 THR A 74 -10.660 8.012 6.292 1.00 0.00 C ATOM 0 H THR A 74 -12.109 8.724 3.612 1.00 0.00 H new ATOM 0 HA THR A 74 -9.936 8.005 3.637 1.00 0.00 H new ATOM 0 HB THR A 74 -9.489 6.400 5.475 1.00 0.00 H new ATOM 0 HG1 THR A 74 -11.819 5.467 4.812 1.00 0.00 H new ATOM 0 HG21 THR A 74 -10.520 7.675 7.319 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.925 8.782 6.059 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.663 8.422 6.179 1.00 0.00 H new ATOM 1099 N ALA A 75 -9.117 5.686 2.853 1.00 0.00 N ATOM 1100 CA ALA A 75 -8.701 4.611 1.968 1.00 0.00 C ATOM 1101 C ALA A 75 -7.909 3.575 2.768 1.00 0.00 C ATOM 1102 O ALA A 75 -6.924 3.912 3.424 1.00 0.00 O ATOM 1103 CB ALA A 75 -7.895 5.190 0.805 1.00 0.00 C ATOM 0 H ALA A 75 -8.369 6.085 3.421 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.569 4.106 1.543 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.583 4.384 0.141 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.512 5.897 0.251 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.014 5.702 1.192 1.00 0.00 H new ATOM 1109 N THR A 76 -8.368 2.335 2.688 1.00 0.00 N ATOM 1110 CA THR A 76 -7.715 1.247 3.397 1.00 0.00 C ATOM 1111 C THR A 76 -6.291 1.048 2.872 1.00 0.00 C ATOM 1112 O THR A 76 -6.083 0.345 1.884 1.00 0.00 O ATOM 1113 CB THR A 76 -8.592 0.001 3.263 1.00 0.00 C ATOM 1114 OG1 THR A 76 -9.734 0.292 4.064 1.00 0.00 O ATOM 1115 CG2 THR A 76 -7.971 -1.227 3.932 1.00 0.00 C ATOM 0 H THR A 76 -9.185 2.059 2.143 1.00 0.00 H new ATOM 0 HA THR A 76 -7.608 1.474 4.458 1.00 0.00 H new ATOM 0 HB THR A 76 -8.765 -0.209 2.207 1.00 0.00 H new ATOM 0 HG1 THR A 76 -10.357 -0.464 4.032 1.00 0.00 H new ATOM 0 HG21 THR A 76 -8.634 -2.083 3.808 1.00 0.00 H new ATOM 0 HG22 THR A 76 -7.007 -1.444 3.471 1.00 0.00 H new ATOM 0 HG23 THR A 76 -7.829 -1.030 4.995 1.00 0.00 H new ATOM 1123 N VAL A 77 -5.349 1.680 3.555 1.00 0.00 N ATOM 1124 CA VAL A 77 -3.951 1.581 3.170 1.00 0.00 C ATOM 1125 C VAL A 77 -3.354 0.302 3.760 1.00 0.00 C ATOM 1126 O VAL A 77 -3.704 -0.097 4.869 1.00 0.00 O ATOM 1127 CB VAL A 77 -3.200 2.844 3.597 1.00 0.00 C ATOM 1128 CG1 VAL A 77 -1.697 2.698 3.348 1.00 0.00 C ATOM 1129 CG2 VAL A 77 -3.756 4.079 2.886 1.00 0.00 C ATOM 0 H VAL A 77 -5.526 2.263 4.373 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.857 1.514 2.086 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.351 2.978 4.668 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -1.186 3.609 3.660 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -1.314 1.853 3.920 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -1.519 2.528 2.286 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.205 4.963 3.207 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -3.650 3.957 1.808 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.810 4.199 3.135 1.00 0.00 H new ATOM 1139 N GLU A 78 -2.461 -0.305 2.991 1.00 0.00 N ATOM 1140 CA GLU A 78 -1.812 -1.531 3.424 1.00 0.00 C ATOM 1141 C GLU A 78 -0.315 -1.477 3.111 1.00 0.00 C ATOM 1142 O GLU A 78 0.080 -1.094 2.011 1.00 0.00 O ATOM 1143 CB GLU A 78 -2.463 -2.754 2.777 1.00 0.00 C ATOM 1144 CG GLU A 78 -1.611 -4.007 2.991 1.00 0.00 C ATOM 1145 CD GLU A 78 -2.439 -5.134 3.612 1.00 0.00 C ATOM 1146 OE1 GLU A 78 -3.485 -5.467 3.013 1.00 0.00 O ATOM 1147 OE2 GLU A 78 -2.008 -5.637 4.672 1.00 0.00 O ATOM 0 H GLU A 78 -2.172 0.029 2.072 1.00 0.00 H new ATOM 0 HA GLU A 78 -1.935 -1.623 4.503 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.456 -2.908 3.200 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.595 -2.578 1.709 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.198 -4.337 2.038 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.767 -3.771 3.640 1.00 0.00 H new ATOM 1154 N VAL A 79 0.478 -1.866 4.099 1.00 0.00 N ATOM 1155 CA VAL A 79 1.922 -1.867 3.943 1.00 0.00 C ATOM 1156 C VAL A 79 2.388 -3.271 3.550 1.00 0.00 C ATOM 1157 O VAL A 79 2.028 -4.252 4.199 1.00 0.00 O ATOM 1158 CB VAL A 79 2.587 -1.353 5.221 1.00 0.00 C ATOM 1159 CG1 VAL A 79 3.935 -2.040 5.453 1.00 0.00 C ATOM 1160 CG2 VAL A 79 2.746 0.168 5.183 1.00 0.00 C ATOM 0 H VAL A 79 0.147 -2.183 5.010 1.00 0.00 H new ATOM 0 HA VAL A 79 2.220 -1.190 3.142 1.00 0.00 H new ATOM 0 HB VAL A 79 1.936 -1.601 6.060 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.386 -1.656 6.368 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.784 -3.115 5.546 1.00 0.00 H new ATOM 0 HG13 VAL A 79 4.596 -1.838 4.610 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.221 0.507 6.103 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.365 0.448 4.330 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.765 0.634 5.088 1.00 0.00 H new ATOM 1170 N LEU A 80 3.180 -3.322 2.490 1.00 0.00 N ATOM 1171 CA LEU A 80 3.699 -4.589 2.003 1.00 0.00 C ATOM 1172 C LEU A 80 5.204 -4.655 2.268 1.00 0.00 C ATOM 1173 O LEU A 80 5.808 -3.668 2.686 1.00 0.00 O ATOM 1174 CB LEU A 80 3.324 -4.792 0.533 1.00 0.00 C ATOM 1175 CG LEU A 80 1.847 -5.074 0.251 1.00 0.00 C ATOM 1176 CD1 LEU A 80 1.339 -4.223 -0.914 1.00 0.00 C ATOM 1177 CD2 LEU A 80 1.610 -6.567 0.015 1.00 0.00 C ATOM 0 H LEU A 80 3.475 -2.506 1.954 1.00 0.00 H new ATOM 0 HA LEU A 80 3.243 -5.420 2.542 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.616 -3.901 -0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.913 -5.620 0.139 1.00 0.00 H new ATOM 0 HG LEU A 80 1.271 -4.791 1.132 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.287 -4.443 -1.093 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.452 -3.167 -0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 80 1.915 -4.452 -1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.552 -6.741 -0.183 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.199 -6.898 -0.841 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.910 -7.127 0.900 1.00 0.00 H new ATOM 1189 N ALA A 81 5.766 -5.828 2.014 1.00 0.00 N ATOM 1190 CA ALA A 81 7.189 -6.035 2.221 1.00 0.00 C ATOM 1191 C ALA A 81 7.965 -5.420 1.054 1.00 0.00 C ATOM 1192 O ALA A 81 7.377 -5.058 0.036 1.00 0.00 O ATOM 1193 CB ALA A 81 7.469 -7.531 2.382 1.00 0.00 C ATOM 0 H ALA A 81 5.262 -6.644 1.667 1.00 0.00 H new ATOM 0 HA ALA A 81 7.520 -5.540 3.134 1.00 0.00 H new ATOM 0 HB1 ALA A 81 8.537 -7.687 2.537 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.918 -7.914 3.241 1.00 0.00 H new ATOM 0 HB3 ALA A 81 7.152 -8.059 1.483 1.00 0.00 H new ATOM 1199 N PRO A 82 9.307 -5.316 1.247 1.00 0.00 N ATOM 1200 CA PRO A 82 10.169 -4.751 0.223 1.00 0.00 C ATOM 1201 C PRO A 82 10.375 -5.738 -0.927 1.00 0.00 C ATOM 1202 O PRO A 82 11.079 -5.437 -1.890 1.00 0.00 O ATOM 1203 CB PRO A 82 11.460 -4.401 0.945 1.00 0.00 C ATOM 1204 CG PRO A 82 11.447 -5.205 2.235 1.00 0.00 C ATOM 1205 CD PRO A 82 10.037 -5.734 2.441 1.00 0.00 C ATOM 0 HA PRO A 82 9.739 -3.867 -0.248 1.00 0.00 H new ATOM 0 HB2 PRO A 82 12.329 -4.653 0.336 1.00 0.00 H new ATOM 0 HB3 PRO A 82 11.515 -3.332 1.151 1.00 0.00 H new ATOM 0 HG2 PRO A 82 12.159 -6.028 2.179 1.00 0.00 H new ATOM 0 HG3 PRO A 82 11.747 -4.581 3.077 1.00 0.00 H new ATOM 0 HD2 PRO A 82 10.033 -6.819 2.549 1.00 0.00 H new ATOM 0 HD3 PRO A 82 9.587 -5.322 3.345 1.00 0.00 H new ATOM 1213 N SER A 83 9.749 -6.898 -0.788 1.00 0.00 N ATOM 1214 CA SER A 83 9.855 -7.931 -1.804 1.00 0.00 C ATOM 1215 C SER A 83 8.461 -8.332 -2.290 1.00 0.00 C ATOM 1216 O SER A 83 8.232 -9.487 -2.647 1.00 0.00 O ATOM 1217 CB SER A 83 10.602 -9.155 -1.269 1.00 0.00 C ATOM 1218 OG SER A 83 11.228 -9.897 -2.312 1.00 0.00 O ATOM 0 H SER A 83 9.167 -7.145 0.013 1.00 0.00 H new ATOM 0 HA SER A 83 10.424 -7.529 -2.642 1.00 0.00 H new ATOM 0 HB2 SER A 83 11.356 -8.834 -0.550 1.00 0.00 H new ATOM 0 HB3 SER A 83 9.905 -9.800 -0.734 1.00 0.00 H new ATOM 0 HG SER A 83 11.695 -10.669 -1.929 1.00 0.00 H new ATOM 1224 N ALA A 84 7.565 -7.356 -2.290 1.00 0.00 N ATOM 1225 CA ALA A 84 6.200 -7.592 -2.726 1.00 0.00 C ATOM 1226 C ALA A 84 5.989 -6.947 -4.097 1.00 0.00 C ATOM 1227 O ALA A 84 6.013 -5.723 -4.222 1.00 0.00 O ATOM 1228 CB ALA A 84 5.227 -7.057 -1.674 1.00 0.00 C ATOM 0 H ALA A 84 7.758 -6.399 -1.995 1.00 0.00 H new ATOM 0 HA ALA A 84 6.010 -8.660 -2.831 1.00 0.00 H new ATOM 0 HB1 ALA A 84 4.203 -7.234 -2.002 1.00 0.00 H new ATOM 0 HB2 ALA A 84 5.398 -7.568 -0.727 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.386 -5.987 -1.543 1.00 0.00 H new ATOM 1234 N ARG A 85 5.787 -7.798 -5.092 1.00 0.00 N ATOM 1235 CA ARG A 85 5.571 -7.326 -6.449 1.00 0.00 C ATOM 1236 C ARG A 85 4.075 -7.295 -6.769 1.00 0.00 C ATOM 1237 O ARG A 85 3.641 -6.557 -7.652 1.00 0.00 O ATOM 1238 CB ARG A 85 6.284 -8.223 -7.464 1.00 0.00 C ATOM 1239 CG ARG A 85 7.802 -8.152 -7.285 1.00 0.00 C ATOM 1240 CD ARG A 85 8.477 -7.600 -8.542 1.00 0.00 C ATOM 1241 NE ARG A 85 9.101 -8.702 -9.308 1.00 0.00 N ATOM 1242 CZ ARG A 85 10.256 -9.292 -8.970 1.00 0.00 C ATOM 1243 NH1 ARG A 85 10.919 -8.889 -7.878 1.00 0.00 N ATOM 1244 NH2 ARG A 85 10.747 -10.285 -9.724 1.00 0.00 N ATOM 0 H ARG A 85 5.768 -8.812 -4.985 1.00 0.00 H new ATOM 0 HA ARG A 85 5.982 -6.319 -6.519 1.00 0.00 H new ATOM 0 HB2 ARG A 85 5.948 -9.253 -7.344 1.00 0.00 H new ATOM 0 HB3 ARG A 85 6.018 -7.916 -8.476 1.00 0.00 H new ATOM 0 HG2 ARG A 85 8.042 -7.518 -6.431 1.00 0.00 H new ATOM 0 HG3 ARG A 85 8.193 -9.145 -7.065 1.00 0.00 H new ATOM 0 HD2 ARG A 85 7.743 -7.085 -9.162 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.233 -6.865 -8.266 1.00 0.00 H new ATOM 0 HE ARG A 85 8.622 -9.033 -10.145 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.545 -8.133 -7.304 1.00 0.00 H new ATOM 0 HH12 ARG A 85 11.798 -9.338 -7.620 1.00 0.00 H new ATOM 0 HH21 ARG A 85 10.242 -10.592 -10.555 1.00 0.00 H new ATOM 0 HH22 ARG A 85 11.626 -10.734 -9.467 1.00 0.00 H new ATOM 1258 N GLN A 86 3.328 -8.106 -6.034 1.00 0.00 N ATOM 1259 CA GLN A 86 1.891 -8.181 -6.229 1.00 0.00 C ATOM 1260 C GLN A 86 1.164 -7.989 -4.896 1.00 0.00 C ATOM 1261 O GLN A 86 1.799 -7.891 -3.847 1.00 0.00 O ATOM 1262 CB GLN A 86 1.494 -9.505 -6.884 1.00 0.00 C ATOM 1263 CG GLN A 86 2.474 -9.881 -7.997 1.00 0.00 C ATOM 1264 CD GLN A 86 3.150 -11.222 -7.702 1.00 0.00 C ATOM 1265 OE1 GLN A 86 3.452 -11.559 -6.569 1.00 0.00 O ATOM 1266 NE2 GLN A 86 3.371 -11.966 -8.782 1.00 0.00 N ATOM 0 H GLN A 86 3.692 -8.717 -5.302 1.00 0.00 H new ATOM 0 HA GLN A 86 1.593 -7.377 -6.903 1.00 0.00 H new ATOM 0 HB2 GLN A 86 1.471 -10.294 -6.133 1.00 0.00 H new ATOM 0 HB3 GLN A 86 0.487 -9.425 -7.293 1.00 0.00 H new ATOM 0 HG2 GLN A 86 1.945 -9.938 -8.948 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.230 -9.103 -8.099 1.00 0.00 H new ATOM 0 HE21 GLN A 86 3.093 -11.624 -9.702 1.00 0.00 H new ATOM 0 HE22 GLN A 86 3.818 -12.878 -8.690 1.00 0.00 H new ATOM 1275 N TYR A 87 -0.158 -7.941 -4.981 1.00 0.00 N ATOM 1276 CA TYR A 87 -0.977 -7.763 -3.795 1.00 0.00 C ATOM 1277 C TYR A 87 -2.421 -8.197 -4.056 1.00 0.00 C ATOM 1278 O TYR A 87 -2.920 -8.066 -5.172 1.00 0.00 O ATOM 1279 CB TYR A 87 -0.955 -6.265 -3.488 1.00 0.00 C ATOM 1280 CG TYR A 87 -2.028 -5.817 -2.492 1.00 0.00 C ATOM 1281 CD1 TYR A 87 -1.785 -5.895 -1.136 1.00 0.00 C ATOM 1282 CD2 TYR A 87 -3.237 -5.336 -2.951 1.00 0.00 C ATOM 1283 CE1 TYR A 87 -2.795 -5.474 -0.199 1.00 0.00 C ATOM 1284 CE2 TYR A 87 -4.246 -4.915 -2.014 1.00 0.00 C ATOM 1285 CZ TYR A 87 -3.975 -5.005 -0.685 1.00 0.00 C ATOM 1286 OH TYR A 87 -4.929 -4.607 0.200 1.00 0.00 O ATOM 0 H TYR A 87 -0.681 -8.022 -5.853 1.00 0.00 H new ATOM 0 HA TYR A 87 -0.594 -8.364 -2.970 1.00 0.00 H new ATOM 0 HB2 TYR A 87 0.026 -6.000 -3.093 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -1.084 -5.712 -4.418 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -0.838 -6.271 -0.777 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -3.426 -5.275 -4.013 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -2.619 -5.530 0.865 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -5.197 -4.536 -2.359 1.00 0.00 H new ATOM 0 HH TYR A 87 -4.625 -4.791 1.113 1.00 0.00 H new ATOM 1296 N THR A 88 -3.052 -8.704 -3.007 1.00 0.00 N ATOM 1297 CA THR A 88 -4.428 -9.158 -3.109 1.00 0.00 C ATOM 1298 C THR A 88 -5.353 -8.240 -2.308 1.00 0.00 C ATOM 1299 O THR A 88 -5.115 -7.989 -1.127 1.00 0.00 O ATOM 1300 CB THR A 88 -4.480 -10.618 -2.654 1.00 0.00 C ATOM 1301 OG1 THR A 88 -3.535 -11.276 -3.493 1.00 0.00 O ATOM 1302 CG2 THR A 88 -5.812 -11.291 -2.994 1.00 0.00 C ATOM 0 H THR A 88 -2.635 -8.810 -2.082 1.00 0.00 H new ATOM 0 HA THR A 88 -4.784 -9.110 -4.138 1.00 0.00 H new ATOM 0 HB THR A 88 -4.312 -10.669 -1.578 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.503 -12.229 -3.265 1.00 0.00 H new ATOM 0 HG21 THR A 88 -5.796 -12.325 -2.649 1.00 0.00 H new ATOM 0 HG22 THR A 88 -6.625 -10.757 -2.502 1.00 0.00 H new ATOM 0 HG23 THR A 88 -5.965 -11.271 -4.073 1.00 0.00 H new ATOM 1310 N ALA A 89 -6.390 -7.763 -2.982 1.00 0.00 N ATOM 1311 CA ALA A 89 -7.351 -6.877 -2.348 1.00 0.00 C ATOM 1312 C ALA A 89 -8.660 -7.634 -2.117 1.00 0.00 C ATOM 1313 O ALA A 89 -9.238 -8.183 -3.055 1.00 0.00 O ATOM 1314 CB ALA A 89 -7.544 -5.629 -3.212 1.00 0.00 C ATOM 0 H ALA A 89 -6.585 -7.974 -3.961 1.00 0.00 H new ATOM 0 HA ALA A 89 -6.985 -6.546 -1.376 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -8.265 -4.965 -2.736 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -6.591 -5.111 -3.322 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -7.914 -5.921 -4.195 1.00 0.00 H new ATOM 1320 N THR A 90 -9.091 -7.641 -0.864 1.00 0.00 N ATOM 1321 CA THR A 90 -10.321 -8.322 -0.498 1.00 0.00 C ATOM 1322 C THR A 90 -11.256 -7.369 0.249 1.00 0.00 C ATOM 1323 O THR A 90 -10.801 -6.429 0.899 1.00 0.00 O ATOM 1324 CB THR A 90 -9.950 -9.567 0.310 1.00 0.00 C ATOM 1325 OG1 THR A 90 -9.057 -9.080 1.308 1.00 0.00 O ATOM 1326 CG2 THR A 90 -9.105 -10.557 -0.495 1.00 0.00 C ATOM 0 H THR A 90 -8.610 -7.185 -0.089 1.00 0.00 H new ATOM 0 HA THR A 90 -10.873 -8.643 -1.381 1.00 0.00 H new ATOM 0 HB THR A 90 -10.859 -10.061 0.653 1.00 0.00 H new ATOM 0 HG1 THR A 90 -8.768 -9.822 1.879 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.869 -11.422 0.125 1.00 0.00 H new ATOM 0 HG22 THR A 90 -9.663 -10.881 -1.374 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.180 -10.074 -0.810 1.00 0.00 H new ATOM 1334 N GLY A 91 -12.547 -7.645 0.132 1.00 0.00 N ATOM 1335 CA GLY A 91 -13.550 -6.824 0.788 1.00 0.00 C ATOM 1336 C GLY A 91 -13.836 -5.557 -0.020 1.00 0.00 C ATOM 1337 O GLY A 91 -13.708 -4.447 0.493 1.00 0.00 O ATOM 0 H GLY A 91 -12.921 -8.426 -0.407 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -14.470 -7.396 0.911 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -13.207 -6.553 1.786 1.00 0.00 H new ATOM 1341 N LEU A 92 -14.219 -5.766 -1.271 1.00 0.00 N ATOM 1342 CA LEU A 92 -14.525 -4.655 -2.156 1.00 0.00 C ATOM 1343 C LEU A 92 -15.962 -4.792 -2.663 1.00 0.00 C ATOM 1344 O LEU A 92 -16.571 -5.854 -2.534 1.00 0.00 O ATOM 1345 CB LEU A 92 -13.485 -4.558 -3.274 1.00 0.00 C ATOM 1346 CG LEU A 92 -12.038 -4.844 -2.870 1.00 0.00 C ATOM 1347 CD1 LEU A 92 -11.231 -5.373 -4.058 1.00 0.00 C ATOM 1348 CD2 LEU A 92 -11.389 -3.609 -2.242 1.00 0.00 C ATOM 0 H LEU A 92 -14.324 -6.689 -1.693 1.00 0.00 H new ATOM 0 HA LEU A 92 -14.467 -3.711 -1.615 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -13.765 -5.254 -4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -13.531 -3.556 -3.700 1.00 0.00 H new ATOM 0 HG LEU A 92 -12.044 -5.626 -2.111 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -10.206 -5.568 -3.743 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.681 -6.297 -4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.230 -4.631 -4.857 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -10.361 -3.840 -1.964 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -11.395 -2.790 -2.961 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -11.948 -3.316 -1.353 1.00 0.00 H new ATOM 1360 N LYS A 93 -16.463 -3.704 -3.229 1.00 0.00 N ATOM 1361 CA LYS A 93 -17.817 -3.690 -3.756 1.00 0.00 C ATOM 1362 C LYS A 93 -17.772 -3.894 -5.271 1.00 0.00 C ATOM 1363 O LYS A 93 -17.002 -3.234 -5.967 1.00 0.00 O ATOM 1364 CB LYS A 93 -18.546 -2.415 -3.328 1.00 0.00 C ATOM 1365 CG LYS A 93 -19.904 -2.299 -4.023 1.00 0.00 C ATOM 1366 CD LYS A 93 -20.095 -0.906 -4.626 1.00 0.00 C ATOM 1367 CE LYS A 93 -20.039 0.172 -3.542 1.00 0.00 C ATOM 1368 NZ LYS A 93 -21.372 0.356 -2.925 1.00 0.00 N ATOM 0 H LYS A 93 -15.955 -2.826 -3.334 1.00 0.00 H new ATOM 0 HA LYS A 93 -18.396 -4.515 -3.340 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -18.686 -2.418 -2.247 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -17.935 -1.545 -3.568 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -19.980 -3.052 -4.807 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -20.701 -2.502 -3.308 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -19.321 -0.719 -5.371 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -21.053 -0.858 -5.143 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -19.314 -0.109 -2.778 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -19.698 1.113 -3.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -21.317 1.091 -2.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -22.055 0.645 -3.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -21.682 -0.539 -2.496 1.00 0.00 H new ATOM 1382 N PRO A 94 -18.630 -4.834 -5.751 1.00 0.00 N ATOM 1383 CA PRO A 94 -18.695 -5.133 -7.171 1.00 0.00 C ATOM 1384 C PRO A 94 -19.429 -4.026 -7.931 1.00 0.00 C ATOM 1385 O PRO A 94 -20.198 -3.268 -7.342 1.00 0.00 O ATOM 1386 CB PRO A 94 -19.396 -6.479 -7.258 1.00 0.00 C ATOM 1387 CG PRO A 94 -20.109 -6.664 -5.929 1.00 0.00 C ATOM 1388 CD PRO A 94 -19.557 -5.635 -4.956 1.00 0.00 C ATOM 0 HA PRO A 94 -17.711 -5.181 -7.636 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -20.104 -6.498 -8.087 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -18.680 -7.282 -7.432 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -21.184 -6.535 -6.052 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -19.951 -7.673 -5.548 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -20.353 -5.020 -4.536 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -19.049 -6.114 -4.119 1.00 0.00 H new ATOM 1396 N GLU A 95 -19.165 -3.968 -9.228 1.00 0.00 N ATOM 1397 CA GLU A 95 -19.790 -2.967 -10.075 1.00 0.00 C ATOM 1398 C GLU A 95 -19.324 -1.566 -9.674 1.00 0.00 C ATOM 1399 O GLU A 95 -20.135 -0.650 -9.546 1.00 0.00 O ATOM 1400 CB GLU A 95 -21.316 -3.074 -10.016 1.00 0.00 C ATOM 1401 CG GLU A 95 -21.817 -4.238 -10.873 1.00 0.00 C ATOM 1402 CD GLU A 95 -22.960 -4.979 -10.177 1.00 0.00 C ATOM 1403 OE1 GLU A 95 -22.672 -5.629 -9.148 1.00 0.00 O ATOM 1404 OE2 GLU A 95 -24.096 -4.879 -10.688 1.00 0.00 O ATOM 0 H GLU A 95 -18.526 -4.598 -9.713 1.00 0.00 H new ATOM 0 HA GLU A 95 -19.485 -3.150 -11.105 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -21.635 -3.215 -8.983 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -21.763 -2.143 -10.364 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -22.156 -3.863 -11.839 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -20.997 -4.929 -11.069 1.00 0.00 H new ATOM 1411 N SER A 96 -18.018 -1.443 -9.487 1.00 0.00 N ATOM 1412 CA SER A 96 -17.433 -0.169 -9.103 1.00 0.00 C ATOM 1413 C SER A 96 -15.982 -0.094 -9.581 1.00 0.00 C ATOM 1414 O SER A 96 -15.482 -1.027 -10.209 1.00 0.00 O ATOM 1415 CB SER A 96 -17.504 0.035 -7.589 1.00 0.00 C ATOM 1416 OG SER A 96 -18.758 0.576 -7.181 1.00 0.00 O ATOM 0 H SER A 96 -17.348 -2.205 -9.594 1.00 0.00 H new ATOM 0 HA SER A 96 -18.006 0.627 -9.577 1.00 0.00 H new ATOM 0 HB2 SER A 96 -17.340 -0.918 -7.087 1.00 0.00 H new ATOM 0 HB3 SER A 96 -16.702 0.703 -7.275 1.00 0.00 H new ATOM 0 HG SER A 96 -19.454 0.303 -7.814 1.00 0.00 H new ATOM 1422 N VAL A 97 -15.345 1.024 -9.266 1.00 0.00 N ATOM 1423 CA VAL A 97 -13.961 1.233 -9.656 1.00 0.00 C ATOM 1424 C VAL A 97 -13.121 1.512 -8.408 1.00 0.00 C ATOM 1425 O VAL A 97 -13.553 2.238 -7.514 1.00 0.00 O ATOM 1426 CB VAL A 97 -13.874 2.350 -10.698 1.00 0.00 C ATOM 1427 CG1 VAL A 97 -12.512 2.344 -11.395 1.00 0.00 C ATOM 1428 CG2 VAL A 97 -15.012 2.242 -11.714 1.00 0.00 C ATOM 0 H VAL A 97 -15.762 1.795 -8.745 1.00 0.00 H new ATOM 0 HA VAL A 97 -13.557 0.337 -10.126 1.00 0.00 H new ATOM 0 HB VAL A 97 -13.980 3.302 -10.179 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -12.476 3.147 -12.131 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -11.725 2.493 -10.656 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -12.364 1.387 -11.895 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -14.927 3.048 -12.443 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.953 1.282 -12.226 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -15.969 2.320 -11.198 1.00 0.00 H new ATOM 1438 N TYR A 98 -11.936 0.920 -8.387 1.00 0.00 N ATOM 1439 CA TYR A 98 -11.031 1.096 -7.264 1.00 0.00 C ATOM 1440 C TYR A 98 -9.659 1.581 -7.735 1.00 0.00 C ATOM 1441 O TYR A 98 -9.085 1.020 -8.667 1.00 0.00 O ATOM 1442 CB TYR A 98 -10.879 -0.286 -6.625 1.00 0.00 C ATOM 1443 CG TYR A 98 -11.954 -0.613 -5.587 1.00 0.00 C ATOM 1444 CD1 TYR A 98 -13.133 -1.215 -5.980 1.00 0.00 C ATOM 1445 CD2 TYR A 98 -11.746 -0.307 -4.257 1.00 0.00 C ATOM 1446 CE1 TYR A 98 -14.145 -1.523 -5.004 1.00 0.00 C ATOM 1447 CE2 TYR A 98 -12.759 -0.616 -3.281 1.00 0.00 C ATOM 1448 CZ TYR A 98 -13.908 -1.209 -3.702 1.00 0.00 C ATOM 1449 OH TYR A 98 -14.864 -1.500 -2.780 1.00 0.00 O ATOM 0 H TYR A 98 -11.582 0.318 -9.130 1.00 0.00 H new ATOM 0 HA TYR A 98 -11.423 1.838 -6.568 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -10.904 -1.042 -7.409 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -9.899 -0.350 -6.151 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -13.296 -1.455 -7.020 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.824 0.164 -3.949 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -15.072 -1.993 -5.299 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.609 -0.382 -2.237 1.00 0.00 H new ATOM 0 HH TYR A 98 -14.558 -1.221 -1.892 1.00 0.00 H new ATOM 1459 N LEU A 99 -9.172 2.618 -7.070 1.00 0.00 N ATOM 1460 CA LEU A 99 -7.878 3.185 -7.409 1.00 0.00 C ATOM 1461 C LEU A 99 -6.805 2.570 -6.508 1.00 0.00 C ATOM 1462 O LEU A 99 -6.842 2.738 -5.290 1.00 0.00 O ATOM 1463 CB LEU A 99 -7.930 4.713 -7.350 1.00 0.00 C ATOM 1464 CG LEU A 99 -6.585 5.434 -7.458 1.00 0.00 C ATOM 1465 CD1 LEU A 99 -5.873 5.473 -6.105 1.00 0.00 C ATOM 1466 CD2 LEU A 99 -5.712 4.806 -8.547 1.00 0.00 C ATOM 0 H LEU A 99 -9.651 3.081 -6.297 1.00 0.00 H new ATOM 0 HA LEU A 99 -7.611 2.938 -8.437 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -8.575 5.066 -8.155 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.402 5.005 -6.412 1.00 0.00 H new ATOM 0 HG LEU A 99 -6.774 6.466 -7.752 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.920 5.991 -6.210 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -6.495 6.001 -5.382 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.696 4.455 -5.757 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.762 5.337 -8.603 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.529 3.759 -8.307 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -6.223 4.874 -9.507 1.00 0.00 H new ATOM 1478 N PHE A 100 -5.875 1.872 -7.142 1.00 0.00 N ATOM 1479 CA PHE A 100 -4.793 1.231 -6.412 1.00 0.00 C ATOM 1480 C PHE A 100 -3.511 2.062 -6.493 1.00 0.00 C ATOM 1481 O PHE A 100 -2.921 2.197 -7.564 1.00 0.00 O ATOM 1482 CB PHE A 100 -4.550 -0.127 -7.074 1.00 0.00 C ATOM 1483 CG PHE A 100 -5.451 -1.245 -6.549 1.00 0.00 C ATOM 1484 CD1 PHE A 100 -6.769 -1.272 -6.885 1.00 0.00 C ATOM 1485 CD2 PHE A 100 -4.935 -2.213 -5.745 1.00 0.00 C ATOM 1486 CE1 PHE A 100 -7.605 -2.311 -6.398 1.00 0.00 C ATOM 1487 CE2 PHE A 100 -5.772 -3.252 -5.257 1.00 0.00 C ATOM 1488 CZ PHE A 100 -7.089 -3.279 -5.594 1.00 0.00 C ATOM 0 H PHE A 100 -5.848 1.736 -8.152 1.00 0.00 H new ATOM 0 HA PHE A 100 -5.062 1.128 -5.361 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.700 -0.028 -8.149 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -3.509 -0.412 -6.923 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -7.179 -0.503 -7.522 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -3.889 -2.192 -5.478 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -8.651 -2.333 -6.666 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.362 -4.020 -4.618 1.00 0.00 H new ATOM 0 HZ PHE A 100 -7.725 -4.069 -5.223 1.00 0.00 H new ATOM 1498 N ARG A 101 -3.117 2.596 -5.346 1.00 0.00 N ATOM 1499 CA ARG A 101 -1.915 3.409 -5.273 1.00 0.00 C ATOM 1500 C ARG A 101 -0.764 2.603 -4.667 1.00 0.00 C ATOM 1501 O ARG A 101 -0.799 2.254 -3.488 1.00 0.00 O ATOM 1502 CB ARG A 101 -2.149 4.664 -4.430 1.00 0.00 C ATOM 1503 CG ARG A 101 -1.372 5.856 -4.993 1.00 0.00 C ATOM 1504 CD ARG A 101 -2.160 7.156 -4.816 1.00 0.00 C ATOM 1505 NE ARG A 101 -2.614 7.286 -3.414 1.00 0.00 N ATOM 1506 CZ ARG A 101 -3.049 8.431 -2.869 1.00 0.00 C ATOM 1507 NH1 ARG A 101 -3.090 9.550 -3.604 1.00 0.00 N ATOM 1508 NH2 ARG A 101 -3.442 8.455 -1.588 1.00 0.00 N ATOM 0 H ARG A 101 -3.609 2.481 -4.460 1.00 0.00 H new ATOM 0 HA ARG A 101 -1.657 3.710 -6.288 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -3.213 4.897 -4.407 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.841 4.478 -3.401 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.409 5.938 -4.489 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.165 5.693 -6.051 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.536 8.008 -5.085 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -3.019 7.165 -5.487 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.595 6.453 -2.826 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -2.790 9.531 -4.579 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -3.421 10.421 -3.189 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.410 7.603 -1.029 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -3.773 9.326 -1.172 1.00 0.00 H new ATOM 1522 N ILE A 102 0.229 2.331 -5.501 1.00 0.00 N ATOM 1523 CA ILE A 102 1.388 1.572 -5.062 1.00 0.00 C ATOM 1524 C ILE A 102 2.520 2.539 -4.708 1.00 0.00 C ATOM 1525 O ILE A 102 2.757 3.512 -5.422 1.00 0.00 O ATOM 1526 CB ILE A 102 1.776 0.530 -6.113 1.00 0.00 C ATOM 1527 CG1 ILE A 102 0.703 -0.554 -6.232 1.00 0.00 C ATOM 1528 CG2 ILE A 102 3.156 -0.060 -5.817 1.00 0.00 C ATOM 1529 CD1 ILE A 102 0.633 -1.103 -7.658 1.00 0.00 C ATOM 0 H ILE A 102 0.255 2.623 -6.478 1.00 0.00 H new ATOM 0 HA ILE A 102 1.155 1.008 -4.159 1.00 0.00 H new ATOM 0 HB ILE A 102 1.840 1.028 -7.080 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.922 -1.365 -5.537 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -0.266 -0.144 -5.949 1.00 0.00 H new ATOM 0 HG21 ILE A 102 3.407 -0.798 -6.579 1.00 0.00 H new ATOM 0 HG22 ILE A 102 3.901 0.736 -5.823 1.00 0.00 H new ATOM 0 HG23 ILE A 102 3.145 -0.539 -4.838 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -0.138 -1.872 -7.714 1.00 0.00 H new ATOM 0 HD12 ILE A 102 0.390 -0.295 -8.348 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.596 -1.534 -7.929 1.00 0.00 H new ATOM 1541 N THR A 103 3.189 2.237 -3.605 1.00 0.00 N ATOM 1542 CA THR A 103 4.291 3.066 -3.147 1.00 0.00 C ATOM 1543 C THR A 103 5.350 2.210 -2.451 1.00 0.00 C ATOM 1544 O THR A 103 5.064 1.095 -2.015 1.00 0.00 O ATOM 1545 CB THR A 103 3.715 4.166 -2.253 1.00 0.00 C ATOM 1546 OG1 THR A 103 2.556 4.611 -2.953 1.00 0.00 O ATOM 1547 CG2 THR A 103 4.612 5.403 -2.194 1.00 0.00 C ATOM 0 H THR A 103 2.989 1.429 -3.015 1.00 0.00 H new ATOM 0 HA THR A 103 4.802 3.541 -3.984 1.00 0.00 H new ATOM 0 HB THR A 103 3.569 3.775 -1.246 1.00 0.00 H new ATOM 0 HG1 THR A 103 2.119 5.324 -2.442 1.00 0.00 H new ATOM 0 HG21 THR A 103 4.157 6.152 -1.546 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.589 5.126 -1.797 1.00 0.00 H new ATOM 0 HG23 THR A 103 4.731 5.814 -3.196 1.00 0.00 H new ATOM 1555 N ALA A 104 6.551 2.763 -2.367 1.00 0.00 N ATOM 1556 CA ALA A 104 7.655 2.063 -1.731 1.00 0.00 C ATOM 1557 C ALA A 104 8.042 2.795 -0.444 1.00 0.00 C ATOM 1558 O ALA A 104 7.714 3.967 -0.270 1.00 0.00 O ATOM 1559 CB ALA A 104 8.823 1.952 -2.713 1.00 0.00 C ATOM 0 H ALA A 104 6.784 3.688 -2.729 1.00 0.00 H new ATOM 0 HA ALA A 104 7.362 1.049 -1.459 1.00 0.00 H new ATOM 0 HB1 ALA A 104 9.651 1.427 -2.236 1.00 0.00 H new ATOM 0 HB2 ALA A 104 8.504 1.399 -3.597 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.147 2.950 -3.007 1.00 0.00 H new ATOM 1565 N GLN A 105 8.735 2.072 0.423 1.00 0.00 N ATOM 1566 CA GLN A 105 9.171 2.637 1.689 1.00 0.00 C ATOM 1567 C GLN A 105 10.687 2.499 1.838 1.00 0.00 C ATOM 1568 O GLN A 105 11.216 1.388 1.838 1.00 0.00 O ATOM 1569 CB GLN A 105 8.443 1.980 2.863 1.00 0.00 C ATOM 1570 CG GLN A 105 8.952 2.525 4.199 1.00 0.00 C ATOM 1571 CD GLN A 105 8.523 1.623 5.358 1.00 0.00 C ATOM 1572 OE1 GLN A 105 8.612 0.408 5.299 1.00 0.00 O ATOM 1573 NE2 GLN A 105 8.055 2.284 6.412 1.00 0.00 N ATOM 0 H GLN A 105 9.006 1.100 0.274 1.00 0.00 H new ATOM 0 HA GLN A 105 8.920 3.698 1.696 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.371 2.160 2.777 1.00 0.00 H new ATOM 0 HB3 GLN A 105 8.589 0.900 2.827 1.00 0.00 H new ATOM 0 HG2 GLN A 105 10.039 2.600 4.175 1.00 0.00 H new ATOM 0 HG3 GLN A 105 8.566 3.532 4.356 1.00 0.00 H new ATOM 0 HE21 GLN A 105 8.008 3.303 6.395 1.00 0.00 H new ATOM 0 HE22 GLN A 105 7.743 1.772 7.238 1.00 0.00 H new ATOM 1582 N THR A 106 11.345 3.643 1.961 1.00 0.00 N ATOM 1583 CA THR A 106 12.790 3.663 2.111 1.00 0.00 C ATOM 1584 C THR A 106 13.183 4.396 3.395 1.00 0.00 C ATOM 1585 O THR A 106 12.332 4.681 4.237 1.00 0.00 O ATOM 1586 CB THR A 106 13.387 4.288 0.848 1.00 0.00 C ATOM 1587 OG1 THR A 106 12.506 5.366 0.544 1.00 0.00 O ATOM 1588 CG2 THR A 106 13.280 3.365 -0.368 1.00 0.00 C ATOM 0 H THR A 106 10.904 4.563 1.960 1.00 0.00 H new ATOM 0 HA THR A 106 13.191 2.655 2.214 1.00 0.00 H new ATOM 0 HB THR A 106 14.434 4.536 1.025 1.00 0.00 H new ATOM 0 HG1 THR A 106 13.004 6.210 0.559 1.00 0.00 H new ATOM 0 HG21 THR A 106 13.718 3.856 -1.237 1.00 0.00 H new ATOM 0 HG22 THR A 106 13.815 2.436 -0.168 1.00 0.00 H new ATOM 0 HG23 THR A 106 12.231 3.144 -0.566 1.00 0.00 H new ATOM 1596 N ARG A 107 14.472 4.681 3.505 1.00 0.00 N ATOM 1597 CA ARG A 107 14.988 5.376 4.672 1.00 0.00 C ATOM 1598 C ARG A 107 14.570 6.847 4.642 1.00 0.00 C ATOM 1599 O ARG A 107 14.610 7.529 5.666 1.00 0.00 O ATOM 1600 CB ARG A 107 16.514 5.288 4.735 1.00 0.00 C ATOM 1601 CG ARG A 107 17.157 6.066 3.585 1.00 0.00 C ATOM 1602 CD ARG A 107 18.675 5.877 3.576 1.00 0.00 C ATOM 1603 NE ARG A 107 19.327 6.983 4.312 1.00 0.00 N ATOM 1604 CZ ARG A 107 20.654 7.139 4.414 1.00 0.00 C ATOM 1605 NH1 ARG A 107 21.478 6.261 3.827 1.00 0.00 N ATOM 1606 NH2 ARG A 107 21.156 8.173 5.102 1.00 0.00 N ATOM 0 H ARG A 107 15.175 4.443 2.805 1.00 0.00 H new ATOM 0 HA ARG A 107 14.571 4.894 5.556 1.00 0.00 H new ATOM 0 HB2 ARG A 107 16.865 5.684 5.688 1.00 0.00 H new ATOM 0 HB3 ARG A 107 16.824 4.244 4.690 1.00 0.00 H new ATOM 0 HG2 ARG A 107 16.740 5.730 2.636 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.919 7.126 3.680 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.934 4.922 4.034 1.00 0.00 H new ATOM 0 HD3 ARG A 107 19.040 5.847 2.549 1.00 0.00 H new ATOM 0 HE ARG A 107 18.729 7.670 4.771 1.00 0.00 H new ATOM 0 HH11 ARG A 107 21.095 5.474 3.303 1.00 0.00 H new ATOM 0 HH12 ARG A 107 22.488 6.379 3.904 1.00 0.00 H new ATOM 0 HH21 ARG A 107 20.528 8.842 5.548 1.00 0.00 H new ATOM 0 HH22 ARG A 107 22.166 8.292 5.180 1.00 0.00 H new ATOM 1620 N LYS A 108 14.178 7.294 3.458 1.00 0.00 N ATOM 1621 CA LYS A 108 13.753 8.673 3.282 1.00 0.00 C ATOM 1622 C LYS A 108 12.262 8.787 3.605 1.00 0.00 C ATOM 1623 O LYS A 108 11.836 9.742 4.254 1.00 0.00 O ATOM 1624 CB LYS A 108 14.119 9.171 1.882 1.00 0.00 C ATOM 1625 CG LYS A 108 15.566 8.818 1.535 1.00 0.00 C ATOM 1626 CD LYS A 108 16.530 9.341 2.603 1.00 0.00 C ATOM 1627 CE LYS A 108 16.580 10.870 2.594 1.00 0.00 C ATOM 1628 NZ LYS A 108 17.504 11.352 1.543 1.00 0.00 N ATOM 0 H LYS A 108 14.146 6.726 2.611 1.00 0.00 H new ATOM 0 HA LYS A 108 14.281 9.327 3.976 1.00 0.00 H new ATOM 0 HB2 LYS A 108 13.447 8.728 1.147 1.00 0.00 H new ATOM 0 HB3 LYS A 108 13.982 10.251 1.829 1.00 0.00 H new ATOM 0 HG2 LYS A 108 15.669 7.737 1.446 1.00 0.00 H new ATOM 0 HG3 LYS A 108 15.826 9.244 0.566 1.00 0.00 H new ATOM 0 HD2 LYS A 108 16.215 8.990 3.586 1.00 0.00 H new ATOM 0 HD3 LYS A 108 17.528 8.940 2.425 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.582 11.271 2.421 1.00 0.00 H new ATOM 0 HE3 LYS A 108 16.906 11.235 3.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 17.376 12.376 1.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 18.485 11.159 1.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 17.300 10.860 0.650 1.00 0.00 H new ATOM 1642 N GLY A 109 11.510 7.801 3.139 1.00 0.00 N ATOM 1643 CA GLY A 109 10.076 7.779 3.370 1.00 0.00 C ATOM 1644 C GLY A 109 9.343 7.110 2.206 1.00 0.00 C ATOM 1645 O GLY A 109 9.824 6.125 1.649 1.00 0.00 O ATOM 0 H GLY A 109 11.867 7.011 2.602 1.00 0.00 H new ATOM 0 HA2 GLY A 109 9.861 7.244 4.295 1.00 0.00 H new ATOM 0 HA3 GLY A 109 9.709 8.797 3.498 1.00 0.00 H new ATOM 1649 N TRP A 110 8.190 7.673 1.873 1.00 0.00 N ATOM 1650 CA TRP A 110 7.386 7.143 0.785 1.00 0.00 C ATOM 1651 C TRP A 110 7.528 8.086 -0.411 1.00 0.00 C ATOM 1652 O TRP A 110 7.048 9.218 -0.374 1.00 0.00 O ATOM 1653 CB TRP A 110 5.933 6.947 1.223 1.00 0.00 C ATOM 1654 CG TRP A 110 5.753 5.916 2.339 1.00 0.00 C ATOM 1655 CD1 TRP A 110 5.772 6.123 3.663 1.00 0.00 C ATOM 1656 CD2 TRP A 110 5.524 4.501 2.174 1.00 0.00 C ATOM 1657 NE1 TRP A 110 5.573 4.949 4.361 1.00 0.00 N ATOM 1658 CE2 TRP A 110 5.418 3.931 3.427 1.00 0.00 C ATOM 1659 CE3 TRP A 110 5.411 3.728 1.005 1.00 0.00 C ATOM 1660 CZ2 TRP A 110 5.193 2.564 3.630 1.00 0.00 C ATOM 1661 CZ3 TRP A 110 5.187 2.363 1.226 1.00 0.00 C ATOM 1662 CH2 TRP A 110 5.077 1.774 2.480 1.00 0.00 C ATOM 0 H TRP A 110 7.794 8.490 2.337 1.00 0.00 H new ATOM 0 HA TRP A 110 7.738 6.154 0.491 1.00 0.00 H new ATOM 0 HB2 TRP A 110 5.533 7.904 1.559 1.00 0.00 H new ATOM 0 HB3 TRP A 110 5.342 6.640 0.360 1.00 0.00 H new ATOM 0 HD1 TRP A 110 5.924 7.087 4.126 1.00 0.00 H new ATOM 0 HE1 TRP A 110 5.545 4.847 5.376 1.00 0.00 H new ATOM 0 HE3 TRP A 110 5.491 4.153 0.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 5.113 2.142 4.621 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 5.093 1.723 0.361 1.00 0.00 H new ATOM 0 HH2 TRP A 110 4.903 0.712 2.567 1.00 0.00 H new ATOM 1673 N GLY A 111 8.189 7.585 -1.444 1.00 0.00 N ATOM 1674 CA GLY A 111 8.400 8.369 -2.649 1.00 0.00 C ATOM 1675 C GLY A 111 7.148 8.371 -3.528 1.00 0.00 C ATOM 1676 O GLY A 111 6.032 8.253 -3.025 1.00 0.00 O ATOM 0 H GLY A 111 8.586 6.646 -1.471 1.00 0.00 H new ATOM 0 HA2 GLY A 111 8.662 9.392 -2.380 1.00 0.00 H new ATOM 0 HA3 GLY A 111 9.242 7.962 -3.209 1.00 0.00 H new ATOM 1680 N GLU A 112 7.376 8.507 -4.827 1.00 0.00 N ATOM 1681 CA GLU A 112 6.280 8.526 -5.781 1.00 0.00 C ATOM 1682 C GLU A 112 5.369 7.315 -5.567 1.00 0.00 C ATOM 1683 O GLU A 112 5.757 6.350 -4.910 1.00 0.00 O ATOM 1684 CB GLU A 112 6.804 8.570 -7.217 1.00 0.00 C ATOM 1685 CG GLU A 112 6.277 9.803 -7.955 1.00 0.00 C ATOM 1686 CD GLU A 112 7.367 10.425 -8.831 1.00 0.00 C ATOM 1687 OE1 GLU A 112 8.535 10.401 -8.386 1.00 0.00 O ATOM 1688 OE2 GLU A 112 7.007 10.910 -9.925 1.00 0.00 O ATOM 0 H GLU A 112 8.303 8.605 -5.240 1.00 0.00 H new ATOM 0 HA GLU A 112 5.695 9.431 -5.615 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.894 8.584 -7.210 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.500 7.667 -7.747 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.424 9.524 -8.573 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.921 10.539 -7.234 1.00 0.00 H new ATOM 1695 N ALA A 113 4.175 7.405 -6.134 1.00 0.00 N ATOM 1696 CA ALA A 113 3.206 6.330 -6.014 1.00 0.00 C ATOM 1697 C ALA A 113 2.526 6.108 -7.366 1.00 0.00 C ATOM 1698 O ALA A 113 2.193 7.067 -8.062 1.00 0.00 O ATOM 1699 CB ALA A 113 2.206 6.665 -4.906 1.00 0.00 C ATOM 0 H ALA A 113 3.857 8.207 -6.678 1.00 0.00 H new ATOM 0 HA ALA A 113 3.699 5.398 -5.737 1.00 0.00 H new ATOM 0 HB1 ALA A 113 1.479 5.858 -4.816 1.00 0.00 H new ATOM 0 HB2 ALA A 113 2.736 6.783 -3.961 1.00 0.00 H new ATOM 0 HB3 ALA A 113 1.690 7.593 -5.150 1.00 0.00 H new ATOM 1705 N ALA A 114 2.339 4.839 -7.698 1.00 0.00 N ATOM 1706 CA ALA A 114 1.704 4.480 -8.954 1.00 0.00 C ATOM 1707 C ALA A 114 0.208 4.259 -8.720 1.00 0.00 C ATOM 1708 O ALA A 114 -0.180 3.412 -7.918 1.00 0.00 O ATOM 1709 CB ALA A 114 2.391 3.245 -9.539 1.00 0.00 C ATOM 0 H ALA A 114 2.616 4.047 -7.119 1.00 0.00 H new ATOM 0 HA ALA A 114 1.808 5.286 -9.680 1.00 0.00 H new ATOM 0 HB1 ALA A 114 1.914 2.976 -10.482 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.444 3.463 -9.714 1.00 0.00 H new ATOM 0 HB3 ALA A 114 2.305 2.414 -8.838 1.00 0.00 H new ATOM 1715 N GLU A 115 -0.591 5.037 -9.436 1.00 0.00 N ATOM 1716 CA GLU A 115 -2.036 4.936 -9.316 1.00 0.00 C ATOM 1717 C GLU A 115 -2.608 4.105 -10.467 1.00 0.00 C ATOM 1718 O GLU A 115 -2.362 4.404 -11.635 1.00 0.00 O ATOM 1719 CB GLU A 115 -2.680 6.324 -9.269 1.00 0.00 C ATOM 1720 CG GLU A 115 -2.948 6.755 -7.826 1.00 0.00 C ATOM 1721 CD GLU A 115 -4.035 7.830 -7.768 1.00 0.00 C ATOM 1722 OE1 GLU A 115 -4.909 7.803 -8.661 1.00 0.00 O ATOM 1723 OE2 GLU A 115 -3.967 8.656 -6.832 1.00 0.00 O ATOM 0 H GLU A 115 -0.266 5.739 -10.100 1.00 0.00 H new ATOM 0 HA GLU A 115 -2.269 4.431 -8.379 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.026 7.049 -9.753 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.615 6.314 -9.829 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -3.254 5.891 -7.236 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.030 7.137 -7.380 1.00 0.00 H new ATOM 1730 N ALA A 116 -3.359 3.079 -10.097 1.00 0.00 N ATOM 1731 CA ALA A 116 -3.968 2.203 -11.083 1.00 0.00 C ATOM 1732 C ALA A 116 -5.406 1.891 -10.664 1.00 0.00 C ATOM 1733 O ALA A 116 -5.642 1.394 -9.564 1.00 0.00 O ATOM 1734 CB ALA A 116 -3.119 0.939 -11.237 1.00 0.00 C ATOM 0 H ALA A 116 -3.560 2.834 -9.127 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.007 2.691 -12.057 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.576 0.282 -11.977 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -2.116 1.212 -11.565 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.060 0.422 -10.279 1.00 0.00 H new ATOM 1740 N LEU A 117 -6.330 2.197 -11.563 1.00 0.00 N ATOM 1741 CA LEU A 117 -7.738 1.956 -11.300 1.00 0.00 C ATOM 1742 C LEU A 117 -8.111 0.553 -11.786 1.00 0.00 C ATOM 1743 O LEU A 117 -7.545 0.060 -12.760 1.00 0.00 O ATOM 1744 CB LEU A 117 -8.595 3.066 -11.912 1.00 0.00 C ATOM 1745 CG LEU A 117 -8.605 4.397 -11.159 1.00 0.00 C ATOM 1746 CD1 LEU A 117 -8.455 5.575 -12.124 1.00 0.00 C ATOM 1747 CD2 LEU A 117 -9.857 4.526 -10.289 1.00 0.00 C ATOM 0 H LEU A 117 -6.131 2.610 -12.474 1.00 0.00 H new ATOM 0 HA LEU A 117 -7.936 1.986 -10.228 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -8.246 3.249 -12.928 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.621 2.706 -11.987 1.00 0.00 H new ATOM 0 HG LEU A 117 -7.744 4.417 -10.490 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -8.465 6.509 -11.562 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -7.512 5.486 -12.663 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -9.281 5.570 -12.835 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -9.839 5.481 -9.765 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -10.745 4.475 -10.919 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -9.880 3.714 -9.562 1.00 0.00 H new ATOM 1759 N VAL A 118 -9.060 -0.049 -11.085 1.00 0.00 N ATOM 1760 CA VAL A 118 -9.514 -1.385 -11.432 1.00 0.00 C ATOM 1761 C VAL A 118 -10.985 -1.536 -11.041 1.00 0.00 C ATOM 1762 O VAL A 118 -11.362 -1.250 -9.906 1.00 0.00 O ATOM 1763 CB VAL A 118 -8.610 -2.431 -10.777 1.00 0.00 C ATOM 1764 CG1 VAL A 118 -8.536 -2.222 -9.263 1.00 0.00 C ATOM 1765 CG2 VAL A 118 -9.081 -3.848 -11.112 1.00 0.00 C ATOM 0 H VAL A 118 -9.527 0.364 -10.278 1.00 0.00 H new ATOM 0 HA VAL A 118 -9.446 -1.545 -12.508 1.00 0.00 H new ATOM 0 HB VAL A 118 -7.606 -2.306 -11.181 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -7.887 -2.979 -8.823 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.133 -1.231 -9.052 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -9.535 -2.307 -8.835 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -8.422 -4.573 -10.635 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -10.099 -3.989 -10.748 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -9.058 -3.993 -12.192 1.00 0.00 H new ATOM 1775 N VAL A 119 -11.777 -1.986 -12.004 1.00 0.00 N ATOM 1776 CA VAL A 119 -13.199 -2.179 -11.774 1.00 0.00 C ATOM 1777 C VAL A 119 -13.431 -3.571 -11.184 1.00 0.00 C ATOM 1778 O VAL A 119 -12.645 -4.487 -11.417 1.00 0.00 O ATOM 1779 CB VAL A 119 -13.975 -1.942 -13.071 1.00 0.00 C ATOM 1780 CG1 VAL A 119 -15.297 -2.711 -13.067 1.00 0.00 C ATOM 1781 CG2 VAL A 119 -14.210 -0.448 -13.304 1.00 0.00 C ATOM 0 H VAL A 119 -11.461 -2.222 -12.945 1.00 0.00 H new ATOM 0 HA VAL A 119 -13.572 -1.453 -11.051 1.00 0.00 H new ATOM 0 HB VAL A 119 -13.371 -2.319 -13.896 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -15.829 -2.525 -14.000 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -15.097 -3.778 -12.970 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -15.909 -2.379 -12.228 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -14.764 -0.307 -14.232 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -14.783 -0.036 -12.474 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -13.251 0.065 -13.372 1.00 0.00 H new ATOM 1791 N THR A 120 -14.515 -3.686 -10.430 1.00 0.00 N ATOM 1792 CA THR A 120 -14.861 -4.951 -9.805 1.00 0.00 C ATOM 1793 C THR A 120 -16.035 -5.604 -10.537 1.00 0.00 C ATOM 1794 O THR A 120 -17.152 -5.090 -10.509 1.00 0.00 O ATOM 1795 CB THR A 120 -15.140 -4.685 -8.324 1.00 0.00 C ATOM 1796 OG1 THR A 120 -15.808 -3.426 -8.317 1.00 0.00 O ATOM 1797 CG2 THR A 120 -13.861 -4.433 -7.523 1.00 0.00 C ATOM 0 H THR A 120 -15.165 -2.924 -10.238 1.00 0.00 H new ATOM 0 HA THR A 120 -14.040 -5.664 -9.873 1.00 0.00 H new ATOM 0 HB THR A 120 -15.674 -5.534 -7.897 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.310 -3.327 -7.481 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.116 -4.250 -6.479 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.212 -5.306 -7.590 1.00 0.00 H new ATOM 0 HG23 THR A 120 -13.343 -3.563 -7.928 1.00 0.00 H new ATOM 1805 N THR A 121 -15.742 -6.727 -11.175 1.00 0.00 N ATOM 1806 CA THR A 121 -16.759 -7.456 -11.913 1.00 0.00 C ATOM 1807 C THR A 121 -16.179 -8.753 -12.481 1.00 0.00 C ATOM 1808 O THR A 121 -14.966 -8.957 -12.460 1.00 0.00 O ATOM 1809 CB THR A 121 -17.325 -6.523 -12.985 1.00 0.00 C ATOM 1810 OG1 THR A 121 -18.193 -7.357 -13.748 1.00 0.00 O ATOM 1811 CG2 THR A 121 -16.262 -6.073 -13.990 1.00 0.00 C ATOM 0 H THR A 121 -14.814 -7.150 -11.196 1.00 0.00 H new ATOM 0 HA THR A 121 -17.578 -7.761 -11.262 1.00 0.00 H new ATOM 0 HB THR A 121 -17.767 -5.648 -12.508 1.00 0.00 H new ATOM 0 HG1 THR A 121 -18.605 -6.831 -14.465 1.00 0.00 H new ATOM 0 HG21 THR A 121 -16.716 -5.413 -14.729 1.00 0.00 H new ATOM 0 HG22 THR A 121 -15.469 -5.540 -13.466 1.00 0.00 H new ATOM 0 HG23 THR A 121 -15.843 -6.945 -14.492 1.00 0.00 H new ATOM 1819 N GLU A 122 -17.073 -9.597 -12.975 1.00 0.00 N ATOM 1820 CA GLU A 122 -16.665 -10.869 -13.548 1.00 0.00 C ATOM 1821 C GLU A 122 -16.431 -10.722 -15.052 1.00 0.00 C ATOM 1822 O GLU A 122 -15.627 -11.451 -15.633 1.00 0.00 O ATOM 1823 CB GLU A 122 -17.700 -11.958 -13.258 1.00 0.00 C ATOM 1824 CG GLU A 122 -17.891 -12.145 -11.751 1.00 0.00 C ATOM 1825 CD GLU A 122 -19.207 -12.866 -11.451 1.00 0.00 C ATOM 1826 OE1 GLU A 122 -20.248 -12.173 -11.459 1.00 0.00 O ATOM 1827 OE2 GLU A 122 -19.143 -14.092 -11.220 1.00 0.00 O ATOM 0 H GLU A 122 -18.078 -9.425 -12.990 1.00 0.00 H new ATOM 0 HA GLU A 122 -15.727 -11.172 -13.082 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -18.652 -11.692 -13.719 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -17.380 -12.898 -13.707 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -17.058 -12.717 -11.343 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -17.883 -11.174 -11.256 1.00 0.00 H new ATOM 1834 N LYS A 123 -17.146 -9.776 -15.641 1.00 0.00 N ATOM 1835 CA LYS A 123 -17.026 -9.525 -17.067 1.00 0.00 C ATOM 1836 C LYS A 123 -15.729 -8.759 -17.339 1.00 0.00 C ATOM 1837 O LYS A 123 -15.306 -7.940 -16.525 1.00 0.00 O ATOM 1838 CB LYS A 123 -18.278 -8.820 -17.595 1.00 0.00 C ATOM 1839 CG LYS A 123 -19.494 -9.747 -17.539 1.00 0.00 C ATOM 1840 CD LYS A 123 -20.613 -9.134 -16.695 1.00 0.00 C ATOM 1841 CE LYS A 123 -21.178 -10.156 -15.708 1.00 0.00 C ATOM 1842 NZ LYS A 123 -22.250 -9.548 -14.889 1.00 0.00 N ATOM 0 H LYS A 123 -17.811 -9.173 -15.157 1.00 0.00 H new ATOM 0 HA LYS A 123 -16.963 -10.465 -17.614 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -18.472 -7.924 -17.005 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -18.111 -8.495 -18.622 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -19.858 -9.937 -18.549 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -19.203 -10.710 -17.119 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -20.231 -8.270 -16.151 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -21.409 -8.774 -17.347 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -21.570 -11.016 -16.251 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -20.382 -10.524 -15.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -22.623 -10.256 -14.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -21.865 -8.742 -14.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -23.017 -9.219 -15.510 1.00 0.00 H new ATOM 1856 N ARG A 124 -15.135 -9.054 -18.485 1.00 0.00 N ATOM 1857 CA ARG A 124 -13.894 -8.404 -18.874 1.00 0.00 C ATOM 1858 C ARG A 124 -14.164 -6.962 -19.307 1.00 0.00 C ATOM 1859 O ARG A 124 -14.917 -6.724 -20.251 1.00 0.00 O ATOM 1860 CB ARG A 124 -13.215 -9.156 -20.020 1.00 0.00 C ATOM 1861 CG ARG A 124 -12.634 -10.486 -19.536 1.00 0.00 C ATOM 1862 CD ARG A 124 -11.255 -10.738 -20.150 1.00 0.00 C ATOM 1863 NE ARG A 124 -11.343 -11.807 -21.169 1.00 0.00 N ATOM 1864 CZ ARG A 124 -11.779 -11.616 -22.422 1.00 0.00 C ATOM 1865 NH1 ARG A 124 -12.169 -10.397 -22.817 1.00 0.00 N ATOM 1866 NH2 ARG A 124 -11.824 -12.645 -23.280 1.00 0.00 N ATOM 0 H ARG A 124 -15.489 -9.734 -19.157 1.00 0.00 H new ATOM 0 HA ARG A 124 -13.231 -8.409 -18.009 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -13.936 -9.339 -20.817 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -12.421 -8.541 -20.443 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -12.556 -10.479 -18.449 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -13.309 -11.300 -19.802 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -10.877 -9.822 -20.604 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -10.548 -11.024 -19.371 1.00 0.00 H new ATOM 0 HE ARG A 124 -11.054 -12.748 -20.901 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -12.134 -9.614 -22.164 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -12.501 -10.252 -23.771 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -11.526 -13.573 -22.979 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -12.156 -12.500 -24.234 1.00 0.00 H new ATOM 1880 N SER A 125 -13.535 -6.037 -18.597 1.00 0.00 N ATOM 1881 CA SER A 125 -13.698 -4.624 -18.897 1.00 0.00 C ATOM 1882 C SER A 125 -12.331 -3.938 -18.939 1.00 0.00 C ATOM 1883 O SER A 125 -11.716 -3.709 -17.899 1.00 0.00 O ATOM 1884 CB SER A 125 -14.603 -3.944 -17.868 1.00 0.00 C ATOM 1885 OG SER A 125 -15.502 -3.021 -18.476 1.00 0.00 O ATOM 0 H SER A 125 -12.912 -6.238 -17.815 1.00 0.00 H new ATOM 0 HA SER A 125 -14.173 -4.533 -19.874 1.00 0.00 H new ATOM 0 HB2 SER A 125 -15.171 -4.701 -17.328 1.00 0.00 H new ATOM 0 HB3 SER A 125 -13.989 -3.422 -17.134 1.00 0.00 H new ATOM 0 HG SER A 125 -16.064 -2.609 -17.787 1.00 0.00 H new ATOM 1891 N GLY A 126 -11.897 -3.628 -20.152 1.00 0.00 N ATOM 1892 CA GLY A 126 -10.615 -2.972 -20.343 1.00 0.00 C ATOM 1893 C GLY A 126 -10.462 -2.474 -21.781 1.00 0.00 C ATOM 1894 O GLY A 126 -10.179 -3.257 -22.686 1.00 0.00 O ATOM 0 H GLY A 126 -12.411 -3.819 -21.012 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -10.525 -2.133 -19.653 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -9.809 -3.666 -20.107 1.00 0.00 H new ATOM 1898 N PRO A 127 -10.663 -1.140 -21.952 1.00 0.00 N ATOM 1899 CA PRO A 127 -10.550 -0.528 -23.266 1.00 0.00 C ATOM 1900 C PRO A 127 -9.085 -0.397 -23.686 1.00 0.00 C ATOM 1901 O PRO A 127 -8.182 -0.650 -22.890 1.00 0.00 O ATOM 1902 CB PRO A 127 -11.254 0.813 -23.137 1.00 0.00 C ATOM 1903 CG PRO A 127 -11.325 1.104 -21.646 1.00 0.00 C ATOM 1904 CD PRO A 127 -11.000 -0.181 -20.904 1.00 0.00 C ATOM 0 HA PRO A 127 -11.008 -1.129 -24.051 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -10.705 1.595 -23.662 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -12.251 0.775 -23.576 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -10.619 1.889 -21.376 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -12.318 1.461 -21.374 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -10.168 -0.040 -20.214 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -11.850 -0.523 -20.313 1.00 0.00 H new ATOM 1912 N SER A 128 -8.894 -0.002 -24.936 1.00 0.00 N ATOM 1913 CA SER A 128 -7.554 0.165 -25.472 1.00 0.00 C ATOM 1914 C SER A 128 -7.153 1.641 -25.427 1.00 0.00 C ATOM 1915 O SER A 128 -7.994 2.522 -25.603 1.00 0.00 O ATOM 1916 CB SER A 128 -7.463 -0.366 -26.904 1.00 0.00 C ATOM 1917 OG SER A 128 -7.322 -1.783 -26.939 1.00 0.00 O ATOM 0 H SER A 128 -9.645 0.207 -25.593 1.00 0.00 H new ATOM 0 HA SER A 128 -6.865 -0.412 -24.855 1.00 0.00 H new ATOM 0 HB2 SER A 128 -8.358 -0.077 -27.456 1.00 0.00 H new ATOM 0 HB3 SER A 128 -6.614 0.096 -27.409 1.00 0.00 H new ATOM 0 HG SER A 128 -7.269 -2.084 -27.870 1.00 0.00 H new ATOM 1923 N SER A 129 -5.870 1.866 -25.190 1.00 0.00 N ATOM 1924 CA SER A 129 -5.347 3.220 -25.119 1.00 0.00 C ATOM 1925 C SER A 129 -4.262 3.418 -26.179 1.00 0.00 C ATOM 1926 O SER A 129 -3.830 2.459 -26.817 1.00 0.00 O ATOM 1927 CB SER A 129 -4.791 3.524 -23.727 1.00 0.00 C ATOM 1928 OG SER A 129 -5.651 4.383 -22.984 1.00 0.00 O ATOM 0 H SER A 129 -5.176 1.133 -25.044 1.00 0.00 H new ATOM 0 HA SER A 129 -6.166 3.913 -25.312 1.00 0.00 H new ATOM 0 HB2 SER A 129 -4.651 2.591 -23.181 1.00 0.00 H new ATOM 0 HB3 SER A 129 -3.809 3.988 -23.822 1.00 0.00 H new ATOM 0 HG SER A 129 -5.261 4.552 -22.101 1.00 0.00 H new ATOM 1934 N GLY A 130 -3.853 4.669 -26.334 1.00 0.00 N ATOM 1935 CA GLY A 130 -2.826 5.005 -27.306 1.00 0.00 C ATOM 1936 C GLY A 130 -3.291 4.684 -28.728 1.00 0.00 C ATOM 1937 O GLY A 130 -4.025 5.461 -29.336 1.00 0.00 O ATOM 0 H GLY A 130 -4.214 5.462 -25.803 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.581 6.064 -27.230 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -1.914 4.450 -27.084 1.00 0.00 H new TER 1941 GLY A 130