USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 819 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=0.000421 USER MOD Single : A 5 SER OG : rot 29:sc= 0.642 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.00414 USER MOD Single : A 17 GLN :FLIP amide:sc= 0.422 F(o=-2.2!,f=0.42) USER MOD Single : A 24 SER OG : rot 180:sc= 0.00575 USER MOD Single : A 25 SER OG : rot 180:sc= -0.968 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 ASN :FLIP amide:sc= -1.34! C(o=-4.3!,f=-1.3!) USER MOD Single : A 29 GLN : amide:sc= -9.29! C(o=-9.3!,f=-19!) USER MOD Single : A 32 SER OG : rot 180:sc=-0.00313 USER MOD Single : A 41 GLN : amide:sc= -0.237 K(o=-0.24,f=-2!) USER MOD Single : A 45 GLN : amide:sc= -0.509 X(o=-0.51,f=-0.25) USER MOD Single : A 46 THR OG1 : rot 175:sc= 0.25 USER MOD Single : A 49 ASN : amide:sc= -1.25 X(o=-1.2,f=-1.6!) USER MOD Single : A 50 THR OG1 : rot 102:sc= 1.33 USER MOD Single : A 51 TYR OH : rot 150:sc= -0.596 USER MOD Single : A 53 ASN : amide:sc= 0.795 K(o=0.79,f=-0.02) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 THR OG1 : rot 8:sc= -0.149 USER MOD Single : A 59 MET CE :methyl -152:sc= -0.272 (180deg=-1.05) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 130:sc= -0.0237 (180deg=-0.755) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= -0.0636 USER MOD Single : A 107 MET CE :methyl 150:sc= -0.288 (180deg=-1.11) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.890 -4.462 -8.438 1.00 0.00 N ATOM 2 CA GLY A 1 -17.257 -4.740 -8.040 1.00 0.00 C ATOM 3 C GLY A 1 -17.742 -3.812 -6.944 1.00 0.00 C ATOM 4 O GLY A 1 -17.603 -4.113 -5.759 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.606 -5.123 -9.189 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.823 -3.486 -8.792 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.260 -4.577 -7.619 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.911 -4.646 -8.907 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -17.329 -5.772 -7.697 1.00 0.00 H new ATOM 8 N SER A 2 -18.312 -2.678 -7.341 1.00 0.00 N ATOM 9 CA SER A 2 -18.814 -1.699 -6.384 1.00 0.00 C ATOM 10 C SER A 2 -20.016 -2.251 -5.623 1.00 0.00 C ATOM 11 O SER A 2 -19.975 -2.404 -4.402 1.00 0.00 O ATOM 12 CB SER A 2 -19.201 -0.405 -7.101 1.00 0.00 C ATOM 13 OG SER A 2 -19.247 0.685 -6.197 1.00 0.00 O ATOM 0 H SER A 2 -18.437 -2.415 -8.318 1.00 0.00 H new ATOM 0 HA SER A 2 -18.019 -1.486 -5.669 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.481 -0.195 -7.892 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.173 -0.527 -7.578 1.00 0.00 H new ATOM 0 HG SER A 2 -19.495 1.501 -6.680 1.00 0.00 H new ATOM 19 N SER A 3 -21.086 -2.547 -6.354 1.00 0.00 N ATOM 20 CA SER A 3 -22.302 -3.078 -5.749 1.00 0.00 C ATOM 21 C SER A 3 -22.224 -4.596 -5.615 1.00 0.00 C ATOM 22 O SER A 3 -21.858 -5.296 -6.558 1.00 0.00 O ATOM 23 CB SER A 3 -23.524 -2.691 -6.584 1.00 0.00 C ATOM 24 OG SER A 3 -23.355 -3.069 -7.940 1.00 0.00 O ATOM 0 H SER A 3 -21.136 -2.428 -7.366 1.00 0.00 H new ATOM 0 HA SER A 3 -22.400 -2.647 -4.753 1.00 0.00 H new ATOM 0 HB2 SER A 3 -24.414 -3.172 -6.177 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.686 -1.615 -6.520 1.00 0.00 H new ATOM 0 HG SER A 3 -24.150 -2.813 -8.453 1.00 0.00 H new ATOM 30 N GLY A 4 -22.571 -5.098 -4.434 1.00 0.00 N ATOM 31 CA GLY A 4 -22.534 -6.530 -4.196 1.00 0.00 C ATOM 32 C GLY A 4 -22.050 -6.873 -2.802 1.00 0.00 C ATOM 33 O GLY A 4 -22.848 -7.200 -1.923 1.00 0.00 O ATOM 0 H GLY A 4 -22.877 -4.539 -3.638 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.531 -6.946 -4.344 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.880 -7.001 -4.930 1.00 0.00 H new ATOM 37 N SER A 5 -20.738 -6.801 -2.598 1.00 0.00 N ATOM 38 CA SER A 5 -20.148 -7.113 -1.301 1.00 0.00 C ATOM 39 C SER A 5 -18.669 -6.740 -1.274 1.00 0.00 C ATOM 40 O SER A 5 -17.861 -7.303 -2.012 1.00 0.00 O ATOM 41 CB SER A 5 -20.316 -8.600 -0.985 1.00 0.00 C ATOM 42 OG SER A 5 -19.653 -9.404 -1.945 1.00 0.00 O ATOM 0 H SER A 5 -20.064 -6.530 -3.314 1.00 0.00 H new ATOM 0 HA SER A 5 -20.667 -6.527 -0.543 1.00 0.00 H new ATOM 0 HB2 SER A 5 -19.918 -8.811 0.008 1.00 0.00 H new ATOM 0 HB3 SER A 5 -21.376 -8.853 -0.964 1.00 0.00 H new ATOM 0 HG SER A 5 -18.885 -8.915 -2.307 1.00 0.00 H new ATOM 48 N SER A 6 -18.322 -5.786 -0.416 1.00 0.00 N ATOM 49 CA SER A 6 -16.941 -5.333 -0.294 1.00 0.00 C ATOM 50 C SER A 6 -16.256 -5.994 0.899 1.00 0.00 C ATOM 51 O SER A 6 -16.185 -5.420 1.984 1.00 0.00 O ATOM 52 CB SER A 6 -16.892 -3.811 -0.145 1.00 0.00 C ATOM 53 OG SER A 6 -17.611 -3.174 -1.187 1.00 0.00 O ATOM 0 H SER A 6 -18.978 -5.312 0.205 1.00 0.00 H new ATOM 0 HA SER A 6 -16.409 -5.619 -1.201 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.311 -3.523 0.819 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.855 -3.474 -0.155 1.00 0.00 H new ATOM 0 HG SER A 6 -17.566 -2.202 -1.069 1.00 0.00 H new ATOM 59 N GLY A 7 -15.753 -7.207 0.687 1.00 0.00 N ATOM 60 CA GLY A 7 -15.081 -7.927 1.752 1.00 0.00 C ATOM 61 C GLY A 7 -16.025 -8.324 2.870 1.00 0.00 C ATOM 62 O GLY A 7 -16.214 -7.574 3.828 1.00 0.00 O ATOM 0 H GLY A 7 -15.799 -7.703 -0.203 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.612 -8.821 1.342 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -14.282 -7.306 2.158 1.00 0.00 H new ATOM 66 N ARG A 8 -16.621 -9.506 2.747 1.00 0.00 N ATOM 67 CA ARG A 8 -17.553 -9.999 3.754 1.00 0.00 C ATOM 68 C ARG A 8 -17.133 -9.551 5.151 1.00 0.00 C ATOM 69 O ARG A 8 -16.002 -9.787 5.575 1.00 0.00 O ATOM 70 CB ARG A 8 -17.635 -11.526 3.700 1.00 0.00 C ATOM 71 CG ARG A 8 -18.484 -12.050 2.553 1.00 0.00 C ATOM 72 CD ARG A 8 -18.627 -13.563 2.613 1.00 0.00 C ATOM 73 NE ARG A 8 -19.895 -14.015 2.046 1.00 0.00 N ATOM 74 CZ ARG A 8 -20.091 -15.237 1.565 1.00 0.00 C ATOM 75 NH1 ARG A 8 -19.106 -16.125 1.583 1.00 0.00 N ATOM 76 NH2 ARG A 8 -21.273 -15.574 1.065 1.00 0.00 N ATOM 0 H ARG A 8 -16.475 -10.139 1.961 1.00 0.00 H new ATOM 0 HA ARG A 8 -18.536 -9.581 3.538 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -16.628 -11.933 3.611 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.044 -11.893 4.641 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -19.471 -11.588 2.589 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -18.032 -11.763 1.603 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -17.802 -14.027 2.072 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -18.555 -13.893 3.649 1.00 0.00 H new ATOM 0 HE ARG A 8 -20.673 -13.356 2.018 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -18.196 -15.870 1.967 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -19.258 -17.063 1.213 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -22.033 -14.894 1.050 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -21.422 -16.513 0.696 1.00 0.00 H new ATOM 90 N ASP A 9 -18.050 -8.902 5.859 1.00 0.00 N ATOM 91 CA ASP A 9 -17.775 -8.421 7.208 1.00 0.00 C ATOM 92 C ASP A 9 -18.081 -9.500 8.243 1.00 0.00 C ATOM 93 O ASP A 9 -18.662 -9.221 9.292 1.00 0.00 O ATOM 94 CB ASP A 9 -18.599 -7.167 7.503 1.00 0.00 C ATOM 95 CG ASP A 9 -20.017 -7.492 7.931 1.00 0.00 C ATOM 96 OD1 ASP A 9 -20.685 -8.275 7.224 1.00 0.00 O ATOM 97 OD2 ASP A 9 -20.457 -6.964 8.973 1.00 0.00 O ATOM 0 H ASP A 9 -18.990 -8.697 5.522 1.00 0.00 H new ATOM 0 HA ASP A 9 -16.715 -8.173 7.270 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -18.109 -6.590 8.288 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -18.627 -6.537 6.614 1.00 0.00 H new ATOM 102 N ARG A 10 -17.686 -10.732 7.940 1.00 0.00 N ATOM 103 CA ARG A 10 -17.920 -11.853 8.842 1.00 0.00 C ATOM 104 C ARG A 10 -16.632 -12.255 9.554 1.00 0.00 C ATOM 105 O ARG A 10 -16.620 -12.462 10.768 1.00 0.00 O ATOM 106 CB ARG A 10 -18.483 -13.048 8.070 1.00 0.00 C ATOM 107 CG ARG A 10 -18.645 -14.299 8.918 1.00 0.00 C ATOM 108 CD ARG A 10 -19.999 -14.331 9.610 1.00 0.00 C ATOM 109 NE ARG A 10 -20.073 -13.377 10.713 1.00 0.00 N ATOM 110 CZ ARG A 10 -21.214 -12.979 11.265 1.00 0.00 C ATOM 111 NH1 ARG A 10 -22.370 -13.453 10.821 1.00 0.00 N ATOM 112 NH2 ARG A 10 -21.200 -12.107 12.265 1.00 0.00 N ATOM 0 H ARG A 10 -17.202 -10.979 7.077 1.00 0.00 H new ATOM 0 HA ARG A 10 -18.647 -11.539 9.591 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -19.452 -12.775 7.651 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -17.824 -13.271 7.231 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -18.535 -15.183 8.289 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -17.852 -14.339 9.665 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -20.782 -14.108 8.885 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -20.190 -15.336 9.987 1.00 0.00 H new ATOM 0 HE ARG A 10 -19.201 -12.995 11.080 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -22.385 -14.125 10.054 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -23.244 -13.146 11.247 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -20.313 -11.742 12.611 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -22.077 -11.802 12.688 1.00 0.00 H new ATOM 126 N SER A 11 -15.549 -12.365 8.791 1.00 0.00 N ATOM 127 CA SER A 11 -14.257 -12.747 9.348 1.00 0.00 C ATOM 128 C SER A 11 -13.672 -11.615 10.189 1.00 0.00 C ATOM 129 O SER A 11 -14.056 -10.454 10.043 1.00 0.00 O ATOM 130 CB SER A 11 -13.285 -13.120 8.228 1.00 0.00 C ATOM 131 OG SER A 11 -13.554 -14.419 7.731 1.00 0.00 O ATOM 0 H SER A 11 -15.541 -12.195 7.785 1.00 0.00 H new ATOM 0 HA SER A 11 -14.408 -13.614 9.991 1.00 0.00 H new ATOM 0 HB2 SER A 11 -13.362 -12.394 7.418 1.00 0.00 H new ATOM 0 HB3 SER A 11 -12.262 -13.074 8.600 1.00 0.00 H new ATOM 0 HG SER A 11 -12.920 -14.633 7.015 1.00 0.00 H new ATOM 137 N THR A 12 -12.739 -11.962 11.070 1.00 0.00 N ATOM 138 CA THR A 12 -12.101 -10.978 11.935 1.00 0.00 C ATOM 139 C THR A 12 -11.819 -9.684 11.181 1.00 0.00 C ATOM 140 O THR A 12 -11.751 -9.673 9.952 1.00 0.00 O ATOM 141 CB THR A 12 -10.781 -11.516 12.520 1.00 0.00 C ATOM 142 OG1 THR A 12 -10.988 -12.819 13.078 1.00 0.00 O ATOM 143 CG2 THR A 12 -10.243 -10.580 13.591 1.00 0.00 C ATOM 0 H THR A 12 -12.408 -12.918 11.203 1.00 0.00 H new ATOM 0 HA THR A 12 -12.796 -10.776 12.750 1.00 0.00 H new ATOM 0 HB THR A 12 -10.050 -11.578 11.714 1.00 0.00 H new ATOM 0 HG1 THR A 12 -10.144 -13.155 13.446 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.311 -10.981 13.989 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.059 -9.597 13.157 1.00 0.00 H new ATOM 0 HG23 THR A 12 -10.973 -10.490 14.396 1.00 0.00 H new ATOM 151 N ILE A 13 -11.655 -8.595 11.925 1.00 0.00 N ATOM 152 CA ILE A 13 -11.379 -7.296 11.325 1.00 0.00 C ATOM 153 C ILE A 13 -9.937 -6.868 11.581 1.00 0.00 C ATOM 154 O ILE A 13 -9.306 -7.317 12.537 1.00 0.00 O ATOM 155 CB ILE A 13 -12.328 -6.212 11.869 1.00 0.00 C ATOM 156 CG1 ILE A 13 -13.785 -6.600 11.607 1.00 0.00 C ATOM 157 CG2 ILE A 13 -12.012 -4.865 11.236 1.00 0.00 C ATOM 158 CD1 ILE A 13 -14.782 -5.746 12.357 1.00 0.00 C ATOM 0 H ILE A 13 -11.709 -8.587 12.944 1.00 0.00 H new ATOM 0 HA ILE A 13 -11.539 -7.403 10.252 1.00 0.00 H new ATOM 0 HB ILE A 13 -12.181 -6.129 12.946 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -13.986 -6.525 10.538 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -13.930 -7.644 11.886 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -12.691 -4.109 11.631 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -10.984 -4.586 11.468 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -12.134 -4.933 10.155 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.794 -6.078 12.123 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.608 -5.840 13.429 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -14.664 -4.704 12.060 1.00 0.00 H new ATOM 170 N ALA A 14 -9.424 -5.995 10.720 1.00 0.00 N ATOM 171 CA ALA A 14 -8.058 -5.503 10.855 1.00 0.00 C ATOM 172 C ALA A 14 -8.018 -3.979 10.818 1.00 0.00 C ATOM 173 O ALA A 14 -8.616 -3.354 9.943 1.00 0.00 O ATOM 174 CB ALA A 14 -7.178 -6.083 9.757 1.00 0.00 C ATOM 0 H ALA A 14 -9.933 -5.614 9.922 1.00 0.00 H new ATOM 0 HA ALA A 14 -7.674 -5.827 11.822 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -6.161 -5.708 9.870 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -7.174 -7.171 9.831 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -7.568 -5.787 8.783 1.00 0.00 H new ATOM 180 N ARG A 15 -7.309 -3.388 11.775 1.00 0.00 N ATOM 181 CA ARG A 15 -7.192 -1.937 11.853 1.00 0.00 C ATOM 182 C ARG A 15 -5.909 -1.458 11.180 1.00 0.00 C ATOM 183 O ARG A 15 -4.811 -1.666 11.697 1.00 0.00 O ATOM 184 CB ARG A 15 -7.218 -1.480 13.312 1.00 0.00 C ATOM 185 CG ARG A 15 -8.616 -1.209 13.842 1.00 0.00 C ATOM 186 CD ARG A 15 -8.582 -0.716 15.280 1.00 0.00 C ATOM 187 NE ARG A 15 -8.446 -1.814 16.232 1.00 0.00 N ATOM 188 CZ ARG A 15 -8.803 -1.729 17.509 1.00 0.00 C ATOM 189 NH1 ARG A 15 -9.315 -0.601 17.983 1.00 0.00 N ATOM 190 NH2 ARG A 15 -8.649 -2.772 18.314 1.00 0.00 N ATOM 0 H ARG A 15 -6.807 -3.892 12.506 1.00 0.00 H new ATOM 0 HA ARG A 15 -8.041 -1.500 11.328 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -6.746 -2.243 13.931 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -6.620 -0.574 13.411 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -9.107 -0.466 13.213 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -9.211 -2.120 13.783 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -7.751 -0.022 15.406 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -9.495 -0.161 15.495 1.00 0.00 H new ATOM 0 HE ARG A 15 -8.055 -2.695 15.899 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -9.435 0.203 17.367 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.589 -0.538 18.964 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -8.256 -3.641 17.953 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -8.924 -2.705 19.294 1.00 0.00 H new ATOM 204 N ILE A 16 -6.056 -0.815 10.026 1.00 0.00 N ATOM 205 CA ILE A 16 -4.910 -0.306 9.285 1.00 0.00 C ATOM 206 C ILE A 16 -4.934 1.217 9.212 1.00 0.00 C ATOM 207 O ILE A 16 -5.848 1.806 8.637 1.00 0.00 O ATOM 208 CB ILE A 16 -4.866 -0.876 7.854 1.00 0.00 C ATOM 209 CG1 ILE A 16 -5.333 -2.333 7.848 1.00 0.00 C ATOM 210 CG2 ILE A 16 -3.462 -0.762 7.281 1.00 0.00 C ATOM 211 CD1 ILE A 16 -4.424 -3.262 8.623 1.00 0.00 C ATOM 0 H ILE A 16 -6.958 -0.635 9.585 1.00 0.00 H new ATOM 0 HA ILE A 16 -4.019 -0.628 9.824 1.00 0.00 H new ATOM 0 HB ILE A 16 -5.541 -0.295 7.226 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -6.337 -2.386 8.269 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -5.400 -2.680 6.817 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -3.448 -1.169 6.270 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -3.164 0.286 7.255 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -2.767 -1.321 7.907 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -4.816 -4.278 8.576 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -3.424 -3.239 8.189 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -4.376 -2.940 9.663 1.00 0.00 H new ATOM 223 N GLN A 17 -3.921 1.848 9.799 1.00 0.00 N ATOM 224 CA GLN A 17 -3.826 3.303 9.800 1.00 0.00 C ATOM 225 C GLN A 17 -2.916 3.789 8.676 1.00 0.00 C ATOM 226 O GLN A 17 -1.828 3.252 8.468 1.00 0.00 O ATOM 227 CB GLN A 17 -3.302 3.800 11.148 1.00 0.00 C ATOM 228 CG GLN A 17 -3.087 5.304 11.200 1.00 0.00 C ATOM 229 CD GLN A 17 -2.558 5.771 12.542 1.00 0.00 C ATOM 230 OE1 GLN A 17 -1.284 6.143 12.578 1.00 0.00 O flip ATOM 231 NE2 GLN A 17 -3.286 5.798 13.534 1.00 0.00 N flip ATOM 0 H GLN A 17 -3.156 1.375 10.279 1.00 0.00 H new ATOM 0 HA GLN A 17 -4.825 3.708 9.635 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.006 3.515 11.930 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.360 3.299 11.369 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.387 5.595 10.417 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -4.029 5.810 10.989 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -4.260 5.503 13.460 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -2.916 6.116 14.430 1.00 0.00 H new ATOM 240 N PHE A 18 -3.369 4.809 7.955 1.00 0.00 N ATOM 241 CA PHE A 18 -2.597 5.368 6.851 1.00 0.00 C ATOM 242 C PHE A 18 -2.171 6.801 7.156 1.00 0.00 C ATOM 243 O PHE A 18 -3.009 7.691 7.299 1.00 0.00 O ATOM 244 CB PHE A 18 -3.414 5.330 5.558 1.00 0.00 C ATOM 245 CG PHE A 18 -3.634 3.942 5.028 1.00 0.00 C ATOM 246 CD1 PHE A 18 -4.720 3.190 5.447 1.00 0.00 C ATOM 247 CD2 PHE A 18 -2.755 3.389 4.111 1.00 0.00 C ATOM 248 CE1 PHE A 18 -4.925 1.912 4.961 1.00 0.00 C ATOM 249 CE2 PHE A 18 -2.956 2.113 3.621 1.00 0.00 C ATOM 250 CZ PHE A 18 -4.041 1.373 4.048 1.00 0.00 C ATOM 0 H PHE A 18 -4.267 5.266 8.115 1.00 0.00 H new ATOM 0 HA PHE A 18 -1.701 4.761 6.723 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.381 5.800 5.735 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -2.905 5.924 4.799 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -5.414 3.607 6.161 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -1.903 3.962 3.775 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.775 1.336 5.295 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -2.265 1.694 2.904 1.00 0.00 H new ATOM 0 HZ PHE A 18 -4.198 0.374 3.668 1.00 0.00 H new ATOM 260 N ARG A 19 -0.863 7.015 7.254 1.00 0.00 N ATOM 261 CA ARG A 19 -0.326 8.339 7.544 1.00 0.00 C ATOM 262 C ARG A 19 0.083 9.053 6.258 1.00 0.00 C ATOM 263 O ARG A 19 0.519 8.420 5.296 1.00 0.00 O ATOM 264 CB ARG A 19 0.877 8.230 8.483 1.00 0.00 C ATOM 265 CG ARG A 19 0.526 7.695 9.862 1.00 0.00 C ATOM 266 CD ARG A 19 1.454 8.253 10.929 1.00 0.00 C ATOM 267 NE ARG A 19 1.077 9.605 11.331 1.00 0.00 N ATOM 268 CZ ARG A 19 0.134 9.869 12.229 1.00 0.00 C ATOM 269 NH1 ARG A 19 -0.523 8.879 12.816 1.00 0.00 N ATOM 270 NH2 ARG A 19 -0.152 11.127 12.541 1.00 0.00 N ATOM 0 H ARG A 19 -0.156 6.289 7.137 1.00 0.00 H new ATOM 0 HA ARG A 19 -1.108 8.922 8.031 1.00 0.00 H new ATOM 0 HB2 ARG A 19 1.624 7.579 8.029 1.00 0.00 H new ATOM 0 HB3 ARG A 19 1.334 9.214 8.590 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -0.505 7.955 10.103 1.00 0.00 H new ATOM 0 HG3 ARG A 19 0.588 6.607 9.858 1.00 0.00 H new ATOM 0 HD2 ARG A 19 1.439 7.598 11.800 1.00 0.00 H new ATOM 0 HD3 ARG A 19 2.477 8.259 10.552 1.00 0.00 H new ATOM 0 HE ARG A 19 1.564 10.390 10.899 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -0.305 7.911 12.579 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -1.246 9.085 13.505 1.00 0.00 H new ATOM 0 HH21 ARG A 19 0.352 11.891 12.091 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -0.876 11.330 13.230 1.00 0.00 H new ATOM 284 N LEU A 20 -0.062 10.373 6.250 1.00 0.00 N ATOM 285 CA LEU A 20 0.291 11.174 5.083 1.00 0.00 C ATOM 286 C LEU A 20 1.415 12.151 5.413 1.00 0.00 C ATOM 287 O LEU A 20 1.608 12.549 6.562 1.00 0.00 O ATOM 288 CB LEU A 20 -0.933 11.939 4.575 1.00 0.00 C ATOM 289 CG LEU A 20 -2.044 11.092 3.955 1.00 0.00 C ATOM 290 CD1 LEU A 20 -3.294 11.929 3.736 1.00 0.00 C ATOM 291 CD2 LEU A 20 -1.577 10.474 2.645 1.00 0.00 C ATOM 0 H LEU A 20 -0.421 10.912 7.038 1.00 0.00 H new ATOM 0 HA LEU A 20 0.639 10.499 4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -1.355 12.503 5.407 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.601 12.665 3.833 1.00 0.00 H new ATOM 0 HG LEU A 20 -2.288 10.286 4.647 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -4.074 11.309 3.294 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -3.641 12.322 4.692 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -3.065 12.757 3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -2.381 9.875 2.218 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -1.304 11.265 1.946 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -0.711 9.839 2.831 1.00 0.00 H new ATOM 303 N PRO A 21 2.174 12.551 4.381 1.00 0.00 N ATOM 304 CA PRO A 21 3.290 13.489 4.536 1.00 0.00 C ATOM 305 C PRO A 21 2.818 14.901 4.863 1.00 0.00 C ATOM 306 O PRO A 21 3.614 15.757 5.253 1.00 0.00 O ATOM 307 CB PRO A 21 3.973 13.456 3.167 1.00 0.00 C ATOM 308 CG PRO A 21 2.900 13.048 2.218 1.00 0.00 C ATOM 309 CD PRO A 21 2.001 12.118 2.985 1.00 0.00 C ATOM 0 HA PRO A 21 3.946 13.211 5.361 1.00 0.00 H new ATOM 0 HB2 PRO A 21 4.383 14.432 2.905 1.00 0.00 H new ATOM 0 HB3 PRO A 21 4.802 12.748 3.155 1.00 0.00 H new ATOM 0 HG2 PRO A 21 2.348 13.916 1.857 1.00 0.00 H new ATOM 0 HG3 PRO A 21 3.320 12.551 1.343 1.00 0.00 H new ATOM 0 HD2 PRO A 21 0.963 12.205 2.663 1.00 0.00 H new ATOM 0 HD3 PRO A 21 2.290 11.076 2.849 1.00 0.00 H new ATOM 317 N ASP A 22 1.521 15.139 4.703 1.00 0.00 N ATOM 318 CA ASP A 22 0.944 16.449 4.983 1.00 0.00 C ATOM 319 C ASP A 22 0.668 16.613 6.474 1.00 0.00 C ATOM 320 O ASP A 22 1.181 17.531 7.113 1.00 0.00 O ATOM 321 CB ASP A 22 -0.349 16.640 4.188 1.00 0.00 C ATOM 322 CG ASP A 22 -1.204 17.765 4.736 1.00 0.00 C ATOM 323 OD1 ASP A 22 -1.810 17.581 5.813 1.00 0.00 O ATOM 324 OD2 ASP A 22 -1.268 18.831 4.088 1.00 0.00 O ATOM 0 H ASP A 22 0.849 14.442 4.381 1.00 0.00 H new ATOM 0 HA ASP A 22 1.664 17.209 4.679 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -0.104 16.848 3.146 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -0.921 15.712 4.202 1.00 0.00 H new ATOM 329 N GLY A 23 -0.147 15.717 7.023 1.00 0.00 N ATOM 330 CA GLY A 23 -0.478 15.782 8.434 1.00 0.00 C ATOM 331 C GLY A 23 -1.710 14.969 8.779 1.00 0.00 C ATOM 332 O GLY A 23 -1.762 14.322 9.824 1.00 0.00 O ATOM 0 H GLY A 23 -0.584 14.948 6.515 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.368 15.421 9.019 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.641 16.822 8.718 1.00 0.00 H new ATOM 336 N SER A 24 -2.705 15.003 7.898 1.00 0.00 N ATOM 337 CA SER A 24 -3.945 14.268 8.117 1.00 0.00 C ATOM 338 C SER A 24 -3.764 12.789 7.792 1.00 0.00 C ATOM 339 O SER A 24 -3.041 12.430 6.863 1.00 0.00 O ATOM 340 CB SER A 24 -5.069 14.856 7.261 1.00 0.00 C ATOM 341 OG SER A 24 -4.675 14.960 5.904 1.00 0.00 O ATOM 0 H SER A 24 -2.676 15.532 7.026 1.00 0.00 H new ATOM 0 HA SER A 24 -4.213 14.361 9.170 1.00 0.00 H new ATOM 0 HB2 SER A 24 -5.956 14.227 7.338 1.00 0.00 H new ATOM 0 HB3 SER A 24 -5.342 15.841 7.640 1.00 0.00 H new ATOM 0 HG SER A 24 -5.411 15.337 5.378 1.00 0.00 H new ATOM 347 N SER A 25 -4.427 11.934 8.565 1.00 0.00 N ATOM 348 CA SER A 25 -4.338 10.493 8.363 1.00 0.00 C ATOM 349 C SER A 25 -5.718 9.848 8.436 1.00 0.00 C ATOM 350 O SER A 25 -6.627 10.368 9.083 1.00 0.00 O ATOM 351 CB SER A 25 -3.414 9.867 9.410 1.00 0.00 C ATOM 352 OG SER A 25 -2.115 10.429 9.345 1.00 0.00 O ATOM 0 H SER A 25 -5.032 12.215 9.337 1.00 0.00 H new ATOM 0 HA SER A 25 -3.925 10.315 7.370 1.00 0.00 H new ATOM 0 HB2 SER A 25 -3.831 10.020 10.405 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.356 8.790 9.251 1.00 0.00 H new ATOM 0 HG SER A 25 -1.544 10.014 10.025 1.00 0.00 H new ATOM 358 N PHE A 26 -5.868 8.710 7.765 1.00 0.00 N ATOM 359 CA PHE A 26 -7.138 7.992 7.752 1.00 0.00 C ATOM 360 C PHE A 26 -6.925 6.506 8.022 1.00 0.00 C ATOM 361 O PHE A 26 -5.977 5.900 7.520 1.00 0.00 O ATOM 362 CB PHE A 26 -7.841 8.182 6.406 1.00 0.00 C ATOM 363 CG PHE A 26 -6.978 7.840 5.225 1.00 0.00 C ATOM 364 CD1 PHE A 26 -6.881 6.532 4.778 1.00 0.00 C ATOM 365 CD2 PHE A 26 -6.264 8.825 4.563 1.00 0.00 C ATOM 366 CE1 PHE A 26 -6.088 6.213 3.692 1.00 0.00 C ATOM 367 CE2 PHE A 26 -5.470 8.512 3.475 1.00 0.00 C ATOM 368 CZ PHE A 26 -5.381 7.204 3.040 1.00 0.00 C ATOM 0 H PHE A 26 -5.127 8.266 7.224 1.00 0.00 H new ATOM 0 HA PHE A 26 -7.766 8.400 8.543 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.737 7.562 6.383 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.168 9.218 6.319 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -7.431 5.753 5.284 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.328 9.849 4.900 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -6.021 5.190 3.354 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.920 9.290 2.966 1.00 0.00 H new ATOM 0 HZ PHE A 26 -4.760 6.957 2.192 1.00 0.00 H new ATOM 378 N THR A 27 -7.814 5.922 8.819 1.00 0.00 N ATOM 379 CA THR A 27 -7.724 4.507 9.158 1.00 0.00 C ATOM 380 C THR A 27 -8.926 3.736 8.624 1.00 0.00 C ATOM 381 O THR A 27 -10.036 3.867 9.136 1.00 0.00 O ATOM 382 CB THR A 27 -7.631 4.299 10.681 1.00 0.00 C ATOM 383 OG1 THR A 27 -6.570 5.095 11.221 1.00 0.00 O ATOM 384 CG2 THR A 27 -7.393 2.834 11.014 1.00 0.00 C ATOM 0 H THR A 27 -8.605 6.407 9.242 1.00 0.00 H new ATOM 0 HA THR A 27 -6.815 4.127 8.691 1.00 0.00 H new ATOM 0 HB THR A 27 -8.577 4.607 11.125 1.00 0.00 H new ATOM 0 HG1 THR A 27 -6.519 4.958 12.190 1.00 0.00 H new ATOM 0 HG21 THR A 27 -7.331 2.712 12.095 1.00 0.00 H new ATOM 0 HG22 THR A 27 -8.217 2.235 10.628 1.00 0.00 H new ATOM 0 HG23 THR A 27 -6.460 2.504 10.558 1.00 0.00 H new ATOM 392 N ASN A 28 -8.695 2.932 7.591 1.00 0.00 N ATOM 393 CA ASN A 28 -9.760 2.139 6.987 1.00 0.00 C ATOM 394 C ASN A 28 -9.925 0.807 7.712 1.00 0.00 C ATOM 395 O ASN A 28 -9.287 0.564 8.736 1.00 0.00 O ATOM 396 CB ASN A 28 -9.464 1.893 5.506 1.00 0.00 C ATOM 397 CG ASN A 28 -10.723 1.635 4.700 1.00 0.00 C ATOM 398 OD1 ASN A 28 -11.688 2.541 4.805 1.00 0.00 O flip ATOM 399 ND2 ASN A 28 -10.825 0.633 3.992 1.00 0.00 N flip ATOM 0 H ASN A 28 -7.781 2.812 7.155 1.00 0.00 H new ATOM 0 HA ASN A 28 -10.691 2.699 7.077 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -8.943 2.757 5.094 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -8.793 1.040 5.409 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -10.057 -0.037 3.942 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -11.677 0.472 3.455 1.00 0.00 H new ATOM 406 N GLN A 29 -10.784 -0.052 7.173 1.00 0.00 N ATOM 407 CA GLN A 29 -11.032 -1.359 7.770 1.00 0.00 C ATOM 408 C GLN A 29 -10.867 -2.469 6.737 1.00 0.00 C ATOM 409 O GLN A 29 -11.154 -2.279 5.555 1.00 0.00 O ATOM 410 CB GLN A 29 -12.438 -1.411 8.370 1.00 0.00 C ATOM 411 CG GLN A 29 -12.491 -1.000 9.832 1.00 0.00 C ATOM 412 CD GLN A 29 -11.768 -1.976 10.740 1.00 0.00 C ATOM 413 OE1 GLN A 29 -10.892 -2.720 10.298 1.00 0.00 O ATOM 414 NE2 GLN A 29 -12.132 -1.978 12.017 1.00 0.00 N ATOM 0 H GLN A 29 -11.319 0.133 6.325 1.00 0.00 H new ATOM 0 HA GLN A 29 -10.300 -1.513 8.563 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -13.094 -0.759 7.794 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -12.829 -2.424 8.272 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -12.048 -0.010 9.943 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -13.532 -0.921 10.146 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -12.863 -1.344 12.340 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -11.681 -2.613 12.675 1.00 0.00 H new ATOM 423 N PHE A 30 -10.401 -3.628 7.190 1.00 0.00 N ATOM 424 CA PHE A 30 -10.195 -4.768 6.305 1.00 0.00 C ATOM 425 C PHE A 30 -10.154 -6.071 7.097 1.00 0.00 C ATOM 426 O PHE A 30 -9.763 -6.106 8.264 1.00 0.00 O ATOM 427 CB PHE A 30 -8.897 -4.599 5.513 1.00 0.00 C ATOM 428 CG PHE A 30 -8.722 -3.223 4.936 1.00 0.00 C ATOM 429 CD1 PHE A 30 -9.347 -2.869 3.751 1.00 0.00 C ATOM 430 CD2 PHE A 30 -7.932 -2.283 5.579 1.00 0.00 C ATOM 431 CE1 PHE A 30 -9.188 -1.604 3.218 1.00 0.00 C ATOM 432 CE2 PHE A 30 -7.770 -1.016 5.050 1.00 0.00 C ATOM 433 CZ PHE A 30 -8.398 -0.677 3.868 1.00 0.00 C ATOM 0 H PHE A 30 -10.159 -3.802 8.165 1.00 0.00 H new ATOM 0 HA PHE A 30 -11.033 -4.812 5.610 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -8.052 -4.821 6.164 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -8.877 -5.329 4.704 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.966 -3.590 3.238 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -7.438 -2.543 6.503 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -9.681 -1.341 2.294 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.153 -0.292 5.561 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.271 0.312 3.453 1.00 0.00 H new ATOM 443 N PRO A 31 -10.568 -7.171 6.449 1.00 0.00 N ATOM 444 CA PRO A 31 -10.588 -8.497 7.073 1.00 0.00 C ATOM 445 C PRO A 31 -9.186 -9.047 7.313 1.00 0.00 C ATOM 446 O PRO A 31 -8.386 -9.157 6.384 1.00 0.00 O ATOM 447 CB PRO A 31 -11.333 -9.358 6.051 1.00 0.00 C ATOM 448 CG PRO A 31 -11.114 -8.673 4.746 1.00 0.00 C ATOM 449 CD PRO A 31 -11.047 -7.203 5.057 1.00 0.00 C ATOM 0 HA PRO A 31 -11.057 -8.477 8.057 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -10.945 -10.376 6.033 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -12.394 -9.426 6.289 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -10.192 -9.015 4.275 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -11.926 -8.888 4.051 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -10.366 -6.681 4.385 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -12.022 -6.726 4.956 1.00 0.00 H new ATOM 457 N SER A 32 -8.896 -9.390 8.563 1.00 0.00 N ATOM 458 CA SER A 32 -7.588 -9.925 8.925 1.00 0.00 C ATOM 459 C SER A 32 -7.059 -10.849 7.832 1.00 0.00 C ATOM 460 O SER A 32 -5.848 -11.001 7.665 1.00 0.00 O ATOM 461 CB SER A 32 -7.673 -10.683 10.252 1.00 0.00 C ATOM 462 OG SER A 32 -7.388 -9.828 11.346 1.00 0.00 O ATOM 0 H SER A 32 -9.548 -9.307 9.343 1.00 0.00 H new ATOM 0 HA SER A 32 -6.898 -9.089 9.036 1.00 0.00 H new ATOM 0 HB2 SER A 32 -8.670 -11.108 10.369 1.00 0.00 H new ATOM 0 HB3 SER A 32 -6.970 -11.516 10.244 1.00 0.00 H new ATOM 0 HG SER A 32 -7.450 -10.335 12.182 1.00 0.00 H new ATOM 468 N ASP A 33 -7.974 -11.465 7.092 1.00 0.00 N ATOM 469 CA ASP A 33 -7.600 -12.373 6.014 1.00 0.00 C ATOM 470 C ASP A 33 -7.052 -11.601 4.818 1.00 0.00 C ATOM 471 O ASP A 33 -6.029 -11.973 4.243 1.00 0.00 O ATOM 472 CB ASP A 33 -8.805 -13.213 5.586 1.00 0.00 C ATOM 473 CG ASP A 33 -9.594 -12.565 4.465 1.00 0.00 C ATOM 474 OD1 ASP A 33 -9.085 -12.528 3.325 1.00 0.00 O ATOM 475 OD2 ASP A 33 -10.720 -12.095 4.728 1.00 0.00 O ATOM 0 H ASP A 33 -8.980 -11.352 7.219 1.00 0.00 H new ATOM 0 HA ASP A 33 -6.818 -13.035 6.385 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -8.463 -14.196 5.264 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -9.459 -13.368 6.444 1.00 0.00 H new ATOM 480 N ALA A 34 -7.740 -10.526 4.448 1.00 0.00 N ATOM 481 CA ALA A 34 -7.321 -9.701 3.321 1.00 0.00 C ATOM 482 C ALA A 34 -5.826 -9.407 3.382 1.00 0.00 C ATOM 483 O ALA A 34 -5.294 -8.979 4.406 1.00 0.00 O ATOM 484 CB ALA A 34 -8.116 -8.404 3.293 1.00 0.00 C ATOM 0 H ALA A 34 -8.590 -10.206 4.912 1.00 0.00 H new ATOM 0 HA ALA A 34 -7.518 -10.255 2.403 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -7.793 -7.798 2.447 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -9.178 -8.630 3.193 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -7.948 -7.854 4.219 1.00 0.00 H new ATOM 490 N PRO A 35 -5.130 -9.642 2.259 1.00 0.00 N ATOM 491 CA PRO A 35 -3.687 -9.409 2.160 1.00 0.00 C ATOM 492 C PRO A 35 -3.336 -7.925 2.184 1.00 0.00 C ATOM 493 O PRO A 35 -4.087 -7.091 1.677 1.00 0.00 O ATOM 494 CB PRO A 35 -3.321 -10.023 0.807 1.00 0.00 C ATOM 495 CG PRO A 35 -4.580 -9.970 0.013 1.00 0.00 C ATOM 496 CD PRO A 35 -5.700 -10.152 1.001 1.00 0.00 C ATOM 0 HA PRO A 35 -3.146 -9.842 3.001 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -2.523 -9.462 0.321 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -2.967 -11.048 0.920 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -4.672 -9.018 -0.510 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -4.597 -10.753 -0.745 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -6.589 -9.595 0.708 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -5.994 -11.198 1.088 1.00 0.00 H new ATOM 504 N LEU A 36 -2.191 -7.602 2.776 1.00 0.00 N ATOM 505 CA LEU A 36 -1.740 -6.218 2.865 1.00 0.00 C ATOM 506 C LEU A 36 -2.110 -5.442 1.605 1.00 0.00 C ATOM 507 O LEU A 36 -2.496 -4.276 1.675 1.00 0.00 O ATOM 508 CB LEU A 36 -0.227 -6.167 3.083 1.00 0.00 C ATOM 509 CG LEU A 36 0.322 -4.871 3.681 1.00 0.00 C ATOM 510 CD1 LEU A 36 1.832 -4.804 3.515 1.00 0.00 C ATOM 511 CD2 LEU A 36 -0.341 -3.663 3.035 1.00 0.00 C ATOM 0 H LEU A 36 -1.558 -8.280 3.201 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.239 -5.753 3.715 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.054 -6.993 3.737 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.264 -6.338 2.125 1.00 0.00 H new ATOM 0 HG LEU A 36 0.093 -4.860 4.747 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.205 -3.875 3.946 1.00 0.00 H new ATOM 0 HD12 LEU A 36 2.292 -5.651 4.024 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.083 -4.838 2.455 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.062 -2.750 3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.144 -3.669 1.963 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.417 -3.704 3.206 1.00 0.00 H new ATOM 523 N GLU A 37 -1.992 -6.099 0.456 1.00 0.00 N ATOM 524 CA GLU A 37 -2.316 -5.470 -0.819 1.00 0.00 C ATOM 525 C GLU A 37 -3.621 -4.685 -0.723 1.00 0.00 C ATOM 526 O GLU A 37 -3.652 -3.481 -0.978 1.00 0.00 O ATOM 527 CB GLU A 37 -2.424 -6.526 -1.921 1.00 0.00 C ATOM 528 CG GLU A 37 -2.863 -5.964 -3.263 1.00 0.00 C ATOM 529 CD GLU A 37 -2.960 -7.028 -4.338 1.00 0.00 C ATOM 530 OE1 GLU A 37 -1.988 -7.796 -4.500 1.00 0.00 O ATOM 531 OE2 GLU A 37 -4.005 -7.093 -5.018 1.00 0.00 O ATOM 0 H GLU A 37 -1.675 -7.066 0.382 1.00 0.00 H new ATOM 0 HA GLU A 37 -1.512 -4.777 -1.067 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -1.457 -7.015 -2.040 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -3.132 -7.293 -1.609 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -3.832 -5.478 -3.150 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -2.157 -5.196 -3.580 1.00 0.00 H new ATOM 538 N GLU A 38 -4.694 -5.375 -0.353 1.00 0.00 N ATOM 539 CA GLU A 38 -6.002 -4.743 -0.224 1.00 0.00 C ATOM 540 C GLU A 38 -5.879 -3.366 0.422 1.00 0.00 C ATOM 541 O GLU A 38 -6.425 -2.383 -0.078 1.00 0.00 O ATOM 542 CB GLU A 38 -6.940 -5.624 0.603 1.00 0.00 C ATOM 543 CG GLU A 38 -7.745 -6.607 -0.230 1.00 0.00 C ATOM 544 CD GLU A 38 -6.917 -7.266 -1.316 1.00 0.00 C ATOM 545 OE1 GLU A 38 -6.517 -6.562 -2.267 1.00 0.00 O ATOM 546 OE2 GLU A 38 -6.668 -8.486 -1.214 1.00 0.00 O ATOM 0 H GLU A 38 -4.684 -6.372 -0.137 1.00 0.00 H new ATOM 0 HA GLU A 38 -6.418 -4.621 -1.224 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -6.353 -6.178 1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -7.626 -4.986 1.160 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -8.160 -7.376 0.422 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -8.587 -6.087 -0.686 1.00 0.00 H new ATOM 553 N ALA A 39 -5.158 -3.304 1.536 1.00 0.00 N ATOM 554 CA ALA A 39 -4.961 -2.048 2.250 1.00 0.00 C ATOM 555 C ALA A 39 -4.343 -0.991 1.341 1.00 0.00 C ATOM 556 O ALA A 39 -4.750 0.171 1.358 1.00 0.00 O ATOM 557 CB ALA A 39 -4.087 -2.269 3.476 1.00 0.00 C ATOM 0 H ALA A 39 -4.700 -4.109 1.964 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.937 -1.686 2.574 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -3.948 -1.323 3.999 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -4.569 -2.985 4.142 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -3.117 -2.658 3.166 1.00 0.00 H new ATOM 563 N ARG A 40 -3.357 -1.401 0.550 1.00 0.00 N ATOM 564 CA ARG A 40 -2.682 -0.488 -0.365 1.00 0.00 C ATOM 565 C ARG A 40 -3.659 0.072 -1.394 1.00 0.00 C ATOM 566 O ARG A 40 -3.650 1.268 -1.684 1.00 0.00 O ATOM 567 CB ARG A 40 -1.531 -1.203 -1.075 1.00 0.00 C ATOM 568 CG ARG A 40 -0.759 -0.311 -2.034 1.00 0.00 C ATOM 569 CD ARG A 40 0.697 -0.737 -2.142 1.00 0.00 C ATOM 570 NE ARG A 40 1.258 -0.440 -3.457 1.00 0.00 N ATOM 571 CZ ARG A 40 1.735 0.752 -3.800 1.00 0.00 C ATOM 572 NH1 ARG A 40 1.720 1.751 -2.929 1.00 0.00 N ATOM 573 NH2 ARG A 40 2.229 0.944 -5.016 1.00 0.00 N ATOM 0 H ARG A 40 -3.008 -2.359 0.524 1.00 0.00 H new ATOM 0 HA ARG A 40 -2.281 0.341 0.218 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -0.844 -1.599 -0.327 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.929 -2.056 -1.625 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.224 -0.346 -3.019 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -0.812 0.723 -1.694 1.00 0.00 H new ATOM 0 HD2 ARG A 40 1.281 -0.228 -1.375 1.00 0.00 H new ATOM 0 HD3 ARG A 40 0.777 -1.806 -1.947 1.00 0.00 H new ATOM 0 HE ARG A 40 1.285 -1.188 -4.150 1.00 0.00 H new ATOM 0 HH11 ARG A 40 1.342 1.606 -1.993 1.00 0.00 H new ATOM 0 HH12 ARG A 40 2.087 2.665 -3.195 1.00 0.00 H new ATOM 0 HH21 ARG A 40 2.243 0.177 -5.688 1.00 0.00 H new ATOM 0 HH22 ARG A 40 2.595 1.859 -5.279 1.00 0.00 H new ATOM 587 N GLN A 41 -4.499 -0.800 -1.941 1.00 0.00 N ATOM 588 CA GLN A 41 -5.481 -0.392 -2.939 1.00 0.00 C ATOM 589 C GLN A 41 -6.305 0.791 -2.439 1.00 0.00 C ATOM 590 O GLN A 41 -6.334 1.849 -3.067 1.00 0.00 O ATOM 591 CB GLN A 41 -6.404 -1.561 -3.285 1.00 0.00 C ATOM 592 CG GLN A 41 -5.821 -2.510 -4.320 1.00 0.00 C ATOM 593 CD GLN A 41 -6.888 -3.182 -5.162 1.00 0.00 C ATOM 594 OE1 GLN A 41 -7.991 -2.658 -5.321 1.00 0.00 O ATOM 595 NE2 GLN A 41 -6.564 -4.349 -5.708 1.00 0.00 N ATOM 0 H GLN A 41 -4.520 -1.793 -1.710 1.00 0.00 H new ATOM 0 HA GLN A 41 -4.944 -0.085 -3.836 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.626 -2.120 -2.376 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.351 -1.168 -3.656 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -5.143 -1.959 -4.972 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -5.228 -3.273 -3.815 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.638 -4.747 -5.550 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.241 -4.847 -6.285 1.00 0.00 H new ATOM 604 N PHE A 42 -6.973 0.603 -1.306 1.00 0.00 N ATOM 605 CA PHE A 42 -7.799 1.654 -0.723 1.00 0.00 C ATOM 606 C PHE A 42 -7.046 2.981 -0.688 1.00 0.00 C ATOM 607 O PHE A 42 -7.478 3.968 -1.282 1.00 0.00 O ATOM 608 CB PHE A 42 -8.235 1.264 0.691 1.00 0.00 C ATOM 609 CG PHE A 42 -8.907 2.379 1.440 1.00 0.00 C ATOM 610 CD1 PHE A 42 -10.200 2.765 1.122 1.00 0.00 C ATOM 611 CD2 PHE A 42 -8.246 3.043 2.461 1.00 0.00 C ATOM 612 CE1 PHE A 42 -10.821 3.790 1.810 1.00 0.00 C ATOM 613 CE2 PHE A 42 -8.863 4.068 3.152 1.00 0.00 C ATOM 614 CZ PHE A 42 -10.151 4.443 2.826 1.00 0.00 C ATOM 0 H PHE A 42 -6.959 -0.267 -0.773 1.00 0.00 H new ATOM 0 HA PHE A 42 -8.684 1.775 -1.348 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -8.916 0.415 0.631 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -7.362 0.934 1.254 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -10.728 2.259 0.327 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -7.237 2.756 2.719 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -11.829 4.080 1.554 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -8.338 4.576 3.947 1.00 0.00 H new ATOM 0 HZ PHE A 42 -10.634 5.245 3.364 1.00 0.00 H new ATOM 624 N ALA A 43 -5.918 2.996 0.015 1.00 0.00 N ATOM 625 CA ALA A 43 -5.104 4.199 0.127 1.00 0.00 C ATOM 626 C ALA A 43 -4.960 4.893 -1.223 1.00 0.00 C ATOM 627 O ALA A 43 -5.116 6.109 -1.326 1.00 0.00 O ATOM 628 CB ALA A 43 -3.734 3.859 0.697 1.00 0.00 C ATOM 0 H ALA A 43 -5.548 2.188 0.515 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.608 4.886 0.807 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.137 4.767 0.775 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -3.851 3.416 1.686 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -3.232 3.150 0.039 1.00 0.00 H new ATOM 634 N ALA A 44 -4.660 4.112 -2.255 1.00 0.00 N ATOM 635 CA ALA A 44 -4.496 4.651 -3.599 1.00 0.00 C ATOM 636 C ALA A 44 -5.749 5.396 -4.049 1.00 0.00 C ATOM 637 O ALA A 44 -5.663 6.426 -4.715 1.00 0.00 O ATOM 638 CB ALA A 44 -4.163 3.536 -4.579 1.00 0.00 C ATOM 0 H ALA A 44 -4.526 3.103 -2.186 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.669 5.361 -3.579 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.043 3.954 -5.579 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.236 3.050 -4.276 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.971 2.804 -4.586 1.00 0.00 H new ATOM 644 N GLN A 45 -6.911 4.866 -3.679 1.00 0.00 N ATOM 645 CA GLN A 45 -8.181 5.481 -4.046 1.00 0.00 C ATOM 646 C GLN A 45 -8.437 6.736 -3.219 1.00 0.00 C ATOM 647 O GLN A 45 -8.930 7.741 -3.732 1.00 0.00 O ATOM 648 CB GLN A 45 -9.327 4.486 -3.854 1.00 0.00 C ATOM 649 CG GLN A 45 -9.618 3.648 -5.088 1.00 0.00 C ATOM 650 CD GLN A 45 -10.053 4.486 -6.274 1.00 0.00 C ATOM 651 OE1 GLN A 45 -11.219 4.866 -6.386 1.00 0.00 O ATOM 652 NE2 GLN A 45 -9.115 4.779 -7.167 1.00 0.00 N ATOM 0 H GLN A 45 -6.999 4.013 -3.126 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.128 5.766 -5.097 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -9.086 3.823 -3.023 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -10.228 5.032 -3.575 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.726 3.081 -5.356 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -10.398 2.923 -4.855 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.161 4.443 -7.034 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -9.348 5.340 -7.986 1.00 0.00 H new ATOM 661 N THR A 46 -8.099 6.672 -1.935 1.00 0.00 N ATOM 662 CA THR A 46 -8.294 7.803 -1.036 1.00 0.00 C ATOM 663 C THR A 46 -7.495 9.016 -1.497 1.00 0.00 C ATOM 664 O THR A 46 -8.051 10.094 -1.709 1.00 0.00 O ATOM 665 CB THR A 46 -7.885 7.450 0.407 1.00 0.00 C ATOM 666 OG1 THR A 46 -8.601 6.293 0.851 1.00 0.00 O ATOM 667 CG2 THR A 46 -8.160 8.614 1.347 1.00 0.00 C ATOM 0 H THR A 46 -7.689 5.849 -1.494 1.00 0.00 H new ATOM 0 HA THR A 46 -9.357 8.043 -1.056 1.00 0.00 H new ATOM 0 HB THR A 46 -6.815 7.240 0.416 1.00 0.00 H new ATOM 0 HG1 THR A 46 -8.280 6.031 1.739 1.00 0.00 H new ATOM 0 HG21 THR A 46 -7.863 8.342 2.360 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.590 9.485 1.024 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.224 8.850 1.332 1.00 0.00 H new ATOM 675 N VAL A 47 -6.187 8.834 -1.651 1.00 0.00 N ATOM 676 CA VAL A 47 -5.311 9.914 -2.089 1.00 0.00 C ATOM 677 C VAL A 47 -5.400 10.116 -3.597 1.00 0.00 C ATOM 678 O VAL A 47 -5.141 11.206 -4.105 1.00 0.00 O ATOM 679 CB VAL A 47 -3.845 9.638 -1.704 1.00 0.00 C ATOM 680 CG1 VAL A 47 -3.717 9.429 -0.203 1.00 0.00 C ATOM 681 CG2 VAL A 47 -3.312 8.434 -2.466 1.00 0.00 C ATOM 0 H VAL A 47 -5.711 7.949 -1.479 1.00 0.00 H new ATOM 0 HA VAL A 47 -5.647 10.820 -1.584 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.246 10.507 -1.978 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -2.675 9.235 0.050 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.057 10.323 0.319 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.328 8.578 0.099 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -2.275 8.253 -2.182 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -3.912 7.556 -2.226 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -3.366 8.628 -3.537 1.00 0.00 H new ATOM 691 N GLY A 48 -5.769 9.056 -4.310 1.00 0.00 N ATOM 692 CA GLY A 48 -5.886 9.137 -5.755 1.00 0.00 C ATOM 693 C GLY A 48 -4.566 9.460 -6.426 1.00 0.00 C ATOM 694 O GLY A 48 -3.541 8.853 -6.119 1.00 0.00 O ATOM 0 H GLY A 48 -5.989 8.143 -3.913 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -6.263 8.189 -6.140 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -6.619 9.901 -6.015 1.00 0.00 H new ATOM 698 N ASN A 49 -4.591 10.419 -7.346 1.00 0.00 N ATOM 699 CA ASN A 49 -3.387 10.820 -8.065 1.00 0.00 C ATOM 700 C ASN A 49 -2.794 12.091 -7.466 1.00 0.00 C ATOM 701 O ASN A 49 -2.342 12.980 -8.189 1.00 0.00 O ATOM 702 CB ASN A 49 -3.701 11.039 -9.546 1.00 0.00 C ATOM 703 CG ASN A 49 -4.282 12.413 -9.817 1.00 0.00 C ATOM 704 OD1 ASN A 49 -3.596 13.300 -10.325 1.00 0.00 O ATOM 705 ND2 ASN A 49 -5.553 12.595 -9.477 1.00 0.00 N ATOM 0 H ASN A 49 -5.431 10.933 -7.611 1.00 0.00 H new ATOM 0 HA ASN A 49 -2.654 10.019 -7.971 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -2.790 10.911 -10.130 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.405 10.277 -9.882 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -5.999 13.499 -9.634 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -6.083 11.831 -9.058 1.00 0.00 H new ATOM 712 N THR A 50 -2.798 12.171 -6.139 1.00 0.00 N ATOM 713 CA THR A 50 -2.261 13.333 -5.442 1.00 0.00 C ATOM 714 C THR A 50 -0.754 13.210 -5.247 1.00 0.00 C ATOM 715 O THR A 50 -0.004 14.146 -5.527 1.00 0.00 O ATOM 716 CB THR A 50 -2.931 13.523 -4.068 1.00 0.00 C ATOM 717 OG1 THR A 50 -4.337 13.737 -4.234 1.00 0.00 O ATOM 718 CG2 THR A 50 -2.318 14.700 -3.325 1.00 0.00 C ATOM 0 H THR A 50 -3.167 11.445 -5.525 1.00 0.00 H new ATOM 0 HA THR A 50 -2.474 14.201 -6.065 1.00 0.00 H new ATOM 0 HB THR A 50 -2.768 12.619 -3.481 1.00 0.00 H new ATOM 0 HG1 THR A 50 -4.821 12.911 -4.023 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.807 14.814 -2.358 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.253 14.521 -3.174 1.00 0.00 H new ATOM 0 HG23 THR A 50 -2.453 15.610 -3.910 1.00 0.00 H new ATOM 726 N TYR A 51 -0.317 12.051 -4.768 1.00 0.00 N ATOM 727 CA TYR A 51 1.101 11.807 -4.535 1.00 0.00 C ATOM 728 C TYR A 51 1.724 11.053 -5.706 1.00 0.00 C ATOM 729 O TYR A 51 2.832 11.364 -6.140 1.00 0.00 O ATOM 730 CB TYR A 51 1.298 11.014 -3.241 1.00 0.00 C ATOM 731 CG TYR A 51 0.644 11.651 -2.036 1.00 0.00 C ATOM 732 CD1 TYR A 51 1.268 12.683 -1.347 1.00 0.00 C ATOM 733 CD2 TYR A 51 -0.598 11.219 -1.585 1.00 0.00 C ATOM 734 CE1 TYR A 51 0.674 13.268 -0.244 1.00 0.00 C ATOM 735 CE2 TYR A 51 -1.199 11.799 -0.485 1.00 0.00 C ATOM 736 CZ TYR A 51 -0.559 12.822 0.182 1.00 0.00 C ATOM 737 OH TYR A 51 -1.155 13.401 1.279 1.00 0.00 O ATOM 0 H TYR A 51 -0.924 11.266 -4.534 1.00 0.00 H new ATOM 0 HA TYR A 51 1.599 12.772 -4.442 1.00 0.00 H new ATOM 0 HB2 TYR A 51 0.895 10.010 -3.375 1.00 0.00 H new ATOM 0 HB3 TYR A 51 2.366 10.906 -3.050 1.00 0.00 H new ATOM 0 HD1 TYR A 51 2.234 13.035 -1.679 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -1.101 10.416 -2.103 1.00 0.00 H new ATOM 0 HE1 TYR A 51 1.173 14.069 0.281 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -2.165 11.453 -0.149 1.00 0.00 H new ATOM 0 HH TYR A 51 -2.129 13.357 1.183 1.00 0.00 H new ATOM 747 N GLY A 52 1.001 10.059 -6.213 1.00 0.00 N ATOM 748 CA GLY A 52 1.498 9.275 -7.329 1.00 0.00 C ATOM 749 C GLY A 52 1.758 7.830 -6.953 1.00 0.00 C ATOM 750 O GLY A 52 0.902 7.172 -6.363 1.00 0.00 O ATOM 0 H GLY A 52 0.081 9.783 -5.871 1.00 0.00 H new ATOM 0 HA2 GLY A 52 0.775 9.311 -8.144 1.00 0.00 H new ATOM 0 HA3 GLY A 52 2.420 9.722 -7.701 1.00 0.00 H new ATOM 754 N ASN A 53 2.942 7.335 -7.298 1.00 0.00 N ATOM 755 CA ASN A 53 3.311 5.957 -6.994 1.00 0.00 C ATOM 756 C ASN A 53 3.836 5.836 -5.567 1.00 0.00 C ATOM 757 O ASN A 53 4.849 5.182 -5.320 1.00 0.00 O ATOM 758 CB ASN A 53 4.369 5.461 -7.982 1.00 0.00 C ATOM 759 CG ASN A 53 4.277 3.968 -8.228 1.00 0.00 C ATOM 760 OD1 ASN A 53 4.032 3.526 -9.350 1.00 0.00 O ATOM 761 ND2 ASN A 53 4.473 3.182 -7.175 1.00 0.00 N ATOM 0 H ASN A 53 3.662 7.867 -7.788 1.00 0.00 H new ATOM 0 HA ASN A 53 2.418 5.339 -7.087 1.00 0.00 H new ATOM 0 HB2 ASN A 53 4.255 5.990 -8.928 1.00 0.00 H new ATOM 0 HB3 ASN A 53 5.361 5.703 -7.600 1.00 0.00 H new ATOM 0 HD21 ASN A 53 4.423 2.169 -7.279 1.00 0.00 H new ATOM 0 HD22 ASN A 53 4.674 3.592 -6.263 1.00 0.00 H new ATOM 768 N PHE A 54 3.138 6.470 -4.630 1.00 0.00 N ATOM 769 CA PHE A 54 3.533 6.434 -3.227 1.00 0.00 C ATOM 770 C PHE A 54 3.713 4.996 -2.749 1.00 0.00 C ATOM 771 O PHE A 54 3.178 4.061 -3.345 1.00 0.00 O ATOM 772 CB PHE A 54 2.488 7.144 -2.363 1.00 0.00 C ATOM 773 CG PHE A 54 1.197 6.386 -2.240 1.00 0.00 C ATOM 774 CD1 PHE A 54 1.119 5.248 -1.454 1.00 0.00 C ATOM 775 CD2 PHE A 54 0.062 6.811 -2.912 1.00 0.00 C ATOM 776 CE1 PHE A 54 -0.068 4.548 -1.338 1.00 0.00 C ATOM 777 CE2 PHE A 54 -1.127 6.116 -2.800 1.00 0.00 C ATOM 778 CZ PHE A 54 -1.192 4.982 -2.013 1.00 0.00 C ATOM 0 H PHE A 54 2.296 7.015 -4.817 1.00 0.00 H new ATOM 0 HA PHE A 54 4.487 6.952 -3.130 1.00 0.00 H new ATOM 0 HB2 PHE A 54 2.901 7.306 -1.367 1.00 0.00 H new ATOM 0 HB3 PHE A 54 2.284 8.127 -2.788 1.00 0.00 H new ATOM 0 HD1 PHE A 54 1.996 4.903 -0.926 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.107 7.695 -3.530 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -0.116 3.663 -0.720 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -2.005 6.459 -3.327 1.00 0.00 H new ATOM 0 HZ PHE A 54 -2.120 4.436 -1.926 1.00 0.00 H new ATOM 788 N SER A 55 4.471 4.828 -1.670 1.00 0.00 N ATOM 789 CA SER A 55 4.726 3.505 -1.114 1.00 0.00 C ATOM 790 C SER A 55 4.186 3.400 0.309 1.00 0.00 C ATOM 791 O SER A 55 3.649 4.365 0.854 1.00 0.00 O ATOM 792 CB SER A 55 6.226 3.204 -1.126 1.00 0.00 C ATOM 793 OG SER A 55 6.697 3.006 -2.448 1.00 0.00 O ATOM 0 H SER A 55 4.919 5.592 -1.164 1.00 0.00 H new ATOM 0 HA SER A 55 4.211 2.772 -1.734 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.769 4.028 -0.663 1.00 0.00 H new ATOM 0 HB3 SER A 55 6.426 2.315 -0.528 1.00 0.00 H new ATOM 0 HG SER A 55 7.658 2.817 -2.428 1.00 0.00 H new ATOM 799 N LEU A 56 4.333 2.222 0.905 1.00 0.00 N ATOM 800 CA LEU A 56 3.861 1.989 2.266 1.00 0.00 C ATOM 801 C LEU A 56 4.955 1.361 3.122 1.00 0.00 C ATOM 802 O LEU A 56 5.760 0.567 2.635 1.00 0.00 O ATOM 803 CB LEU A 56 2.627 1.084 2.250 1.00 0.00 C ATOM 804 CG LEU A 56 1.399 1.636 1.524 1.00 0.00 C ATOM 805 CD1 LEU A 56 0.354 0.546 1.340 1.00 0.00 C ATOM 806 CD2 LEU A 56 0.814 2.815 2.287 1.00 0.00 C ATOM 0 H LEU A 56 4.775 1.413 0.468 1.00 0.00 H new ATOM 0 HA LEU A 56 3.593 2.952 2.701 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.902 0.136 1.787 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.347 0.866 3.281 1.00 0.00 H new ATOM 0 HG LEU A 56 1.709 1.984 0.539 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.513 0.957 0.822 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.777 -0.268 0.751 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.048 0.167 2.315 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -0.059 3.195 1.756 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.519 2.492 3.285 1.00 0.00 H new ATOM 0 HD23 LEU A 56 1.562 3.604 2.367 1.00 0.00 H new ATOM 818 N ALA A 57 4.978 1.721 4.401 1.00 0.00 N ATOM 819 CA ALA A 57 5.971 1.189 5.327 1.00 0.00 C ATOM 820 C ALA A 57 5.475 1.264 6.767 1.00 0.00 C ATOM 821 O ALA A 57 4.475 1.922 7.057 1.00 0.00 O ATOM 822 CB ALA A 57 7.285 1.941 5.180 1.00 0.00 C ATOM 0 H ALA A 57 4.320 2.379 4.820 1.00 0.00 H new ATOM 0 HA ALA A 57 6.135 0.140 5.081 1.00 0.00 H new ATOM 0 HB1 ALA A 57 8.017 1.534 5.877 1.00 0.00 H new ATOM 0 HB2 ALA A 57 7.655 1.832 4.160 1.00 0.00 H new ATOM 0 HB3 ALA A 57 7.126 2.997 5.397 1.00 0.00 H new ATOM 828 N THR A 58 6.179 0.585 7.667 1.00 0.00 N ATOM 829 CA THR A 58 5.809 0.573 9.076 1.00 0.00 C ATOM 830 C THR A 58 6.181 1.887 9.754 1.00 0.00 C ATOM 831 O THR A 58 6.635 2.826 9.100 1.00 0.00 O ATOM 832 CB THR A 58 6.489 -0.588 9.826 1.00 0.00 C ATOM 833 OG1 THR A 58 7.903 -0.557 9.598 1.00 0.00 O ATOM 834 CG2 THR A 58 5.926 -1.927 9.374 1.00 0.00 C ATOM 0 H THR A 58 7.009 0.036 7.444 1.00 0.00 H new ATOM 0 HA THR A 58 4.728 0.439 9.117 1.00 0.00 H new ATOM 0 HB THR A 58 6.291 -0.470 10.891 1.00 0.00 H new ATOM 0 HG1 THR A 58 8.139 0.266 9.121 1.00 0.00 H new ATOM 0 HG21 THR A 58 6.421 -2.732 9.917 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.855 -1.958 9.576 1.00 0.00 H new ATOM 0 HG23 THR A 58 6.098 -2.052 8.305 1.00 0.00 H new ATOM 842 N MET A 59 5.986 1.947 11.067 1.00 0.00 N ATOM 843 CA MET A 59 6.304 3.147 11.833 1.00 0.00 C ATOM 844 C MET A 59 7.392 2.862 12.862 1.00 0.00 C ATOM 845 O MET A 59 8.403 3.564 12.922 1.00 0.00 O ATOM 846 CB MET A 59 5.051 3.678 12.532 1.00 0.00 C ATOM 847 CG MET A 59 4.236 4.634 11.675 1.00 0.00 C ATOM 848 SD MET A 59 4.763 6.349 11.857 1.00 0.00 S ATOM 849 CE MET A 59 4.345 6.651 13.573 1.00 0.00 C ATOM 0 H MET A 59 5.609 1.179 11.623 1.00 0.00 H new ATOM 0 HA MET A 59 6.673 3.903 11.140 1.00 0.00 H new ATOM 0 HB2 MET A 59 4.422 2.836 12.821 1.00 0.00 H new ATOM 0 HB3 MET A 59 5.345 4.187 13.450 1.00 0.00 H new ATOM 0 HG2 MET A 59 4.321 4.341 10.629 1.00 0.00 H new ATOM 0 HG3 MET A 59 3.183 4.551 11.945 1.00 0.00 H new ATOM 0 HE1 MET A 59 4.132 7.711 13.714 1.00 0.00 H new ATOM 0 HE2 MET A 59 3.466 6.065 13.842 1.00 0.00 H new ATOM 0 HE3 MET A 59 5.182 6.362 14.208 1.00 0.00 H new ATOM 859 N PHE A 60 7.180 1.830 13.671 1.00 0.00 N ATOM 860 CA PHE A 60 8.144 1.454 14.700 1.00 0.00 C ATOM 861 C PHE A 60 9.420 0.901 14.073 1.00 0.00 C ATOM 862 O PHE A 60 10.485 1.518 14.125 1.00 0.00 O ATOM 863 CB PHE A 60 7.534 0.415 15.644 1.00 0.00 C ATOM 864 CG PHE A 60 6.957 1.009 16.896 1.00 0.00 C ATOM 865 CD1 PHE A 60 7.781 1.380 17.946 1.00 0.00 C ATOM 866 CD2 PHE A 60 5.590 1.195 17.024 1.00 0.00 C ATOM 867 CE1 PHE A 60 7.253 1.928 19.101 1.00 0.00 C ATOM 868 CE2 PHE A 60 5.056 1.742 18.176 1.00 0.00 C ATOM 869 CZ PHE A 60 5.888 2.107 19.216 1.00 0.00 C ATOM 0 H PHE A 60 6.350 1.239 13.635 1.00 0.00 H new ATOM 0 HA PHE A 60 8.398 2.348 15.270 1.00 0.00 H new ATOM 0 HB2 PHE A 60 6.751 -0.129 15.115 1.00 0.00 H new ATOM 0 HB3 PHE A 60 8.300 -0.312 15.916 1.00 0.00 H new ATOM 0 HD1 PHE A 60 8.849 1.240 17.862 1.00 0.00 H new ATOM 0 HD2 PHE A 60 4.934 0.909 16.215 1.00 0.00 H new ATOM 0 HE1 PHE A 60 7.907 2.215 19.911 1.00 0.00 H new ATOM 0 HE2 PHE A 60 3.989 1.884 18.262 1.00 0.00 H new ATOM 0 HZ PHE A 60 5.472 2.532 20.118 1.00 0.00 H new ATOM 879 N PRO A 61 9.314 -0.290 13.466 1.00 0.00 N ATOM 880 CA PRO A 61 10.449 -0.953 12.818 1.00 0.00 C ATOM 881 C PRO A 61 10.890 -0.235 11.547 1.00 0.00 C ATOM 882 O PRO A 61 11.925 -0.562 10.966 1.00 0.00 O ATOM 883 CB PRO A 61 9.905 -2.344 12.484 1.00 0.00 C ATOM 884 CG PRO A 61 8.430 -2.158 12.378 1.00 0.00 C ATOM 885 CD PRO A 61 8.076 -1.082 13.366 1.00 0.00 C ATOM 0 HA PRO A 61 11.331 -0.968 13.458 1.00 0.00 H new ATOM 0 HB2 PRO A 61 10.325 -2.720 11.551 1.00 0.00 H new ATOM 0 HB3 PRO A 61 10.158 -3.065 13.261 1.00 0.00 H new ATOM 0 HG2 PRO A 61 8.145 -1.868 11.367 1.00 0.00 H new ATOM 0 HG3 PRO A 61 7.903 -3.085 12.605 1.00 0.00 H new ATOM 0 HD2 PRO A 61 7.239 -0.477 13.018 1.00 0.00 H new ATOM 0 HD3 PRO A 61 7.788 -1.501 14.330 1.00 0.00 H new ATOM 893 N ARG A 62 10.099 0.744 11.120 1.00 0.00 N ATOM 894 CA ARG A 62 10.409 1.508 9.918 1.00 0.00 C ATOM 895 C ARG A 62 11.061 0.619 8.863 1.00 0.00 C ATOM 896 O ARG A 62 12.127 0.942 8.338 1.00 0.00 O ATOM 897 CB ARG A 62 11.333 2.679 10.255 1.00 0.00 C ATOM 898 CG ARG A 62 11.152 3.880 9.340 1.00 0.00 C ATOM 899 CD ARG A 62 11.774 3.637 7.974 1.00 0.00 C ATOM 900 NE ARG A 62 12.100 4.886 7.291 1.00 0.00 N ATOM 901 CZ ARG A 62 12.955 4.969 6.278 1.00 0.00 C ATOM 902 NH1 ARG A 62 13.565 3.880 5.831 1.00 0.00 N ATOM 903 NH2 ARG A 62 13.200 6.142 5.708 1.00 0.00 N ATOM 0 H ARG A 62 9.238 1.027 11.589 1.00 0.00 H new ATOM 0 HA ARG A 62 9.474 1.897 9.514 1.00 0.00 H new ATOM 0 HB2 ARG A 62 11.154 2.987 11.285 1.00 0.00 H new ATOM 0 HB3 ARG A 62 12.368 2.342 10.198 1.00 0.00 H new ATOM 0 HG2 ARG A 62 10.090 4.094 9.225 1.00 0.00 H new ATOM 0 HG3 ARG A 62 11.607 4.759 9.797 1.00 0.00 H new ATOM 0 HD2 ARG A 62 12.679 3.040 8.089 1.00 0.00 H new ATOM 0 HD3 ARG A 62 11.085 3.057 7.360 1.00 0.00 H new ATOM 0 HE ARG A 62 11.646 5.742 7.610 1.00 0.00 H new ATOM 0 HH11 ARG A 62 13.378 2.976 6.265 1.00 0.00 H new ATOM 0 HH12 ARG A 62 14.221 3.946 5.053 1.00 0.00 H new ATOM 0 HH21 ARG A 62 12.731 6.982 6.048 1.00 0.00 H new ATOM 0 HH22 ARG A 62 13.857 6.204 4.930 1.00 0.00 H new ATOM 917 N ARG A 63 10.414 -0.501 8.557 1.00 0.00 N ATOM 918 CA ARG A 63 10.932 -1.437 7.567 1.00 0.00 C ATOM 919 C ARG A 63 10.013 -1.505 6.350 1.00 0.00 C ATOM 920 O ARG A 63 8.809 -1.719 6.483 1.00 0.00 O ATOM 921 CB ARG A 63 11.087 -2.829 8.181 1.00 0.00 C ATOM 922 CG ARG A 63 12.190 -3.657 7.543 1.00 0.00 C ATOM 923 CD ARG A 63 11.896 -5.146 7.639 1.00 0.00 C ATOM 924 NE ARG A 63 12.961 -5.953 7.051 1.00 0.00 N ATOM 925 CZ ARG A 63 12.878 -7.268 6.881 1.00 0.00 C ATOM 926 NH1 ARG A 63 11.785 -7.920 7.252 1.00 0.00 N ATOM 927 NH2 ARG A 63 13.890 -7.934 6.338 1.00 0.00 N ATOM 0 H ARG A 63 9.530 -0.782 8.981 1.00 0.00 H new ATOM 0 HA ARG A 63 11.910 -1.080 7.243 1.00 0.00 H new ATOM 0 HB2 ARG A 63 11.292 -2.726 9.247 1.00 0.00 H new ATOM 0 HB3 ARG A 63 10.142 -3.365 8.088 1.00 0.00 H new ATOM 0 HG2 ARG A 63 12.300 -3.374 6.496 1.00 0.00 H new ATOM 0 HG3 ARG A 63 13.139 -3.440 8.033 1.00 0.00 H new ATOM 0 HD2 ARG A 63 11.767 -5.423 8.685 1.00 0.00 H new ATOM 0 HD3 ARG A 63 10.955 -5.363 7.133 1.00 0.00 H new ATOM 0 HE ARG A 63 13.815 -5.481 6.754 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.005 -7.412 7.669 1.00 0.00 H new ATOM 0 HH12 ARG A 63 11.724 -8.930 7.120 1.00 0.00 H new ATOM 0 HH21 ARG A 63 14.733 -7.436 6.051 1.00 0.00 H new ATOM 0 HH22 ARG A 63 13.825 -8.944 6.208 1.00 0.00 H new ATOM 941 N GLU A 64 10.591 -1.321 5.167 1.00 0.00 N ATOM 942 CA GLU A 64 9.823 -1.361 3.929 1.00 0.00 C ATOM 943 C GLU A 64 9.303 -2.770 3.655 1.00 0.00 C ATOM 944 O GLU A 64 10.024 -3.753 3.826 1.00 0.00 O ATOM 945 CB GLU A 64 10.681 -0.885 2.755 1.00 0.00 C ATOM 946 CG GLU A 64 10.568 0.605 2.482 1.00 0.00 C ATOM 947 CD GLU A 64 11.848 1.195 1.923 1.00 0.00 C ATOM 948 OE1 GLU A 64 12.322 0.702 0.879 1.00 0.00 O ATOM 949 OE2 GLU A 64 12.375 2.150 2.531 1.00 0.00 O ATOM 0 H GLU A 64 11.587 -1.143 5.040 1.00 0.00 H new ATOM 0 HA GLU A 64 8.969 -0.693 4.040 1.00 0.00 H new ATOM 0 HB2 GLU A 64 11.724 -1.131 2.955 1.00 0.00 H new ATOM 0 HB3 GLU A 64 10.391 -1.433 1.858 1.00 0.00 H new ATOM 0 HG2 GLU A 64 9.754 0.781 1.779 1.00 0.00 H new ATOM 0 HG3 GLU A 64 10.308 1.121 3.406 1.00 0.00 H new ATOM 956 N PHE A 65 8.047 -2.859 3.230 1.00 0.00 N ATOM 957 CA PHE A 65 7.430 -4.146 2.935 1.00 0.00 C ATOM 958 C PHE A 65 7.971 -4.722 1.630 1.00 0.00 C ATOM 959 O PHE A 65 8.334 -3.983 0.714 1.00 0.00 O ATOM 960 CB PHE A 65 5.909 -3.999 2.848 1.00 0.00 C ATOM 961 CG PHE A 65 5.254 -3.755 4.177 1.00 0.00 C ATOM 962 CD1 PHE A 65 4.951 -4.813 5.019 1.00 0.00 C ATOM 963 CD2 PHE A 65 4.941 -2.469 4.585 1.00 0.00 C ATOM 964 CE1 PHE A 65 4.347 -4.592 6.243 1.00 0.00 C ATOM 965 CE2 PHE A 65 4.337 -2.241 5.807 1.00 0.00 C ATOM 966 CZ PHE A 65 4.041 -3.304 6.638 1.00 0.00 C ATOM 0 H PHE A 65 7.437 -2.055 3.082 1.00 0.00 H new ATOM 0 HA PHE A 65 7.676 -4.832 3.745 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.669 -3.174 2.177 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.489 -4.902 2.405 1.00 0.00 H new ATOM 0 HD1 PHE A 65 5.189 -5.822 4.716 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.172 -1.634 3.940 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.115 -5.425 6.890 1.00 0.00 H new ATOM 0 HE2 PHE A 65 4.097 -1.233 6.112 1.00 0.00 H new ATOM 0 HZ PHE A 65 3.571 -3.129 7.595 1.00 0.00 H new ATOM 976 N THR A 66 8.025 -6.049 1.552 1.00 0.00 N ATOM 977 CA THR A 66 8.523 -6.725 0.361 1.00 0.00 C ATOM 978 C THR A 66 7.387 -7.378 -0.417 1.00 0.00 C ATOM 979 O THR A 66 6.387 -7.801 0.164 1.00 0.00 O ATOM 980 CB THR A 66 9.567 -7.799 0.721 1.00 0.00 C ATOM 981 OG1 THR A 66 10.037 -8.444 -0.468 1.00 0.00 O ATOM 982 CG2 THR A 66 8.974 -8.835 1.665 1.00 0.00 C ATOM 0 H THR A 66 7.730 -6.676 2.300 1.00 0.00 H new ATOM 0 HA THR A 66 8.994 -5.964 -0.261 1.00 0.00 H new ATOM 0 HB THR A 66 10.402 -7.309 1.222 1.00 0.00 H new ATOM 0 HG1 THR A 66 10.701 -9.124 -0.230 1.00 0.00 H new ATOM 0 HG21 THR A 66 9.730 -9.583 1.905 1.00 0.00 H new ATOM 0 HG22 THR A 66 8.644 -8.346 2.581 1.00 0.00 H new ATOM 0 HG23 THR A 66 8.123 -9.319 1.186 1.00 0.00 H new ATOM 990 N ARG A 67 7.546 -7.456 -1.734 1.00 0.00 N ATOM 991 CA ARG A 67 6.532 -8.057 -2.592 1.00 0.00 C ATOM 992 C ARG A 67 5.866 -9.242 -1.898 1.00 0.00 C ATOM 993 O ARG A 67 4.652 -9.420 -1.982 1.00 0.00 O ATOM 994 CB ARG A 67 7.155 -8.510 -3.914 1.00 0.00 C ATOM 995 CG ARG A 67 6.151 -8.640 -5.047 1.00 0.00 C ATOM 996 CD ARG A 67 6.810 -9.152 -6.319 1.00 0.00 C ATOM 997 NE ARG A 67 7.689 -8.153 -6.920 1.00 0.00 N ATOM 998 CZ ARG A 67 8.955 -7.975 -6.559 1.00 0.00 C ATOM 999 NH1 ARG A 67 9.487 -8.726 -5.604 1.00 0.00 N ATOM 1000 NH2 ARG A 67 9.692 -7.045 -7.153 1.00 0.00 N ATOM 0 H ARG A 67 8.367 -7.110 -2.230 1.00 0.00 H new ATOM 0 HA ARG A 67 5.771 -7.303 -2.797 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.928 -7.798 -4.204 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.647 -9.471 -3.764 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.352 -9.320 -4.751 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.690 -7.671 -5.239 1.00 0.00 H new ATOM 0 HD2 ARG A 67 7.384 -10.051 -6.093 1.00 0.00 H new ATOM 0 HD3 ARG A 67 6.041 -9.437 -7.037 1.00 0.00 H new ATOM 0 HE ARG A 67 7.310 -7.559 -7.658 1.00 0.00 H new ATOM 0 HH11 ARG A 67 8.924 -9.442 -5.145 1.00 0.00 H new ATOM 0 HH12 ARG A 67 10.459 -8.588 -5.328 1.00 0.00 H new ATOM 0 HH21 ARG A 67 9.287 -6.465 -7.888 1.00 0.00 H new ATOM 0 HH22 ARG A 67 10.664 -6.910 -6.875 1.00 0.00 H new ATOM 1014 N GLU A 68 6.671 -10.050 -1.215 1.00 0.00 N ATOM 1015 CA GLU A 68 6.159 -11.219 -0.509 1.00 0.00 C ATOM 1016 C GLU A 68 5.182 -10.807 0.588 1.00 0.00 C ATOM 1017 O GLU A 68 4.123 -11.413 0.751 1.00 0.00 O ATOM 1018 CB GLU A 68 7.312 -12.023 0.096 1.00 0.00 C ATOM 1019 CG GLU A 68 7.975 -12.972 -0.889 1.00 0.00 C ATOM 1020 CD GLU A 68 8.697 -12.243 -2.006 1.00 0.00 C ATOM 1021 OE1 GLU A 68 9.614 -11.452 -1.703 1.00 0.00 O ATOM 1022 OE2 GLU A 68 8.343 -12.465 -3.183 1.00 0.00 O ATOM 0 H GLU A 68 7.679 -9.917 -1.136 1.00 0.00 H new ATOM 0 HA GLU A 68 5.629 -11.843 -1.229 1.00 0.00 H new ATOM 0 HB2 GLU A 68 8.061 -11.333 0.483 1.00 0.00 H new ATOM 0 HB3 GLU A 68 6.938 -12.596 0.944 1.00 0.00 H new ATOM 0 HG2 GLU A 68 8.684 -13.606 -0.356 1.00 0.00 H new ATOM 0 HG3 GLU A 68 7.220 -13.630 -1.318 1.00 0.00 H new ATOM 1029 N ASP A 69 5.546 -9.773 1.338 1.00 0.00 N ATOM 1030 CA ASP A 69 4.702 -9.278 2.420 1.00 0.00 C ATOM 1031 C ASP A 69 3.267 -9.083 1.944 1.00 0.00 C ATOM 1032 O ASP A 69 2.319 -9.501 2.608 1.00 0.00 O ATOM 1033 CB ASP A 69 5.256 -7.961 2.966 1.00 0.00 C ATOM 1034 CG ASP A 69 6.456 -8.166 3.869 1.00 0.00 C ATOM 1035 OD1 ASP A 69 6.569 -9.257 4.466 1.00 0.00 O ATOM 1036 OD2 ASP A 69 7.283 -7.237 3.976 1.00 0.00 O ATOM 0 H ASP A 69 6.420 -9.261 1.217 1.00 0.00 H new ATOM 0 HA ASP A 69 4.703 -10.021 3.217 1.00 0.00 H new ATOM 0 HB2 ASP A 69 5.538 -7.316 2.134 1.00 0.00 H new ATOM 0 HB3 ASP A 69 4.473 -7.443 3.520 1.00 0.00 H new ATOM 1041 N TYR A 70 3.114 -8.443 0.789 1.00 0.00 N ATOM 1042 CA TYR A 70 1.794 -8.189 0.225 1.00 0.00 C ATOM 1043 C TYR A 70 1.054 -9.496 -0.041 1.00 0.00 C ATOM 1044 O TYR A 70 -0.176 -9.532 -0.076 1.00 0.00 O ATOM 1045 CB TYR A 70 1.916 -7.386 -1.071 1.00 0.00 C ATOM 1046 CG TYR A 70 2.274 -5.934 -0.852 1.00 0.00 C ATOM 1047 CD1 TYR A 70 1.440 -5.094 -0.124 1.00 0.00 C ATOM 1048 CD2 TYR A 70 3.447 -5.401 -1.374 1.00 0.00 C ATOM 1049 CE1 TYR A 70 1.763 -3.766 0.078 1.00 0.00 C ATOM 1050 CE2 TYR A 70 3.778 -4.074 -1.176 1.00 0.00 C ATOM 1051 CZ TYR A 70 2.934 -3.261 -0.449 1.00 0.00 C ATOM 1052 OH TYR A 70 3.260 -1.939 -0.251 1.00 0.00 O ATOM 0 H TYR A 70 3.888 -8.091 0.226 1.00 0.00 H new ATOM 0 HA TYR A 70 1.222 -7.610 0.951 1.00 0.00 H new ATOM 0 HB2 TYR A 70 2.674 -7.847 -1.704 1.00 0.00 H new ATOM 0 HB3 TYR A 70 0.972 -7.441 -1.613 1.00 0.00 H new ATOM 0 HD1 TYR A 70 0.523 -5.486 0.291 1.00 0.00 H new ATOM 0 HD2 TYR A 70 4.111 -6.035 -1.944 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.103 -3.127 0.645 1.00 0.00 H new ATOM 0 HE2 TYR A 70 4.693 -3.676 -1.589 1.00 0.00 H new ATOM 0 HH TYR A 70 4.116 -1.745 -0.686 1.00 0.00 H new ATOM 1062 N LYS A 71 1.813 -10.571 -0.227 1.00 0.00 N ATOM 1063 CA LYS A 71 1.233 -11.883 -0.489 1.00 0.00 C ATOM 1064 C LYS A 71 0.744 -12.529 0.804 1.00 0.00 C ATOM 1065 O LYS A 71 -0.170 -13.353 0.790 1.00 0.00 O ATOM 1066 CB LYS A 71 2.259 -12.791 -1.169 1.00 0.00 C ATOM 1067 CG LYS A 71 2.796 -12.231 -2.475 1.00 0.00 C ATOM 1068 CD LYS A 71 1.800 -12.407 -3.609 1.00 0.00 C ATOM 1069 CE LYS A 71 2.009 -13.727 -4.335 1.00 0.00 C ATOM 1070 NZ LYS A 71 1.203 -14.825 -3.733 1.00 0.00 N ATOM 0 H LYS A 71 2.833 -10.559 -0.201 1.00 0.00 H new ATOM 0 HA LYS A 71 0.379 -11.749 -1.154 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.092 -12.960 -0.486 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.802 -13.762 -1.360 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.024 -11.172 -2.351 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.730 -12.731 -2.729 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.785 -12.365 -3.213 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.901 -11.582 -4.315 1.00 0.00 H new ATOM 0 HE2 LYS A 71 1.738 -13.611 -5.384 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.065 -13.994 -4.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 0.677 -15.320 -4.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.835 -15.497 -3.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 0.533 -14.427 -3.044 1.00 0.00 H new ATOM 1084 N ARG A 72 1.359 -12.148 1.919 1.00 0.00 N ATOM 1085 CA ARG A 72 0.986 -12.691 3.220 1.00 0.00 C ATOM 1086 C ARG A 72 -0.200 -11.931 3.806 1.00 0.00 C ATOM 1087 O ARG A 72 -0.200 -10.701 3.855 1.00 0.00 O ATOM 1088 CB ARG A 72 2.173 -12.625 4.183 1.00 0.00 C ATOM 1089 CG ARG A 72 3.394 -13.389 3.697 1.00 0.00 C ATOM 1090 CD ARG A 72 4.683 -12.761 4.207 1.00 0.00 C ATOM 1091 NE ARG A 72 5.741 -13.752 4.383 1.00 0.00 N ATOM 1092 CZ ARG A 72 7.036 -13.456 4.360 1.00 0.00 C ATOM 1093 NH1 ARG A 72 7.430 -12.204 4.170 1.00 0.00 N ATOM 1094 NH2 ARG A 72 7.940 -14.413 4.529 1.00 0.00 N ATOM 0 H ARG A 72 2.117 -11.466 1.948 1.00 0.00 H new ATOM 0 HA ARG A 72 0.696 -13.733 3.082 1.00 0.00 H new ATOM 0 HB2 ARG A 72 2.446 -11.581 4.339 1.00 0.00 H new ATOM 0 HB3 ARG A 72 1.867 -13.023 5.151 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.334 -14.424 4.033 1.00 0.00 H new ATOM 0 HG3 ARG A 72 3.403 -13.408 2.607 1.00 0.00 H new ATOM 0 HD2 ARG A 72 5.016 -11.996 3.506 1.00 0.00 H new ATOM 0 HD3 ARG A 72 4.492 -12.262 5.157 1.00 0.00 H new ATOM 0 HE ARG A 72 5.471 -14.724 4.532 1.00 0.00 H new ATOM 0 HH11 ARG A 72 6.738 -11.466 4.041 1.00 0.00 H new ATOM 0 HH12 ARG A 72 8.425 -11.979 4.153 1.00 0.00 H new ATOM 0 HH21 ARG A 72 7.641 -15.377 4.677 1.00 0.00 H new ATOM 0 HH22 ARG A 72 8.934 -14.185 4.511 1.00 0.00 H new ATOM 1108 N ARG A 73 -1.211 -12.673 4.248 1.00 0.00 N ATOM 1109 CA ARG A 73 -2.404 -12.069 4.829 1.00 0.00 C ATOM 1110 C ARG A 73 -2.031 -11.038 5.890 1.00 0.00 C ATOM 1111 O ARG A 73 -0.989 -11.148 6.538 1.00 0.00 O ATOM 1112 CB ARG A 73 -3.300 -13.147 5.443 1.00 0.00 C ATOM 1113 CG ARG A 73 -3.762 -14.196 4.444 1.00 0.00 C ATOM 1114 CD ARG A 73 -5.004 -14.923 4.935 1.00 0.00 C ATOM 1115 NE ARG A 73 -5.214 -16.184 4.229 1.00 0.00 N ATOM 1116 CZ ARG A 73 -5.822 -16.275 3.052 1.00 0.00 C ATOM 1117 NH1 ARG A 73 -6.276 -15.184 2.450 1.00 0.00 N ATOM 1118 NH2 ARG A 73 -5.976 -17.459 2.473 1.00 0.00 N ATOM 0 H ARG A 73 -1.227 -13.692 4.215 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.949 -11.563 4.032 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -2.759 -13.640 6.251 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -4.174 -12.671 5.888 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.972 -13.720 3.486 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.961 -14.916 4.274 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -4.912 -15.117 6.004 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -5.876 -14.283 4.801 1.00 0.00 H new ATOM 0 HE ARG A 73 -4.875 -17.042 4.664 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -6.159 -14.272 2.891 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -6.743 -15.257 1.546 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -5.627 -18.300 2.932 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -6.443 -17.528 1.569 1.00 0.00 H new ATOM 1132 N LEU A 74 -2.887 -10.037 6.063 1.00 0.00 N ATOM 1133 CA LEU A 74 -2.647 -8.986 7.045 1.00 0.00 C ATOM 1134 C LEU A 74 -2.313 -9.581 8.409 1.00 0.00 C ATOM 1135 O LEU A 74 -1.287 -9.252 9.007 1.00 0.00 O ATOM 1136 CB LEU A 74 -3.873 -8.078 7.159 1.00 0.00 C ATOM 1137 CG LEU A 74 -3.977 -6.957 6.124 1.00 0.00 C ATOM 1138 CD1 LEU A 74 -5.418 -6.493 5.983 1.00 0.00 C ATOM 1139 CD2 LEU A 74 -3.074 -5.793 6.506 1.00 0.00 C ATOM 0 H LEU A 74 -3.754 -9.931 5.536 1.00 0.00 H new ATOM 0 HA LEU A 74 -1.795 -8.396 6.708 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.767 -8.697 7.085 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.877 -7.630 8.152 1.00 0.00 H new ATOM 0 HG LEU A 74 -3.647 -7.346 5.161 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.473 -5.695 5.242 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -6.040 -7.329 5.662 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -5.776 -6.122 6.943 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -3.161 -5.005 5.758 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -3.373 -5.405 7.479 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -2.040 -6.135 6.554 1.00 0.00 H new ATOM 1151 N LEU A 75 -3.182 -10.460 8.894 1.00 0.00 N ATOM 1152 CA LEU A 75 -2.978 -11.104 10.187 1.00 0.00 C ATOM 1153 C LEU A 75 -1.627 -11.811 10.236 1.00 0.00 C ATOM 1154 O LEU A 75 -1.070 -12.032 11.312 1.00 0.00 O ATOM 1155 CB LEU A 75 -4.101 -12.105 10.464 1.00 0.00 C ATOM 1156 CG LEU A 75 -3.867 -13.531 9.963 1.00 0.00 C ATOM 1157 CD1 LEU A 75 -5.005 -14.442 10.395 1.00 0.00 C ATOM 1158 CD2 LEU A 75 -3.716 -13.546 8.448 1.00 0.00 C ATOM 0 H LEU A 75 -4.035 -10.743 8.412 1.00 0.00 H new ATOM 0 HA LEU A 75 -2.991 -10.331 10.956 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.270 -12.142 11.540 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.017 -11.727 10.010 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.943 -13.903 10.405 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.821 -15.452 10.029 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.067 -14.456 11.483 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -5.944 -14.072 9.983 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.550 -14.569 8.109 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -4.623 -13.154 7.988 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -2.866 -12.926 8.161 1.00 0.00 H new ATOM 1170 N ASP A 76 -1.106 -12.162 9.066 1.00 0.00 N ATOM 1171 CA ASP A 76 0.181 -12.841 8.975 1.00 0.00 C ATOM 1172 C ASP A 76 1.323 -11.891 9.322 1.00 0.00 C ATOM 1173 O ASP A 76 2.358 -12.310 9.842 1.00 0.00 O ATOM 1174 CB ASP A 76 0.384 -13.409 7.569 1.00 0.00 C ATOM 1175 CG ASP A 76 1.260 -14.646 7.565 1.00 0.00 C ATOM 1176 OD1 ASP A 76 2.495 -14.497 7.459 1.00 0.00 O ATOM 1177 OD2 ASP A 76 0.711 -15.763 7.667 1.00 0.00 O ATOM 0 H ASP A 76 -1.555 -11.988 8.167 1.00 0.00 H new ATOM 0 HA ASP A 76 0.183 -13.660 9.694 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.586 -13.653 7.135 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.834 -12.646 6.934 1.00 0.00 H new ATOM 1182 N LEU A 77 1.128 -10.609 9.032 1.00 0.00 N ATOM 1183 CA LEU A 77 2.142 -9.598 9.313 1.00 0.00 C ATOM 1184 C LEU A 77 1.861 -8.899 10.639 1.00 0.00 C ATOM 1185 O LEU A 77 2.116 -7.705 10.788 1.00 0.00 O ATOM 1186 CB LEU A 77 2.191 -8.570 8.182 1.00 0.00 C ATOM 1187 CG LEU A 77 2.601 -9.102 6.808 1.00 0.00 C ATOM 1188 CD1 LEU A 77 1.964 -8.274 5.703 1.00 0.00 C ATOM 1189 CD2 LEU A 77 4.116 -9.107 6.667 1.00 0.00 C ATOM 0 H LEU A 77 0.277 -10.245 8.603 1.00 0.00 H new ATOM 0 HA LEU A 77 3.108 -10.097 9.385 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.206 -8.111 8.093 1.00 0.00 H new ATOM 0 HB3 LEU A 77 2.886 -7.780 8.466 1.00 0.00 H new ATOM 0 HG LEU A 77 2.245 -10.128 6.717 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.267 -8.667 4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 77 0.879 -8.323 5.791 1.00 0.00 H new ATOM 0 HD13 LEU A 77 2.289 -7.237 5.792 1.00 0.00 H new ATOM 0 HD21 LEU A 77 4.389 -9.489 5.683 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.495 -8.091 6.780 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.551 -9.745 7.437 1.00 0.00 H new ATOM 1201 N GLU A 78 1.336 -9.653 11.600 1.00 0.00 N ATOM 1202 CA GLU A 78 1.022 -9.105 12.914 1.00 0.00 C ATOM 1203 C GLU A 78 0.267 -7.785 12.787 1.00 0.00 C ATOM 1204 O GLU A 78 0.556 -6.821 13.497 1.00 0.00 O ATOM 1205 CB GLU A 78 2.304 -8.897 13.724 1.00 0.00 C ATOM 1206 CG GLU A 78 3.337 -8.036 13.017 1.00 0.00 C ATOM 1207 CD GLU A 78 4.563 -7.776 13.871 1.00 0.00 C ATOM 1208 OE1 GLU A 78 5.308 -8.739 14.147 1.00 0.00 O ATOM 1209 OE2 GLU A 78 4.776 -6.610 14.261 1.00 0.00 O ATOM 0 H GLU A 78 1.119 -10.644 11.493 1.00 0.00 H new ATOM 0 HA GLU A 78 0.384 -9.819 13.434 1.00 0.00 H new ATOM 0 HB2 GLU A 78 2.050 -8.435 14.678 1.00 0.00 H new ATOM 0 HB3 GLU A 78 2.745 -9.869 13.947 1.00 0.00 H new ATOM 0 HG2 GLU A 78 3.641 -8.526 12.092 1.00 0.00 H new ATOM 0 HG3 GLU A 78 2.883 -7.084 12.740 1.00 0.00 H new ATOM 1216 N LEU A 79 -0.701 -7.749 11.878 1.00 0.00 N ATOM 1217 CA LEU A 79 -1.498 -6.547 11.657 1.00 0.00 C ATOM 1218 C LEU A 79 -2.963 -6.794 12.002 1.00 0.00 C ATOM 1219 O LEU A 79 -3.767 -5.864 12.039 1.00 0.00 O ATOM 1220 CB LEU A 79 -1.374 -6.091 10.202 1.00 0.00 C ATOM 1221 CG LEU A 79 0.045 -6.024 9.638 1.00 0.00 C ATOM 1222 CD1 LEU A 79 0.039 -5.404 8.249 1.00 0.00 C ATOM 1223 CD2 LEU A 79 0.953 -5.237 10.571 1.00 0.00 C ATOM 0 H LEU A 79 -0.953 -8.538 11.282 1.00 0.00 H new ATOM 0 HA LEU A 79 -1.118 -5.762 12.311 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -1.959 -6.767 9.579 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -1.826 -5.103 10.112 1.00 0.00 H new ATOM 0 HG LEU A 79 0.432 -7.040 9.558 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.058 -5.365 7.864 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.578 -6.008 7.584 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.368 -4.394 8.303 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.959 -5.200 10.154 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.569 -4.223 10.683 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.983 -5.724 11.546 1.00 0.00 H new ATOM 1235 N ALA A 80 -3.301 -8.054 12.256 1.00 0.00 N ATOM 1236 CA ALA A 80 -4.668 -8.423 12.602 1.00 0.00 C ATOM 1237 C ALA A 80 -5.300 -7.385 13.523 1.00 0.00 C ATOM 1238 O ALA A 80 -6.343 -6.805 13.221 1.00 0.00 O ATOM 1239 CB ALA A 80 -4.695 -9.797 13.255 1.00 0.00 C ATOM 0 H ALA A 80 -2.647 -8.836 12.229 1.00 0.00 H new ATOM 0 HA ALA A 80 -5.252 -8.459 11.682 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -5.722 -10.059 13.508 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -4.291 -10.537 12.563 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -4.091 -9.781 14.162 1.00 0.00 H new ATOM 1245 N PRO A 81 -4.657 -7.145 14.675 1.00 0.00 N ATOM 1246 CA PRO A 81 -5.138 -6.176 15.664 1.00 0.00 C ATOM 1247 C PRO A 81 -5.007 -4.737 15.177 1.00 0.00 C ATOM 1248 O PRO A 81 -5.917 -4.201 14.544 1.00 0.00 O ATOM 1249 CB PRO A 81 -4.227 -6.418 16.870 1.00 0.00 C ATOM 1250 CG PRO A 81 -2.980 -6.992 16.294 1.00 0.00 C ATOM 1251 CD PRO A 81 -3.409 -7.801 15.101 1.00 0.00 C ATOM 0 HA PRO A 81 -6.198 -6.307 15.881 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -4.025 -5.491 17.406 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -4.686 -7.104 17.582 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -2.286 -6.204 16.002 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -2.464 -7.616 17.024 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -2.657 -7.784 14.312 1.00 0.00 H new ATOM 0 HD3 PRO A 81 -3.573 -8.846 15.362 1.00 0.00 H new ATOM 1259 N SER A 82 -3.870 -4.117 15.476 1.00 0.00 N ATOM 1260 CA SER A 82 -3.622 -2.739 15.071 1.00 0.00 C ATOM 1261 C SER A 82 -2.418 -2.655 14.138 1.00 0.00 C ATOM 1262 O SER A 82 -1.428 -3.363 14.320 1.00 0.00 O ATOM 1263 CB SER A 82 -3.391 -1.858 16.301 1.00 0.00 C ATOM 1264 OG SER A 82 -2.174 -2.191 16.946 1.00 0.00 O ATOM 0 H SER A 82 -3.106 -4.547 15.997 1.00 0.00 H new ATOM 0 HA SER A 82 -4.500 -2.380 14.535 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.373 -0.810 16.003 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.220 -1.977 16.998 1.00 0.00 H new ATOM 0 HG SER A 82 -2.049 -1.613 17.727 1.00 0.00 H new ATOM 1270 N ALA A 83 -2.511 -1.783 13.139 1.00 0.00 N ATOM 1271 CA ALA A 83 -1.429 -1.605 12.178 1.00 0.00 C ATOM 1272 C ALA A 83 -1.310 -0.146 11.751 1.00 0.00 C ATOM 1273 O ALA A 83 -2.312 0.560 11.633 1.00 0.00 O ATOM 1274 CB ALA A 83 -1.649 -2.496 10.965 1.00 0.00 C ATOM 0 H ALA A 83 -3.324 -1.189 12.974 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.495 -1.892 12.661 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.834 -2.353 10.256 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -1.677 -3.539 11.280 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -2.594 -2.235 10.489 1.00 0.00 H new ATOM 1280 N SER A 84 -0.079 0.300 11.521 1.00 0.00 N ATOM 1281 CA SER A 84 0.171 1.677 11.111 1.00 0.00 C ATOM 1282 C SER A 84 1.123 1.725 9.920 1.00 0.00 C ATOM 1283 O SER A 84 2.338 1.609 10.077 1.00 0.00 O ATOM 1284 CB SER A 84 0.752 2.481 12.276 1.00 0.00 C ATOM 1285 OG SER A 84 -0.183 2.593 13.335 1.00 0.00 O ATOM 0 H SER A 84 0.761 -0.272 11.612 1.00 0.00 H new ATOM 0 HA SER A 84 -0.779 2.119 10.812 1.00 0.00 H new ATOM 0 HB2 SER A 84 1.660 1.998 12.638 1.00 0.00 H new ATOM 0 HB3 SER A 84 1.035 3.475 11.930 1.00 0.00 H new ATOM 0 HG SER A 84 0.213 3.109 14.068 1.00 0.00 H new ATOM 1291 N VAL A 85 0.561 1.897 8.728 1.00 0.00 N ATOM 1292 CA VAL A 85 1.358 1.962 7.509 1.00 0.00 C ATOM 1293 C VAL A 85 1.497 3.399 7.019 1.00 0.00 C ATOM 1294 O VAL A 85 0.518 4.025 6.614 1.00 0.00 O ATOM 1295 CB VAL A 85 0.740 1.106 6.388 1.00 0.00 C ATOM 1296 CG1 VAL A 85 1.040 -0.368 6.614 1.00 0.00 C ATOM 1297 CG2 VAL A 85 -0.759 1.346 6.300 1.00 0.00 C ATOM 0 H VAL A 85 -0.444 1.994 8.581 1.00 0.00 H new ATOM 0 HA VAL A 85 2.344 1.568 7.754 1.00 0.00 H new ATOM 0 HB VAL A 85 1.189 1.402 5.440 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.595 -0.957 5.812 1.00 0.00 H new ATOM 0 HG12 VAL A 85 2.119 -0.523 6.622 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.621 -0.682 7.570 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.179 0.733 5.503 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.226 1.079 7.248 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -0.947 2.398 6.086 1.00 0.00 H new ATOM 1307 N VAL A 86 2.721 3.916 7.057 1.00 0.00 N ATOM 1308 CA VAL A 86 2.989 5.279 6.615 1.00 0.00 C ATOM 1309 C VAL A 86 3.041 5.363 5.093 1.00 0.00 C ATOM 1310 O VAL A 86 3.604 4.491 4.431 1.00 0.00 O ATOM 1311 CB VAL A 86 4.317 5.805 7.192 1.00 0.00 C ATOM 1312 CG1 VAL A 86 4.089 6.454 8.549 1.00 0.00 C ATOM 1313 CG2 VAL A 86 5.336 4.681 7.294 1.00 0.00 C ATOM 0 H VAL A 86 3.543 3.411 7.389 1.00 0.00 H new ATOM 0 HA VAL A 86 2.171 5.898 6.983 1.00 0.00 H new ATOM 0 HB VAL A 86 4.713 6.562 6.515 1.00 0.00 H new ATOM 0 HG11 VAL A 86 5.038 6.820 8.941 1.00 0.00 H new ATOM 0 HG12 VAL A 86 3.395 7.288 8.442 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.670 5.720 9.238 1.00 0.00 H new ATOM 0 HG21 VAL A 86 6.268 5.071 7.703 1.00 0.00 H new ATOM 0 HG22 VAL A 86 4.951 3.899 7.949 1.00 0.00 H new ATOM 0 HG23 VAL A 86 5.521 4.266 6.303 1.00 0.00 H new ATOM 1323 N LEU A 87 2.450 6.419 4.545 1.00 0.00 N ATOM 1324 CA LEU A 87 2.428 6.618 3.100 1.00 0.00 C ATOM 1325 C LEU A 87 3.604 7.479 2.651 1.00 0.00 C ATOM 1326 O LEU A 87 3.730 8.636 3.055 1.00 0.00 O ATOM 1327 CB LEU A 87 1.112 7.272 2.675 1.00 0.00 C ATOM 1328 CG LEU A 87 0.931 7.503 1.174 1.00 0.00 C ATOM 1329 CD1 LEU A 87 -0.542 7.442 0.799 1.00 0.00 C ATOM 1330 CD2 LEU A 87 1.532 8.840 0.765 1.00 0.00 C ATOM 0 H LEU A 87 1.980 7.150 5.079 1.00 0.00 H new ATOM 0 HA LEU A 87 2.513 5.642 2.623 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.290 6.650 3.028 1.00 0.00 H new ATOM 0 HB3 LEU A 87 1.026 8.233 3.183 1.00 0.00 H new ATOM 0 HG LEU A 87 1.455 6.712 0.637 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -0.652 7.609 -0.273 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.943 6.462 1.057 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.088 8.212 1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 87 1.394 8.988 -0.306 1.00 0.00 H new ATOM 0 HD22 LEU A 87 1.036 9.644 1.309 1.00 0.00 H new ATOM 0 HD23 LEU A 87 2.597 8.847 0.998 1.00 0.00 H new ATOM 1342 N LEU A 88 4.463 6.909 1.813 1.00 0.00 N ATOM 1343 CA LEU A 88 5.628 7.625 1.307 1.00 0.00 C ATOM 1344 C LEU A 88 5.381 8.136 -0.109 1.00 0.00 C ATOM 1345 O LEU A 88 5.227 7.364 -1.056 1.00 0.00 O ATOM 1346 CB LEU A 88 6.858 6.715 1.325 1.00 0.00 C ATOM 1347 CG LEU A 88 7.227 6.112 2.682 1.00 0.00 C ATOM 1348 CD1 LEU A 88 8.107 4.886 2.499 1.00 0.00 C ATOM 1349 CD2 LEU A 88 7.924 7.147 3.553 1.00 0.00 C ATOM 0 H LEU A 88 4.374 5.953 1.470 1.00 0.00 H new ATOM 0 HA LEU A 88 5.807 8.482 1.957 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.693 5.900 0.621 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.712 7.285 0.959 1.00 0.00 H new ATOM 0 HG LEU A 88 6.310 5.803 3.183 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.360 4.470 3.475 1.00 0.00 H new ATOM 0 HD12 LEU A 88 7.572 4.138 1.914 1.00 0.00 H new ATOM 0 HD13 LEU A 88 9.021 5.169 1.978 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.179 6.701 4.514 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.834 7.486 3.057 1.00 0.00 H new ATOM 0 HD23 LEU A 88 7.259 7.996 3.712 1.00 0.00 H new ATOM 1361 N PRO A 89 5.345 9.468 -0.260 1.00 0.00 N ATOM 1362 CA PRO A 89 5.120 10.112 -1.557 1.00 0.00 C ATOM 1363 C PRO A 89 6.303 9.940 -2.503 1.00 0.00 C ATOM 1364 O PRO A 89 7.459 10.033 -2.090 1.00 0.00 O ATOM 1365 CB PRO A 89 4.936 11.588 -1.193 1.00 0.00 C ATOM 1366 CG PRO A 89 5.667 11.754 0.094 1.00 0.00 C ATOM 1367 CD PRO A 89 5.520 10.448 0.825 1.00 0.00 C ATOM 0 HA PRO A 89 4.270 9.680 -2.085 1.00 0.00 H new ATOM 0 HB2 PRO A 89 5.342 12.240 -1.966 1.00 0.00 H new ATOM 0 HB3 PRO A 89 3.881 11.841 -1.085 1.00 0.00 H new ATOM 0 HG2 PRO A 89 6.717 11.987 -0.081 1.00 0.00 H new ATOM 0 HG3 PRO A 89 5.251 12.576 0.676 1.00 0.00 H new ATOM 0 HD2 PRO A 89 6.399 10.225 1.430 1.00 0.00 H new ATOM 0 HD3 PRO A 89 4.663 10.459 1.499 1.00 0.00 H new ATOM 1375 N ALA A 90 6.007 9.688 -3.774 1.00 0.00 N ATOM 1376 CA ALA A 90 7.047 9.505 -4.778 1.00 0.00 C ATOM 1377 C ALA A 90 7.349 10.814 -5.501 1.00 0.00 C ATOM 1378 O ALA A 90 8.509 11.181 -5.683 1.00 0.00 O ATOM 1379 CB ALA A 90 6.635 8.433 -5.776 1.00 0.00 C ATOM 0 H ALA A 90 5.056 9.606 -4.132 1.00 0.00 H new ATOM 0 HA ALA A 90 7.955 9.183 -4.269 1.00 0.00 H new ATOM 0 HB1 ALA A 90 7.421 8.307 -6.520 1.00 0.00 H new ATOM 0 HB2 ALA A 90 6.476 7.490 -5.253 1.00 0.00 H new ATOM 0 HB3 ALA A 90 5.711 8.733 -6.271 1.00 0.00 H new ATOM 1385 N GLY A 91 6.296 11.515 -5.911 1.00 0.00 N ATOM 1386 CA GLY A 91 6.470 12.775 -6.610 1.00 0.00 C ATOM 1387 C GLY A 91 5.327 13.073 -7.561 1.00 0.00 C ATOM 1388 O GLY A 91 4.164 13.093 -7.157 1.00 0.00 O ATOM 0 H GLY A 91 5.326 11.233 -5.772 1.00 0.00 H new ATOM 0 HA2 GLY A 91 6.553 13.582 -5.882 1.00 0.00 H new ATOM 0 HA3 GLY A 91 7.406 12.751 -7.168 1.00 0.00 H new ATOM 1392 N ARG A 92 5.659 13.306 -8.826 1.00 0.00 N ATOM 1393 CA ARG A 92 4.652 13.607 -9.837 1.00 0.00 C ATOM 1394 C ARG A 92 3.869 12.354 -10.215 1.00 0.00 C ATOM 1395 O ARG A 92 4.430 11.273 -10.399 1.00 0.00 O ATOM 1396 CB ARG A 92 5.310 14.205 -11.081 1.00 0.00 C ATOM 1397 CG ARG A 92 6.325 13.283 -11.736 1.00 0.00 C ATOM 1398 CD ARG A 92 7.037 13.968 -12.892 1.00 0.00 C ATOM 1399 NE ARG A 92 8.395 13.463 -13.075 1.00 0.00 N ATOM 1400 CZ ARG A 92 9.445 13.914 -12.399 1.00 0.00 C ATOM 1401 NH1 ARG A 92 9.294 14.875 -11.498 1.00 0.00 N ATOM 1402 NH2 ARG A 92 10.649 13.403 -12.622 1.00 0.00 N ATOM 0 H ARG A 92 6.617 13.292 -9.176 1.00 0.00 H new ATOM 0 HA ARG A 92 3.958 14.335 -9.416 1.00 0.00 H new ATOM 0 HB2 ARG A 92 4.536 14.454 -11.807 1.00 0.00 H new ATOM 0 HB3 ARG A 92 5.803 15.138 -10.808 1.00 0.00 H new ATOM 0 HG2 ARG A 92 7.057 12.962 -10.995 1.00 0.00 H new ATOM 0 HG3 ARG A 92 5.823 12.386 -12.097 1.00 0.00 H new ATOM 0 HD2 ARG A 92 6.467 13.817 -13.809 1.00 0.00 H new ATOM 0 HD3 ARG A 92 7.071 15.042 -12.711 1.00 0.00 H new ATOM 0 HE ARG A 92 8.545 12.723 -13.760 1.00 0.00 H new ATOM 0 HH11 ARG A 92 8.370 15.269 -11.323 1.00 0.00 H new ATOM 0 HH12 ARG A 92 10.102 15.220 -10.980 1.00 0.00 H new ATOM 0 HH21 ARG A 92 10.769 12.663 -13.313 1.00 0.00 H new ATOM 0 HH22 ARG A 92 11.455 13.750 -12.102 1.00 0.00 H new ATOM 1416 N PRO A 93 2.541 12.498 -10.334 1.00 0.00 N ATOM 1417 CA PRO A 93 1.653 11.388 -10.691 1.00 0.00 C ATOM 1418 C PRO A 93 1.833 10.945 -12.139 1.00 0.00 C ATOM 1419 O PRO A 93 2.009 9.759 -12.418 1.00 0.00 O ATOM 1420 CB PRO A 93 0.253 11.972 -10.481 1.00 0.00 C ATOM 1421 CG PRO A 93 0.427 13.442 -10.646 1.00 0.00 C ATOM 1422 CD PRO A 93 1.804 13.757 -10.130 1.00 0.00 C ATOM 0 HA PRO A 93 1.853 10.498 -10.094 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -0.455 11.573 -11.207 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -0.134 11.728 -9.492 1.00 0.00 H new ATOM 0 HG2 PRO A 93 0.327 13.732 -11.692 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -0.333 13.990 -10.089 1.00 0.00 H new ATOM 0 HD2 PRO A 93 2.259 14.582 -10.677 1.00 0.00 H new ATOM 0 HD3 PRO A 93 1.783 14.045 -9.079 1.00 0.00 H new ATOM 1430 N ALA A 94 1.787 11.905 -13.057 1.00 0.00 N ATOM 1431 CA ALA A 94 1.948 11.613 -14.476 1.00 0.00 C ATOM 1432 C ALA A 94 1.031 10.474 -14.910 1.00 0.00 C ATOM 1433 O ALA A 94 1.433 9.595 -15.674 1.00 0.00 O ATOM 1434 CB ALA A 94 3.399 11.272 -14.784 1.00 0.00 C ATOM 0 H ALA A 94 1.640 12.891 -12.843 1.00 0.00 H new ATOM 0 HA ALA A 94 1.669 12.504 -15.039 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.504 11.056 -15.847 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.035 12.117 -14.521 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.698 10.398 -14.205 1.00 0.00 H new ATOM 1440 N THR A 95 -0.203 10.493 -14.416 1.00 0.00 N ATOM 1441 CA THR A 95 -1.176 9.461 -14.751 1.00 0.00 C ATOM 1442 C THR A 95 -2.570 10.054 -14.921 1.00 0.00 C ATOM 1443 O THR A 95 -2.807 11.213 -14.583 1.00 0.00 O ATOM 1444 CB THR A 95 -1.226 8.364 -13.671 1.00 0.00 C ATOM 1445 OG1 THR A 95 -1.430 8.954 -12.382 1.00 0.00 O ATOM 1446 CG2 THR A 95 0.061 7.552 -13.664 1.00 0.00 C ATOM 0 H THR A 95 -0.552 11.212 -13.782 1.00 0.00 H new ATOM 0 HA THR A 95 -0.855 9.018 -15.694 1.00 0.00 H new ATOM 0 HB THR A 95 -2.057 7.697 -13.901 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.462 8.250 -11.701 1.00 0.00 H new ATOM 0 HG21 THR A 95 0.002 6.784 -12.893 1.00 0.00 H new ATOM 0 HG22 THR A 95 0.199 7.080 -14.637 1.00 0.00 H new ATOM 0 HG23 THR A 95 0.905 8.210 -13.457 1.00 0.00 H new ATOM 1454 N SER A 96 -3.489 9.251 -15.447 1.00 0.00 N ATOM 1455 CA SER A 96 -4.860 9.698 -15.665 1.00 0.00 C ATOM 1456 C SER A 96 -5.856 8.626 -15.234 1.00 0.00 C ATOM 1457 O SER A 96 -5.552 7.433 -15.263 1.00 0.00 O ATOM 1458 CB SER A 96 -5.077 10.049 -17.138 1.00 0.00 C ATOM 1459 OG SER A 96 -4.523 11.316 -17.448 1.00 0.00 O ATOM 0 H SER A 96 -3.309 8.288 -15.730 1.00 0.00 H new ATOM 0 HA SER A 96 -5.026 10.589 -15.059 1.00 0.00 H new ATOM 0 HB2 SER A 96 -4.621 9.285 -17.768 1.00 0.00 H new ATOM 0 HB3 SER A 96 -6.144 10.051 -17.361 1.00 0.00 H new ATOM 0 HG SER A 96 -4.674 11.516 -18.396 1.00 0.00 H new ATOM 1465 N ILE A 97 -7.047 9.060 -14.835 1.00 0.00 N ATOM 1466 CA ILE A 97 -8.089 8.138 -14.399 1.00 0.00 C ATOM 1467 C ILE A 97 -9.194 8.024 -15.443 1.00 0.00 C ATOM 1468 O ILE A 97 -9.789 9.025 -15.845 1.00 0.00 O ATOM 1469 CB ILE A 97 -8.707 8.580 -13.059 1.00 0.00 C ATOM 1470 CG1 ILE A 97 -7.628 8.660 -11.977 1.00 0.00 C ATOM 1471 CG2 ILE A 97 -9.812 7.621 -12.643 1.00 0.00 C ATOM 1472 CD1 ILE A 97 -8.053 9.447 -10.757 1.00 0.00 C ATOM 0 H ILE A 97 -7.314 10.044 -14.805 1.00 0.00 H new ATOM 0 HA ILE A 97 -7.615 7.165 -14.268 1.00 0.00 H new ATOM 0 HB ILE A 97 -9.142 9.571 -13.186 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -7.356 7.650 -11.671 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -6.733 9.117 -12.400 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -10.239 7.947 -11.694 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -10.590 7.610 -13.406 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -9.400 6.618 -12.530 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -7.239 9.462 -10.032 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -8.297 10.468 -11.050 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -8.929 8.979 -10.309 1.00 0.00 H new ATOM 1484 N VAL A 98 -9.466 6.798 -15.877 1.00 0.00 N ATOM 1485 CA VAL A 98 -10.503 6.552 -16.873 1.00 0.00 C ATOM 1486 C VAL A 98 -11.711 5.861 -16.249 1.00 0.00 C ATOM 1487 O VAL A 98 -11.583 4.808 -15.623 1.00 0.00 O ATOM 1488 CB VAL A 98 -9.974 5.688 -18.033 1.00 0.00 C ATOM 1489 CG1 VAL A 98 -11.082 5.402 -19.034 1.00 0.00 C ATOM 1490 CG2 VAL A 98 -8.795 6.371 -18.710 1.00 0.00 C ATOM 0 H VAL A 98 -8.983 5.959 -15.555 1.00 0.00 H new ATOM 0 HA VAL A 98 -10.805 7.524 -17.263 1.00 0.00 H new ATOM 0 HB VAL A 98 -9.630 4.737 -17.628 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -10.689 4.790 -19.846 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -11.892 4.869 -18.537 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -11.460 6.342 -19.437 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -8.433 5.747 -19.527 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -9.111 7.337 -19.103 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -7.995 6.519 -17.985 1.00 0.00 H new ATOM 1500 N HIS A 99 -12.884 6.461 -16.425 1.00 0.00 N ATOM 1501 CA HIS A 99 -14.117 5.902 -15.880 1.00 0.00 C ATOM 1502 C HIS A 99 -14.493 4.611 -16.600 1.00 0.00 C ATOM 1503 O HIS A 99 -14.967 4.637 -17.735 1.00 0.00 O ATOM 1504 CB HIS A 99 -15.256 6.915 -15.997 1.00 0.00 C ATOM 1505 CG HIS A 99 -16.326 6.736 -14.964 1.00 0.00 C ATOM 1506 ND1 HIS A 99 -16.457 7.560 -13.866 1.00 0.00 N ATOM 1507 CD2 HIS A 99 -17.319 5.821 -14.868 1.00 0.00 C ATOM 1508 CE1 HIS A 99 -17.484 7.159 -13.138 1.00 0.00 C ATOM 1509 NE2 HIS A 99 -18.024 6.105 -13.725 1.00 0.00 N ATOM 0 H HIS A 99 -13.007 7.333 -16.940 1.00 0.00 H new ATOM 0 HA HIS A 99 -13.950 5.674 -14.827 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -14.846 7.921 -15.913 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -15.702 6.834 -16.988 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -17.519 5.017 -15.561 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -17.824 7.615 -12.220 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -18.834 5.587 -13.384 1.00 0.00 H new ATOM 1518 N SER A 100 -14.277 3.482 -15.931 1.00 0.00 N ATOM 1519 CA SER A 100 -14.589 2.180 -16.509 1.00 0.00 C ATOM 1520 C SER A 100 -16.055 1.823 -16.283 1.00 0.00 C ATOM 1521 O SER A 100 -16.450 1.439 -15.182 1.00 0.00 O ATOM 1522 CB SER A 100 -13.690 1.101 -15.902 1.00 0.00 C ATOM 1523 OG SER A 100 -13.479 0.039 -16.817 1.00 0.00 O ATOM 0 H SER A 100 -13.888 3.443 -14.989 1.00 0.00 H new ATOM 0 HA SER A 100 -14.407 2.233 -17.582 1.00 0.00 H new ATOM 0 HB2 SER A 100 -12.732 1.538 -15.620 1.00 0.00 H new ATOM 0 HB3 SER A 100 -14.145 0.715 -14.990 1.00 0.00 H new ATOM 0 HG SER A 100 -12.900 -0.637 -16.406 1.00 0.00 H new ATOM 1529 N SER A 101 -16.858 1.951 -17.335 1.00 0.00 N ATOM 1530 CA SER A 101 -18.281 1.646 -17.252 1.00 0.00 C ATOM 1531 C SER A 101 -18.576 0.269 -17.839 1.00 0.00 C ATOM 1532 O SER A 101 -18.094 -0.075 -18.918 1.00 0.00 O ATOM 1533 CB SER A 101 -19.096 2.711 -17.987 1.00 0.00 C ATOM 1534 OG SER A 101 -18.771 2.741 -19.366 1.00 0.00 O ATOM 0 H SER A 101 -16.547 2.264 -18.255 1.00 0.00 H new ATOM 0 HA SER A 101 -18.566 1.642 -16.200 1.00 0.00 H new ATOM 0 HB2 SER A 101 -20.160 2.507 -17.865 1.00 0.00 H new ATOM 0 HB3 SER A 101 -18.906 3.689 -17.544 1.00 0.00 H new ATOM 0 HG SER A 101 -19.307 3.429 -19.813 1.00 0.00 H new ATOM 1540 N SER A 102 -19.373 -0.515 -17.119 1.00 0.00 N ATOM 1541 CA SER A 102 -19.730 -1.857 -17.565 1.00 0.00 C ATOM 1542 C SER A 102 -21.221 -1.947 -17.877 1.00 0.00 C ATOM 1543 O SER A 102 -21.614 -2.240 -19.005 1.00 0.00 O ATOM 1544 CB SER A 102 -19.358 -2.888 -16.498 1.00 0.00 C ATOM 1545 OG SER A 102 -19.916 -2.546 -15.241 1.00 0.00 O ATOM 0 H SER A 102 -19.783 -0.244 -16.225 1.00 0.00 H new ATOM 0 HA SER A 102 -19.172 -2.071 -18.477 1.00 0.00 H new ATOM 0 HB2 SER A 102 -19.713 -3.873 -16.801 1.00 0.00 H new ATOM 0 HB3 SER A 102 -18.273 -2.952 -16.412 1.00 0.00 H new ATOM 0 HG SER A 102 -19.665 -3.222 -14.577 1.00 0.00 H new ATOM 1551 N GLY A 103 -22.047 -1.691 -16.866 1.00 0.00 N ATOM 1552 CA GLY A 103 -23.485 -1.748 -17.051 1.00 0.00 C ATOM 1553 C GLY A 103 -24.226 -2.015 -15.756 1.00 0.00 C ATOM 1554 O GLY A 103 -23.911 -2.964 -15.037 1.00 0.00 O ATOM 0 H GLY A 103 -21.746 -1.445 -15.923 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -23.831 -0.806 -17.476 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -23.725 -2.530 -17.771 1.00 0.00 H new ATOM 1558 N ASP A 104 -25.212 -1.177 -15.457 1.00 0.00 N ATOM 1559 CA ASP A 104 -26.000 -1.326 -14.239 1.00 0.00 C ATOM 1560 C ASP A 104 -27.053 -2.417 -14.404 1.00 0.00 C ATOM 1561 O ASP A 104 -27.665 -2.548 -15.465 1.00 0.00 O ATOM 1562 CB ASP A 104 -26.672 -0.002 -13.875 1.00 0.00 C ATOM 1563 CG ASP A 104 -25.797 0.868 -12.994 1.00 0.00 C ATOM 1564 OD1 ASP A 104 -24.838 1.471 -13.520 1.00 0.00 O ATOM 1565 OD2 ASP A 104 -26.072 0.947 -11.778 1.00 0.00 O ATOM 0 H ASP A 104 -25.485 -0.387 -16.042 1.00 0.00 H new ATOM 0 HA ASP A 104 -25.326 -1.615 -13.433 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -26.917 0.541 -14.788 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -27.612 -0.204 -13.362 1.00 0.00 H new ATOM 1570 N ILE A 105 -27.260 -3.198 -13.349 1.00 0.00 N ATOM 1571 CA ILE A 105 -28.239 -4.277 -13.377 1.00 0.00 C ATOM 1572 C ILE A 105 -29.533 -3.863 -12.685 1.00 0.00 C ATOM 1573 O ILE A 105 -29.527 -3.469 -11.518 1.00 0.00 O ATOM 1574 CB ILE A 105 -27.694 -5.550 -12.704 1.00 0.00 C ATOM 1575 CG1 ILE A 105 -26.377 -5.975 -13.357 1.00 0.00 C ATOM 1576 CG2 ILE A 105 -28.718 -6.672 -12.785 1.00 0.00 C ATOM 1577 CD1 ILE A 105 -26.528 -6.396 -14.802 1.00 0.00 C ATOM 0 H ILE A 105 -26.762 -3.103 -12.464 1.00 0.00 H new ATOM 0 HA ILE A 105 -28.443 -4.490 -14.426 1.00 0.00 H new ATOM 0 HB ILE A 105 -27.503 -5.334 -11.653 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -25.669 -5.148 -13.300 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -25.949 -6.801 -12.789 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -28.318 -7.565 -12.305 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -29.633 -6.367 -12.278 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -28.938 -6.889 -13.830 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -25.555 -6.684 -15.201 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -27.211 -7.243 -14.865 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -26.927 -5.565 -15.383 1.00 0.00 H new ATOM 1589 N LEU A 106 -30.642 -3.957 -13.410 1.00 0.00 N ATOM 1590 CA LEU A 106 -31.946 -3.594 -12.866 1.00 0.00 C ATOM 1591 C LEU A 106 -33.024 -4.562 -13.343 1.00 0.00 C ATOM 1592 O LEU A 106 -33.052 -4.948 -14.511 1.00 0.00 O ATOM 1593 CB LEU A 106 -32.311 -2.165 -13.272 1.00 0.00 C ATOM 1594 CG LEU A 106 -31.896 -1.063 -12.296 1.00 0.00 C ATOM 1595 CD1 LEU A 106 -31.621 0.234 -13.042 1.00 0.00 C ATOM 1596 CD2 LEU A 106 -32.971 -0.855 -11.239 1.00 0.00 C ATOM 0 H LEU A 106 -30.664 -4.282 -14.377 1.00 0.00 H new ATOM 0 HA LEU A 106 -31.887 -3.652 -11.779 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -31.855 -1.956 -14.240 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -33.391 -2.113 -13.410 1.00 0.00 H new ATOM 0 HG LEU A 106 -30.978 -1.372 -11.796 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -31.327 1.007 -12.332 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -30.817 0.077 -13.761 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -32.522 0.549 -13.569 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -32.659 -0.067 -10.553 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -33.905 -0.567 -11.722 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -33.120 -1.781 -10.684 1.00 0.00 H new ATOM 1608 N MET A 107 -33.910 -4.948 -12.432 1.00 0.00 N ATOM 1609 CA MET A 107 -34.993 -5.868 -12.761 1.00 0.00 C ATOM 1610 C MET A 107 -36.351 -5.228 -12.492 1.00 0.00 C ATOM 1611 O MET A 107 -36.435 -4.047 -12.156 1.00 0.00 O ATOM 1612 CB MET A 107 -34.856 -7.160 -11.953 1.00 0.00 C ATOM 1613 CG MET A 107 -33.513 -7.850 -12.132 1.00 0.00 C ATOM 1614 SD MET A 107 -32.290 -7.313 -10.920 1.00 0.00 S ATOM 1615 CE MET A 107 -33.055 -7.868 -9.399 1.00 0.00 C ATOM 0 H MET A 107 -33.900 -4.638 -11.460 1.00 0.00 H new ATOM 0 HA MET A 107 -34.926 -6.103 -13.823 1.00 0.00 H new ATOM 0 HB2 MET A 107 -35.002 -6.935 -10.896 1.00 0.00 H new ATOM 0 HB3 MET A 107 -35.650 -7.847 -12.245 1.00 0.00 H new ATOM 0 HG2 MET A 107 -33.649 -8.928 -12.052 1.00 0.00 H new ATOM 0 HG3 MET A 107 -33.137 -7.650 -13.135 1.00 0.00 H new ATOM 0 HE1 MET A 107 -32.282 -8.109 -8.670 1.00 0.00 H new ATOM 0 HE2 MET A 107 -33.693 -7.078 -9.003 1.00 0.00 H new ATOM 0 HE3 MET A 107 -33.657 -8.755 -9.597 1.00 0.00 H new ATOM 1625 N ILE A 108 -37.411 -6.015 -12.642 1.00 0.00 N ATOM 1626 CA ILE A 108 -38.765 -5.524 -12.415 1.00 0.00 C ATOM 1627 C ILE A 108 -39.557 -6.484 -11.533 1.00 0.00 C ATOM 1628 O ILE A 108 -39.319 -7.692 -11.544 1.00 0.00 O ATOM 1629 CB ILE A 108 -39.520 -5.321 -13.741 1.00 0.00 C ATOM 1630 CG1 ILE A 108 -40.860 -4.626 -13.489 1.00 0.00 C ATOM 1631 CG2 ILE A 108 -39.733 -6.656 -14.439 1.00 0.00 C ATOM 1632 CD1 ILE A 108 -40.719 -3.183 -13.057 1.00 0.00 C ATOM 0 H ILE A 108 -37.359 -6.995 -12.920 1.00 0.00 H new ATOM 0 HA ILE A 108 -38.672 -4.563 -11.909 1.00 0.00 H new ATOM 0 HB ILE A 108 -38.919 -4.685 -14.391 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -41.459 -4.668 -14.399 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -41.407 -5.175 -12.722 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -40.268 -6.496 -15.375 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -38.767 -7.116 -14.647 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -40.317 -7.314 -13.795 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -41.708 -2.753 -12.896 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -40.147 -3.135 -12.130 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -40.200 -2.620 -13.833 1.00 0.00 H new ATOM 1644 N ASP A 109 -40.500 -5.939 -10.773 1.00 0.00 N ATOM 1645 CA ASP A 109 -41.330 -6.748 -9.888 1.00 0.00 C ATOM 1646 C ASP A 109 -41.764 -8.038 -10.577 1.00 0.00 C ATOM 1647 O ASP A 109 -42.219 -8.979 -9.925 1.00 0.00 O ATOM 1648 CB ASP A 109 -42.559 -5.955 -9.442 1.00 0.00 C ATOM 1649 CG ASP A 109 -43.729 -6.851 -9.087 1.00 0.00 C ATOM 1650 OD1 ASP A 109 -44.352 -7.409 -10.015 1.00 0.00 O ATOM 1651 OD2 ASP A 109 -44.022 -6.996 -7.882 1.00 0.00 O ATOM 0 H ASP A 109 -40.709 -4.941 -10.752 1.00 0.00 H new ATOM 0 HA ASP A 109 -40.737 -7.008 -9.011 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -42.299 -5.343 -8.578 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -42.856 -5.273 -10.238 1.00 0.00 H new TER 1656 ASP A 109