USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1003 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 90 THR OG1 : rot 180:sc= 0.187 USER MOD Set 1.2: A 92 THR OG1 : rot 180:sc= -0.204 USER MOD Set 1.3: A 96 GLN : amide:sc= -9.15! C(o=-9.5!,f=-13!) USER MOD Set 1.4: A 116 GLN : amide:sc= -0.354 K(o=-9.5,f=-12!) USER MOD Set 2.1: A 18 MET CE :methyl 160:sc= -4.74! (180deg=-3.65!) USER MOD Set 2.2: A 39 MET CE :methyl 176:sc= -3.23! (180deg=-2.06!) USER MOD Set 3.1: A 30 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 132 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 27 MET CE :methyl -97:sc= -0.136 (180deg=-1.34) USER MOD Set 4.2: A 119 TYR OH : rot 69:sc= 1.09 USER MOD Set 5.1: A 19 HIS : no HD1:sc= -7.54! C(o=-7.7!,f=-8.7!) USER MOD Set 5.2: A 20 GLN : amide:sc= -0.12 X(o=-7.7,f=-7.4) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.103 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0311 USER MOD Single : A 29 MET CE :methyl -164:sc= -7.3! (180deg=-7.63!) USER MOD Single : A 36 CYS SG : rot -67:sc= -1.33 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 GLN : amide:sc= 0.396 K(o=0.4,f=-4.2!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= 0.701 K(o=0.7,f=-3.3!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 ASN : amide:sc= -0.33 K(o=-0.33,f=-1.6) USER MOD Single : A 83 MET CE :methyl -138:sc= -0.241 (180deg=-1.88!) USER MOD Single : A 85 ASN : amide:sc=-0.00234 K(o=-0.0023,f=-2.7!) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl -141:sc= -0.0862 (180deg=-3.35!) USER MOD Single : A 99 HIS : no HD1:sc= -0.0468 X(o=-0.047,f=-0.015) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.167 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 CYS SG : rot 103:sc= 0.0727 USER MOD Single : A 110 GLN : amide:sc=-0.00438 K(o=-0.0044,f=-1) USER MOD Single : A 113 CYS SG : rot -4:sc= -2.42! USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 ASN :FLIP amide:sc= -3.63! C(o=-5.5!,f=-3.6!) USER MOD Single : A 125 HIS : no HD1:sc= -0.2 X(o=-0.2,f=-0.3) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.131 -27.466 7.378 1.00 0.00 N ATOM 2 CA GLY A 1 2.789 -26.514 8.253 1.00 0.00 C ATOM 3 C GLY A 1 2.384 -25.082 7.962 1.00 0.00 C ATOM 4 O GLY A 1 1.594 -24.826 7.053 1.00 0.00 O ATOM 0 H1 GLY A 1 1.541 -28.108 7.945 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.532 -26.956 6.698 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.847 -28.017 6.863 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.550 -26.752 9.289 1.00 0.00 H new ATOM 0 HA3 GLY A 1 3.869 -26.612 8.144 1.00 0.00 H new ATOM 8 N SER A 2 2.924 -24.147 8.736 1.00 0.00 N ATOM 9 CA SER A 2 2.610 -22.734 8.560 1.00 0.00 C ATOM 10 C SER A 2 3.856 -21.945 8.168 1.00 0.00 C ATOM 11 O SER A 2 4.977 -22.327 8.503 1.00 0.00 O ATOM 12 CB SER A 2 2.012 -22.159 9.846 1.00 0.00 C ATOM 13 OG SER A 2 1.343 -20.935 9.594 1.00 0.00 O ATOM 0 H SER A 2 3.581 -24.342 9.491 1.00 0.00 H new ATOM 0 HA SER A 2 1.879 -22.647 7.757 1.00 0.00 H new ATOM 0 HB2 SER A 2 1.314 -22.876 10.279 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.803 -22.001 10.580 1.00 0.00 H new ATOM 0 HG SER A 2 0.968 -20.589 10.431 1.00 0.00 H new ATOM 19 N SER A 3 3.650 -20.841 7.456 1.00 0.00 N ATOM 20 CA SER A 3 4.756 -20.000 7.015 1.00 0.00 C ATOM 21 C SER A 3 5.057 -18.914 8.044 1.00 0.00 C ATOM 22 O SER A 3 4.224 -18.600 8.893 1.00 0.00 O ATOM 23 CB SER A 3 4.430 -19.361 5.663 1.00 0.00 C ATOM 24 OG SER A 3 5.614 -19.006 4.969 1.00 0.00 O ATOM 0 H SER A 3 2.728 -20.509 7.173 1.00 0.00 H new ATOM 0 HA SER A 3 5.639 -20.630 6.908 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.846 -20.056 5.060 1.00 0.00 H new ATOM 0 HB3 SER A 3 3.814 -18.475 5.815 1.00 0.00 H new ATOM 0 HG SER A 3 5.380 -18.601 4.108 1.00 0.00 H new ATOM 30 N GLY A 4 6.255 -18.344 7.960 1.00 0.00 N ATOM 31 CA GLY A 4 6.646 -17.299 8.889 1.00 0.00 C ATOM 32 C GLY A 4 7.643 -16.330 8.286 1.00 0.00 C ATOM 33 O GLY A 4 7.775 -16.244 7.065 1.00 0.00 O ATOM 0 H GLY A 4 6.962 -18.587 7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.760 -16.751 9.209 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.079 -17.753 9.780 1.00 0.00 H new ATOM 37 N SER A 5 8.347 -15.598 9.143 1.00 0.00 N ATOM 38 CA SER A 5 9.334 -14.626 8.688 1.00 0.00 C ATOM 39 C SER A 5 10.671 -15.303 8.400 1.00 0.00 C ATOM 40 O SER A 5 11.731 -14.780 8.742 1.00 0.00 O ATOM 41 CB SER A 5 9.522 -13.528 9.736 1.00 0.00 C ATOM 42 OG SER A 5 8.320 -12.805 9.939 1.00 0.00 O ATOM 0 H SER A 5 8.252 -15.660 10.157 1.00 0.00 H new ATOM 0 HA SER A 5 8.966 -14.178 7.765 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.847 -13.971 10.677 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.310 -12.847 9.416 1.00 0.00 H new ATOM 0 HG SER A 5 8.466 -12.110 10.615 1.00 0.00 H new ATOM 48 N SER A 6 10.611 -16.471 7.767 1.00 0.00 N ATOM 49 CA SER A 6 11.816 -17.223 7.435 1.00 0.00 C ATOM 50 C SER A 6 12.393 -16.762 6.100 1.00 0.00 C ATOM 51 O SER A 6 11.688 -16.190 5.270 1.00 0.00 O ATOM 52 CB SER A 6 11.508 -18.721 7.381 1.00 0.00 C ATOM 53 OG SER A 6 11.115 -19.207 8.653 1.00 0.00 O ATOM 0 H SER A 6 9.741 -16.917 7.474 1.00 0.00 H new ATOM 0 HA SER A 6 12.556 -17.039 8.214 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.715 -18.907 6.656 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.388 -19.264 7.037 1.00 0.00 H new ATOM 0 HG SER A 6 10.922 -20.166 8.592 1.00 0.00 H new ATOM 59 N GLY A 7 13.683 -17.017 5.901 1.00 0.00 N ATOM 60 CA GLY A 7 14.335 -16.622 4.666 1.00 0.00 C ATOM 61 C GLY A 7 15.662 -15.929 4.907 1.00 0.00 C ATOM 62 O GLY A 7 15.730 -14.942 5.639 1.00 0.00 O ATOM 0 H GLY A 7 14.288 -17.490 6.573 1.00 0.00 H new ATOM 0 HA2 GLY A 7 14.496 -17.504 4.046 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.677 -15.956 4.108 1.00 0.00 H new ATOM 66 N ASP A 8 16.718 -16.448 4.292 1.00 0.00 N ATOM 67 CA ASP A 8 18.050 -15.873 4.443 1.00 0.00 C ATOM 68 C ASP A 8 18.175 -14.576 3.650 1.00 0.00 C ATOM 69 O ASP A 8 18.718 -13.586 4.141 1.00 0.00 O ATOM 70 CB ASP A 8 19.115 -16.870 3.984 1.00 0.00 C ATOM 71 CG ASP A 8 20.481 -16.567 4.567 1.00 0.00 C ATOM 72 OD1 ASP A 8 20.540 -15.966 5.659 1.00 0.00 O ATOM 73 OD2 ASP A 8 21.492 -16.930 3.929 1.00 0.00 O ATOM 0 H ASP A 8 16.678 -17.266 3.684 1.00 0.00 H new ATOM 0 HA ASP A 8 18.204 -15.649 5.499 1.00 0.00 H new ATOM 0 HB2 ASP A 8 18.815 -17.877 4.274 1.00 0.00 H new ATOM 0 HB3 ASP A 8 19.176 -16.856 2.896 1.00 0.00 H new ATOM 78 N ASP A 9 17.670 -14.589 2.421 1.00 0.00 N ATOM 79 CA ASP A 9 17.725 -13.414 1.559 1.00 0.00 C ATOM 80 C ASP A 9 16.338 -13.060 1.033 1.00 0.00 C ATOM 81 O ASP A 9 16.012 -13.336 -0.121 1.00 0.00 O ATOM 82 CB ASP A 9 18.681 -13.656 0.390 1.00 0.00 C ATOM 83 CG ASP A 9 20.131 -13.431 0.771 1.00 0.00 C ATOM 84 OD1 ASP A 9 20.599 -12.278 0.667 1.00 0.00 O ATOM 85 OD2 ASP A 9 20.798 -14.407 1.173 1.00 0.00 O ATOM 0 H ASP A 9 17.218 -15.400 1.999 1.00 0.00 H new ATOM 0 HA ASP A 9 18.093 -12.577 2.152 1.00 0.00 H new ATOM 0 HB2 ASP A 9 18.558 -14.677 0.029 1.00 0.00 H new ATOM 0 HB3 ASP A 9 18.418 -12.993 -0.434 1.00 0.00 H new ATOM 90 N ASP A 10 15.525 -12.449 1.888 1.00 0.00 N ATOM 91 CA ASP A 10 14.172 -12.057 1.509 1.00 0.00 C ATOM 92 C ASP A 10 14.200 -10.929 0.483 1.00 0.00 C ATOM 93 O ASP A 10 13.626 -11.048 -0.600 1.00 0.00 O ATOM 94 CB ASP A 10 13.380 -11.621 2.743 1.00 0.00 C ATOM 95 CG ASP A 10 11.956 -11.227 2.407 1.00 0.00 C ATOM 96 OD1 ASP A 10 11.309 -11.953 1.623 1.00 0.00 O ATOM 97 OD2 ASP A 10 11.487 -10.192 2.927 1.00 0.00 O ATOM 0 H ASP A 10 15.779 -12.214 2.848 1.00 0.00 H new ATOM 0 HA ASP A 10 13.683 -12.921 1.059 1.00 0.00 H new ATOM 0 HB2 ASP A 10 13.367 -12.434 3.469 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.885 -10.779 3.216 1.00 0.00 H new ATOM 102 N ILE A 11 14.870 -9.835 0.831 1.00 0.00 N ATOM 103 CA ILE A 11 14.972 -8.686 -0.060 1.00 0.00 C ATOM 104 C ILE A 11 15.267 -9.125 -1.491 1.00 0.00 C ATOM 105 O ILE A 11 14.591 -8.707 -2.430 1.00 0.00 O ATOM 106 CB ILE A 11 16.070 -7.711 0.403 1.00 0.00 C ATOM 107 CG1 ILE A 11 15.727 -7.138 1.780 1.00 0.00 C ATOM 108 CG2 ILE A 11 16.247 -6.592 -0.613 1.00 0.00 C ATOM 109 CD1 ILE A 11 16.878 -6.408 2.435 1.00 0.00 C ATOM 0 H ILE A 11 15.350 -9.721 1.724 1.00 0.00 H new ATOM 0 HA ILE A 11 14.009 -8.176 -0.030 1.00 0.00 H new ATOM 0 HB ILE A 11 17.010 -8.257 0.482 1.00 0.00 H new ATOM 0 HG12 ILE A 11 14.884 -6.455 1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 11 15.404 -7.950 2.432 1.00 0.00 H new ATOM 0 HG21 ILE A 11 17.026 -5.911 -0.272 1.00 0.00 H new ATOM 0 HG22 ILE A 11 16.532 -7.016 -1.576 1.00 0.00 H new ATOM 0 HG23 ILE A 11 15.310 -6.046 -0.720 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.562 -6.029 3.407 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.715 -7.093 2.567 1.00 0.00 H new ATOM 0 HD13 ILE A 11 17.187 -5.575 1.804 1.00 0.00 H new ATOM 121 N GLU A 12 16.281 -9.971 -1.647 1.00 0.00 N ATOM 122 CA GLU A 12 16.665 -10.466 -2.964 1.00 0.00 C ATOM 123 C GLU A 12 15.438 -10.904 -3.759 1.00 0.00 C ATOM 124 O GLU A 12 15.270 -10.525 -4.918 1.00 0.00 O ATOM 125 CB GLU A 12 17.642 -11.636 -2.828 1.00 0.00 C ATOM 126 CG GLU A 12 19.080 -11.203 -2.594 1.00 0.00 C ATOM 127 CD GLU A 12 19.845 -10.998 -3.888 1.00 0.00 C ATOM 128 OE1 GLU A 12 19.599 -11.758 -4.848 1.00 0.00 O ATOM 129 OE2 GLU A 12 20.688 -10.079 -3.939 1.00 0.00 O ATOM 0 H GLU A 12 16.850 -10.327 -0.879 1.00 0.00 H new ATOM 0 HA GLU A 12 17.154 -9.654 -3.501 1.00 0.00 H new ATOM 0 HB2 GLU A 12 17.323 -12.271 -2.001 1.00 0.00 H new ATOM 0 HB3 GLU A 12 17.597 -12.243 -3.732 1.00 0.00 H new ATOM 0 HG2 GLU A 12 19.088 -10.276 -2.021 1.00 0.00 H new ATOM 0 HG3 GLU A 12 19.589 -11.955 -1.991 1.00 0.00 H new ATOM 136 N GLN A 13 14.585 -11.704 -3.127 1.00 0.00 N ATOM 137 CA GLN A 13 13.375 -12.195 -3.776 1.00 0.00 C ATOM 138 C GLN A 13 12.484 -11.037 -4.214 1.00 0.00 C ATOM 139 O GLN A 13 11.987 -11.013 -5.341 1.00 0.00 O ATOM 140 CB GLN A 13 12.604 -13.119 -2.832 1.00 0.00 C ATOM 141 CG GLN A 13 13.310 -14.437 -2.559 1.00 0.00 C ATOM 142 CD GLN A 13 12.357 -15.528 -2.114 1.00 0.00 C ATOM 143 OE1 GLN A 13 11.389 -15.844 -2.806 1.00 0.00 O ATOM 144 NE2 GLN A 13 12.627 -16.113 -0.952 1.00 0.00 N ATOM 0 H GLN A 13 14.709 -12.026 -2.167 1.00 0.00 H new ATOM 0 HA GLN A 13 13.670 -12.757 -4.662 1.00 0.00 H new ATOM 0 HB2 GLN A 13 12.439 -12.602 -1.887 1.00 0.00 H new ATOM 0 HB3 GLN A 13 11.622 -13.324 -3.259 1.00 0.00 H new ATOM 0 HG2 GLN A 13 13.830 -14.760 -3.461 1.00 0.00 H new ATOM 0 HG3 GLN A 13 14.068 -14.286 -1.790 1.00 0.00 H new ATOM 0 HE21 GLN A 13 13.440 -15.820 -0.410 1.00 0.00 H new ATOM 0 HE22 GLN A 13 12.021 -16.855 -0.602 1.00 0.00 H new ATOM 153 N LEU A 14 12.286 -10.078 -3.316 1.00 0.00 N ATOM 154 CA LEU A 14 11.454 -8.916 -3.609 1.00 0.00 C ATOM 155 C LEU A 14 11.948 -8.194 -4.858 1.00 0.00 C ATOM 156 O LEU A 14 11.206 -8.029 -5.828 1.00 0.00 O ATOM 157 CB LEU A 14 11.449 -7.955 -2.419 1.00 0.00 C ATOM 158 CG LEU A 14 10.364 -8.194 -1.368 1.00 0.00 C ATOM 159 CD1 LEU A 14 10.851 -7.766 0.008 1.00 0.00 C ATOM 160 CD2 LEU A 14 9.088 -7.453 -1.739 1.00 0.00 C ATOM 0 H LEU A 14 12.690 -10.082 -2.379 1.00 0.00 H new ATOM 0 HA LEU A 14 10.437 -9.264 -3.791 1.00 0.00 H new ATOM 0 HB2 LEU A 14 12.421 -8.011 -1.928 1.00 0.00 H new ATOM 0 HB3 LEU A 14 11.342 -6.939 -2.799 1.00 0.00 H new ATOM 0 HG LEU A 14 10.144 -9.261 -1.337 1.00 0.00 H new ATOM 0 HD11 LEU A 14 10.066 -7.943 0.743 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.736 -8.343 0.276 1.00 0.00 H new ATOM 0 HD13 LEU A 14 11.100 -6.705 -0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 14 8.328 -7.635 -0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 14 9.292 -6.384 -1.799 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.729 -7.808 -2.705 1.00 0.00 H new ATOM 172 N LEU A 15 13.206 -7.766 -4.830 1.00 0.00 N ATOM 173 CA LEU A 15 13.801 -7.063 -5.961 1.00 0.00 C ATOM 174 C LEU A 15 13.406 -7.721 -7.279 1.00 0.00 C ATOM 175 O LEU A 15 12.678 -7.136 -8.081 1.00 0.00 O ATOM 176 CB LEU A 15 15.325 -7.038 -5.827 1.00 0.00 C ATOM 177 CG LEU A 15 15.880 -6.271 -4.626 1.00 0.00 C ATOM 178 CD1 LEU A 15 17.387 -6.449 -4.530 1.00 0.00 C ATOM 179 CD2 LEU A 15 15.520 -4.795 -4.724 1.00 0.00 C ATOM 0 H LEU A 15 13.833 -7.894 -4.036 1.00 0.00 H new ATOM 0 HA LEU A 15 13.426 -6.040 -5.960 1.00 0.00 H new ATOM 0 HB2 LEU A 15 15.682 -8.066 -5.773 1.00 0.00 H new ATOM 0 HB3 LEU A 15 15.743 -6.603 -6.735 1.00 0.00 H new ATOM 0 HG LEU A 15 15.429 -6.675 -3.720 1.00 0.00 H new ATOM 0 HD11 LEU A 15 17.765 -5.896 -3.670 1.00 0.00 H new ATOM 0 HD12 LEU A 15 17.622 -7.507 -4.413 1.00 0.00 H new ATOM 0 HD13 LEU A 15 17.857 -6.071 -5.438 1.00 0.00 H new ATOM 0 HD21 LEU A 15 15.923 -4.264 -3.861 1.00 0.00 H new ATOM 0 HD22 LEU A 15 15.943 -4.377 -5.637 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.436 -4.685 -4.744 1.00 0.00 H new ATOM 191 N GLU A 16 13.890 -8.940 -7.495 1.00 0.00 N ATOM 192 CA GLU A 16 13.585 -9.677 -8.716 1.00 0.00 C ATOM 193 C GLU A 16 12.129 -9.474 -9.125 1.00 0.00 C ATOM 194 O GLU A 16 11.791 -9.531 -10.308 1.00 0.00 O ATOM 195 CB GLU A 16 13.869 -11.168 -8.523 1.00 0.00 C ATOM 196 CG GLU A 16 15.258 -11.457 -7.977 1.00 0.00 C ATOM 197 CD GLU A 16 15.809 -12.785 -8.458 1.00 0.00 C ATOM 198 OE1 GLU A 16 15.495 -13.820 -7.833 1.00 0.00 O ATOM 199 OE2 GLU A 16 16.554 -12.789 -9.460 1.00 0.00 O ATOM 0 H GLU A 16 14.494 -9.438 -6.841 1.00 0.00 H new ATOM 0 HA GLU A 16 14.224 -9.293 -9.511 1.00 0.00 H new ATOM 0 HB2 GLU A 16 13.126 -11.586 -7.843 1.00 0.00 H new ATOM 0 HB3 GLU A 16 13.750 -11.679 -9.479 1.00 0.00 H new ATOM 0 HG2 GLU A 16 15.935 -10.657 -8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.224 -11.455 -6.888 1.00 0.00 H new ATOM 206 N PHE A 17 11.271 -9.238 -8.139 1.00 0.00 N ATOM 207 CA PHE A 17 9.851 -9.028 -8.394 1.00 0.00 C ATOM 208 C PHE A 17 9.554 -7.551 -8.638 1.00 0.00 C ATOM 209 O PHE A 17 8.702 -7.205 -9.455 1.00 0.00 O ATOM 210 CB PHE A 17 9.018 -9.539 -7.217 1.00 0.00 C ATOM 211 CG PHE A 17 7.715 -8.812 -7.044 1.00 0.00 C ATOM 212 CD1 PHE A 17 7.677 -7.569 -6.434 1.00 0.00 C ATOM 213 CD2 PHE A 17 6.529 -9.371 -7.491 1.00 0.00 C ATOM 214 CE1 PHE A 17 6.479 -6.898 -6.272 1.00 0.00 C ATOM 215 CE2 PHE A 17 5.329 -8.705 -7.333 1.00 0.00 C ATOM 216 CZ PHE A 17 5.304 -7.466 -6.724 1.00 0.00 C ATOM 0 H PHE A 17 11.534 -9.187 -7.155 1.00 0.00 H new ATOM 0 HA PHE A 17 9.583 -9.587 -9.290 1.00 0.00 H new ATOM 0 HB2 PHE A 17 8.816 -10.601 -7.359 1.00 0.00 H new ATOM 0 HB3 PHE A 17 9.602 -9.445 -6.301 1.00 0.00 H new ATOM 0 HD1 PHE A 17 8.593 -7.119 -6.081 1.00 0.00 H new ATOM 0 HD2 PHE A 17 6.543 -10.339 -7.969 1.00 0.00 H new ATOM 0 HE1 PHE A 17 6.462 -5.930 -5.792 1.00 0.00 H new ATOM 0 HE2 PHE A 17 4.412 -9.153 -7.685 1.00 0.00 H new ATOM 0 HZ PHE A 17 4.368 -6.942 -6.601 1.00 0.00 H new ATOM 226 N MET A 18 10.265 -6.685 -7.923 1.00 0.00 N ATOM 227 CA MET A 18 10.078 -5.245 -8.061 1.00 0.00 C ATOM 228 C MET A 18 10.414 -4.788 -9.477 1.00 0.00 C ATOM 229 O MET A 18 9.543 -4.320 -10.212 1.00 0.00 O ATOM 230 CB MET A 18 10.950 -4.497 -7.051 1.00 0.00 C ATOM 231 CG MET A 18 10.287 -4.312 -5.696 1.00 0.00 C ATOM 232 SD MET A 18 11.471 -3.941 -4.388 1.00 0.00 S ATOM 233 CE MET A 18 11.409 -2.151 -4.373 1.00 0.00 C ATOM 0 H MET A 18 10.975 -6.955 -7.243 1.00 0.00 H new ATOM 0 HA MET A 18 9.030 -5.018 -7.863 1.00 0.00 H new ATOM 0 HB2 MET A 18 11.885 -5.041 -6.918 1.00 0.00 H new ATOM 0 HB3 MET A 18 11.205 -3.519 -7.458 1.00 0.00 H new ATOM 0 HG2 MET A 18 9.558 -3.505 -5.760 1.00 0.00 H new ATOM 0 HG3 MET A 18 9.738 -5.218 -5.438 1.00 0.00 H new ATOM 0 HE1 MET A 18 11.790 -1.782 -3.421 1.00 0.00 H new ATOM 0 HE2 MET A 18 12.021 -1.759 -5.185 1.00 0.00 H new ATOM 0 HE3 MET A 18 10.378 -1.822 -4.504 1.00 0.00 H new ATOM 243 N HIS A 19 11.681 -4.926 -9.855 1.00 0.00 N ATOM 244 CA HIS A 19 12.131 -4.526 -11.183 1.00 0.00 C ATOM 245 C HIS A 19 11.138 -4.977 -12.251 1.00 0.00 C ATOM 246 O HIS A 19 10.858 -4.244 -13.199 1.00 0.00 O ATOM 247 CB HIS A 19 13.513 -5.113 -11.475 1.00 0.00 C ATOM 248 CG HIS A 19 13.466 -6.454 -12.139 1.00 0.00 C ATOM 249 ND1 HIS A 19 12.847 -6.672 -13.352 1.00 0.00 N ATOM 250 CD2 HIS A 19 13.968 -7.651 -11.754 1.00 0.00 C ATOM 251 CE1 HIS A 19 12.969 -7.945 -13.683 1.00 0.00 C ATOM 252 NE2 HIS A 19 13.645 -8.561 -12.731 1.00 0.00 N ATOM 0 H HIS A 19 12.414 -5.312 -9.260 1.00 0.00 H new ATOM 0 HA HIS A 19 12.194 -3.438 -11.206 1.00 0.00 H new ATOM 0 HB2 HIS A 19 14.066 -4.421 -12.111 1.00 0.00 H new ATOM 0 HB3 HIS A 19 14.067 -5.199 -10.540 1.00 0.00 H new ATOM 0 HD2 HIS A 19 14.520 -7.853 -10.848 1.00 0.00 H new ATOM 0 HE1 HIS A 19 12.581 -8.404 -14.580 1.00 0.00 H new ATOM 0 HE2 HIS A 19 13.888 -9.552 -12.722 1.00 0.00 H new ATOM 261 N GLN A 20 10.612 -6.187 -12.090 1.00 0.00 N ATOM 262 CA GLN A 20 9.653 -6.735 -13.041 1.00 0.00 C ATOM 263 C GLN A 20 8.508 -5.756 -13.285 1.00 0.00 C ATOM 264 O GLN A 20 8.123 -5.507 -14.429 1.00 0.00 O ATOM 265 CB GLN A 20 9.100 -8.067 -12.531 1.00 0.00 C ATOM 266 CG GLN A 20 9.910 -9.273 -12.979 1.00 0.00 C ATOM 267 CD GLN A 20 9.424 -9.845 -14.296 1.00 0.00 C ATOM 268 OE1 GLN A 20 8.441 -10.585 -14.340 1.00 0.00 O ATOM 269 NE2 GLN A 20 10.112 -9.504 -15.380 1.00 0.00 N ATOM 0 H GLN A 20 10.834 -6.806 -11.310 1.00 0.00 H new ATOM 0 HA GLN A 20 10.172 -6.903 -13.985 1.00 0.00 H new ATOM 0 HB2 GLN A 20 9.069 -8.045 -11.442 1.00 0.00 H new ATOM 0 HB3 GLN A 20 8.073 -8.181 -12.877 1.00 0.00 H new ATOM 0 HG2 GLN A 20 10.957 -8.987 -13.076 1.00 0.00 H new ATOM 0 HG3 GLN A 20 9.860 -10.045 -12.211 1.00 0.00 H new ATOM 0 HE21 GLN A 20 10.921 -8.888 -15.298 1.00 0.00 H new ATOM 0 HE22 GLN A 20 9.832 -9.858 -16.294 1.00 0.00 H new ATOM 278 N LEU A 21 7.969 -5.204 -12.205 1.00 0.00 N ATOM 279 CA LEU A 21 6.867 -4.252 -12.301 1.00 0.00 C ATOM 280 C LEU A 21 7.369 -2.882 -12.747 1.00 0.00 C ATOM 281 O LEU A 21 8.456 -2.440 -12.373 1.00 0.00 O ATOM 282 CB LEU A 21 6.152 -4.132 -10.954 1.00 0.00 C ATOM 283 CG LEU A 21 5.898 -5.443 -10.210 1.00 0.00 C ATOM 284 CD1 LEU A 21 5.144 -5.184 -8.915 1.00 0.00 C ATOM 285 CD2 LEU A 21 5.129 -6.416 -11.091 1.00 0.00 C ATOM 0 H LEU A 21 8.276 -5.399 -11.252 1.00 0.00 H new ATOM 0 HA LEU A 21 6.164 -4.622 -13.047 1.00 0.00 H new ATOM 0 HB2 LEU A 21 6.741 -3.480 -10.309 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.194 -3.638 -11.117 1.00 0.00 H new ATOM 0 HG LEU A 21 6.861 -5.891 -9.963 1.00 0.00 H new ATOM 0 HD11 LEU A 21 4.972 -6.129 -8.399 1.00 0.00 H new ATOM 0 HD12 LEU A 21 5.732 -4.524 -8.277 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.187 -4.714 -9.139 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.957 -7.344 -10.545 1.00 0.00 H new ATOM 0 HD22 LEU A 21 4.171 -5.976 -11.369 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.707 -6.626 -11.991 1.00 0.00 H new ATOM 297 N PRO A 22 6.559 -2.192 -13.564 1.00 0.00 N ATOM 298 CA PRO A 22 6.899 -0.861 -14.076 1.00 0.00 C ATOM 299 C PRO A 22 6.869 0.205 -12.986 1.00 0.00 C ATOM 300 O PRO A 22 7.655 1.151 -13.009 1.00 0.00 O ATOM 301 CB PRO A 22 5.808 -0.593 -15.116 1.00 0.00 C ATOM 302 CG PRO A 22 4.655 -1.429 -14.680 1.00 0.00 C ATOM 303 CD PRO A 22 5.249 -2.658 -14.049 1.00 0.00 C ATOM 0 HA PRO A 22 7.911 -0.826 -14.480 1.00 0.00 H new ATOM 0 HB2 PRO A 22 5.542 0.463 -15.147 1.00 0.00 H new ATOM 0 HB3 PRO A 22 6.140 -0.868 -16.117 1.00 0.00 H new ATOM 0 HG2 PRO A 22 4.029 -0.890 -13.970 1.00 0.00 H new ATOM 0 HG3 PRO A 22 4.022 -1.693 -15.527 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.628 -3.032 -13.234 1.00 0.00 H new ATOM 0 HD3 PRO A 22 5.352 -3.470 -14.769 1.00 0.00 H new ATOM 311 N ALA A 23 5.958 0.044 -12.032 1.00 0.00 N ATOM 312 CA ALA A 23 5.828 0.991 -10.931 1.00 0.00 C ATOM 313 C ALA A 23 7.084 1.004 -10.067 1.00 0.00 C ATOM 314 O ALA A 23 7.374 1.991 -9.391 1.00 0.00 O ATOM 315 CB ALA A 23 4.608 0.655 -10.087 1.00 0.00 C ATOM 0 H ALA A 23 5.299 -0.734 -11.999 1.00 0.00 H new ATOM 0 HA ALA A 23 5.700 1.987 -11.355 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.523 1.370 -9.269 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.712 0.705 -10.706 1.00 0.00 H new ATOM 0 HB3 ALA A 23 4.713 -0.351 -9.680 1.00 0.00 H new ATOM 321 N PHE A 24 7.827 -0.098 -10.094 1.00 0.00 N ATOM 322 CA PHE A 24 9.052 -0.213 -9.311 1.00 0.00 C ATOM 323 C PHE A 24 10.280 0.029 -10.184 1.00 0.00 C ATOM 324 O PHE A 24 11.226 0.699 -9.771 1.00 0.00 O ATOM 325 CB PHE A 24 9.138 -1.595 -8.661 1.00 0.00 C ATOM 326 CG PHE A 24 8.376 -1.700 -7.371 1.00 0.00 C ATOM 327 CD1 PHE A 24 8.507 -0.728 -6.393 1.00 0.00 C ATOM 328 CD2 PHE A 24 7.527 -2.771 -7.138 1.00 0.00 C ATOM 329 CE1 PHE A 24 7.806 -0.823 -5.205 1.00 0.00 C ATOM 330 CE2 PHE A 24 6.824 -2.870 -5.952 1.00 0.00 C ATOM 331 CZ PHE A 24 6.963 -1.895 -4.985 1.00 0.00 C ATOM 0 H PHE A 24 7.602 -0.924 -10.649 1.00 0.00 H new ATOM 0 HA PHE A 24 9.028 0.547 -8.530 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.758 -2.340 -9.360 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.185 -1.836 -8.476 1.00 0.00 H new ATOM 0 HD1 PHE A 24 9.164 0.113 -6.560 1.00 0.00 H new ATOM 0 HD2 PHE A 24 7.414 -3.536 -7.891 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.917 -0.059 -4.449 1.00 0.00 H new ATOM 0 HE2 PHE A 24 6.166 -3.710 -5.782 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.414 -1.970 -4.058 1.00 0.00 H new ATOM 341 N ALA A 25 10.256 -0.522 -11.393 1.00 0.00 N ATOM 342 CA ALA A 25 11.366 -0.366 -12.325 1.00 0.00 C ATOM 343 C ALA A 25 11.772 1.098 -12.454 1.00 0.00 C ATOM 344 O ALA A 25 12.943 1.411 -12.666 1.00 0.00 O ATOM 345 CB ALA A 25 10.995 -0.935 -13.687 1.00 0.00 C ATOM 0 H ALA A 25 9.480 -1.080 -11.750 1.00 0.00 H new ATOM 0 HA ALA A 25 12.219 -0.919 -11.932 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.833 -0.812 -14.373 1.00 0.00 H new ATOM 0 HB2 ALA A 25 10.761 -1.995 -13.587 1.00 0.00 H new ATOM 0 HB3 ALA A 25 10.125 -0.406 -14.078 1.00 0.00 H new ATOM 351 N ASN A 26 10.797 1.992 -12.326 1.00 0.00 N ATOM 352 CA ASN A 26 11.053 3.424 -12.430 1.00 0.00 C ATOM 353 C ASN A 26 12.233 3.830 -11.552 1.00 0.00 C ATOM 354 O ASN A 26 13.087 4.614 -11.967 1.00 0.00 O ATOM 355 CB ASN A 26 9.808 4.217 -12.029 1.00 0.00 C ATOM 356 CG ASN A 26 9.882 5.668 -12.462 1.00 0.00 C ATOM 357 OD1 ASN A 26 10.103 5.966 -13.636 1.00 0.00 O ATOM 358 ND2 ASN A 26 9.697 6.579 -11.514 1.00 0.00 N ATOM 0 H ASN A 26 9.822 1.750 -12.150 1.00 0.00 H new ATOM 0 HA ASN A 26 11.300 3.649 -13.468 1.00 0.00 H new ATOM 0 HB2 ASN A 26 8.927 3.753 -12.472 1.00 0.00 H new ATOM 0 HB3 ASN A 26 9.683 4.170 -10.947 1.00 0.00 H new ATOM 0 HD21 ASN A 26 9.735 7.572 -11.746 1.00 0.00 H new ATOM 0 HD22 ASN A 26 9.516 6.286 -10.554 1.00 0.00 H new ATOM 365 N MET A 27 12.274 3.291 -10.339 1.00 0.00 N ATOM 366 CA MET A 27 13.350 3.596 -9.403 1.00 0.00 C ATOM 367 C MET A 27 14.584 2.748 -9.698 1.00 0.00 C ATOM 368 O MET A 27 14.495 1.714 -10.361 1.00 0.00 O ATOM 369 CB MET A 27 12.887 3.358 -7.964 1.00 0.00 C ATOM 370 CG MET A 27 11.521 3.952 -7.660 1.00 0.00 C ATOM 371 SD MET A 27 10.637 3.041 -6.379 1.00 0.00 S ATOM 372 CE MET A 27 8.945 3.233 -6.934 1.00 0.00 C ATOM 0 H MET A 27 11.575 2.641 -9.980 1.00 0.00 H new ATOM 0 HA MET A 27 13.615 4.647 -9.523 1.00 0.00 H new ATOM 0 HB2 MET A 27 12.859 2.285 -7.773 1.00 0.00 H new ATOM 0 HB3 MET A 27 13.620 3.785 -7.280 1.00 0.00 H new ATOM 0 HG2 MET A 27 11.642 4.989 -7.346 1.00 0.00 H new ATOM 0 HG3 MET A 27 10.923 3.963 -8.571 1.00 0.00 H new ATOM 0 HE1 MET A 27 8.478 4.060 -6.399 1.00 0.00 H new ATOM 0 HE2 MET A 27 8.934 3.441 -8.004 1.00 0.00 H new ATOM 0 HE3 MET A 27 8.391 2.315 -6.738 1.00 0.00 H new ATOM 382 N THR A 28 15.734 3.193 -9.203 1.00 0.00 N ATOM 383 CA THR A 28 16.986 2.476 -9.415 1.00 0.00 C ATOM 384 C THR A 28 17.210 1.429 -8.330 1.00 0.00 C ATOM 385 O THR A 28 16.611 1.495 -7.257 1.00 0.00 O ATOM 386 CB THR A 28 18.187 3.439 -9.439 1.00 0.00 C ATOM 387 OG1 THR A 28 19.371 2.735 -9.831 1.00 0.00 O ATOM 388 CG2 THR A 28 18.399 4.075 -8.073 1.00 0.00 C ATOM 0 H THR A 28 15.825 4.047 -8.652 1.00 0.00 H new ATOM 0 HA THR A 28 16.907 1.981 -10.383 1.00 0.00 H new ATOM 0 HB THR A 28 17.977 4.228 -10.161 1.00 0.00 H new ATOM 0 HG1 THR A 28 20.130 3.355 -9.846 1.00 0.00 H new ATOM 0 HG21 THR A 28 19.253 4.751 -8.115 1.00 0.00 H new ATOM 0 HG22 THR A 28 17.507 4.634 -7.790 1.00 0.00 H new ATOM 0 HG23 THR A 28 18.589 3.296 -7.335 1.00 0.00 H new ATOM 396 N MET A 29 18.076 0.462 -8.617 1.00 0.00 N ATOM 397 CA MET A 29 18.381 -0.598 -7.664 1.00 0.00 C ATOM 398 C MET A 29 18.344 -0.071 -6.233 1.00 0.00 C ATOM 399 O MET A 29 17.462 -0.429 -5.452 1.00 0.00 O ATOM 400 CB MET A 29 19.755 -1.202 -7.962 1.00 0.00 C ATOM 401 CG MET A 29 20.054 -2.457 -7.158 1.00 0.00 C ATOM 402 SD MET A 29 19.351 -3.942 -7.900 1.00 0.00 S ATOM 403 CE MET A 29 17.778 -4.034 -7.049 1.00 0.00 C ATOM 0 H MET A 29 18.578 0.391 -9.502 1.00 0.00 H new ATOM 0 HA MET A 29 17.621 -1.373 -7.766 1.00 0.00 H new ATOM 0 HB2 MET A 29 19.817 -1.438 -9.024 1.00 0.00 H new ATOM 0 HB3 MET A 29 20.523 -0.457 -7.756 1.00 0.00 H new ATOM 0 HG2 MET A 29 21.134 -2.577 -7.068 1.00 0.00 H new ATOM 0 HG3 MET A 29 19.661 -2.339 -6.148 1.00 0.00 H new ATOM 0 HE1 MET A 29 17.352 -5.029 -7.178 1.00 0.00 H new ATOM 0 HE2 MET A 29 17.927 -3.837 -5.987 1.00 0.00 H new ATOM 0 HE3 MET A 29 17.096 -3.292 -7.464 1.00 0.00 H new ATOM 413 N SER A 30 19.306 0.782 -5.896 1.00 0.00 N ATOM 414 CA SER A 30 19.385 1.355 -4.558 1.00 0.00 C ATOM 415 C SER A 30 17.992 1.630 -4.001 1.00 0.00 C ATOM 416 O SER A 30 17.551 0.983 -3.051 1.00 0.00 O ATOM 417 CB SER A 30 20.202 2.649 -4.582 1.00 0.00 C ATOM 418 OG SER A 30 21.563 2.388 -4.875 1.00 0.00 O ATOM 0 H SER A 30 20.042 1.091 -6.531 1.00 0.00 H new ATOM 0 HA SER A 30 19.880 0.633 -3.909 1.00 0.00 H new ATOM 0 HB2 SER A 30 19.790 3.329 -5.328 1.00 0.00 H new ATOM 0 HB3 SER A 30 20.124 3.150 -3.617 1.00 0.00 H new ATOM 0 HG SER A 30 22.063 3.231 -4.886 1.00 0.00 H new ATOM 424 N VAL A 31 17.302 2.596 -4.600 1.00 0.00 N ATOM 425 CA VAL A 31 15.957 2.957 -4.167 1.00 0.00 C ATOM 426 C VAL A 31 15.139 1.717 -3.824 1.00 0.00 C ATOM 427 O VAL A 31 14.620 1.591 -2.715 1.00 0.00 O ATOM 428 CB VAL A 31 15.217 3.765 -5.249 1.00 0.00 C ATOM 429 CG1 VAL A 31 13.752 3.940 -4.876 1.00 0.00 C ATOM 430 CG2 VAL A 31 15.887 5.114 -5.458 1.00 0.00 C ATOM 0 H VAL A 31 17.653 3.143 -5.387 1.00 0.00 H new ATOM 0 HA VAL A 31 16.066 3.574 -3.275 1.00 0.00 H new ATOM 0 HB VAL A 31 15.265 3.212 -6.187 1.00 0.00 H new ATOM 0 HG11 VAL A 31 13.245 4.513 -5.652 1.00 0.00 H new ATOM 0 HG12 VAL A 31 13.281 2.961 -4.782 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.679 4.471 -3.927 1.00 0.00 H new ATOM 0 HG21 VAL A 31 15.351 5.671 -6.226 1.00 0.00 H new ATOM 0 HG22 VAL A 31 15.872 5.676 -4.524 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.919 4.963 -5.774 1.00 0.00 H new ATOM 440 N ARG A 32 15.028 0.804 -4.783 1.00 0.00 N ATOM 441 CA ARG A 32 14.272 -0.426 -4.584 1.00 0.00 C ATOM 442 C ARG A 32 14.554 -1.020 -3.207 1.00 0.00 C ATOM 443 O ARG A 32 13.632 -1.308 -2.443 1.00 0.00 O ATOM 444 CB ARG A 32 14.618 -1.445 -5.671 1.00 0.00 C ATOM 445 CG ARG A 32 14.413 -0.922 -7.083 1.00 0.00 C ATOM 446 CD ARG A 32 14.742 -1.982 -8.123 1.00 0.00 C ATOM 447 NE ARG A 32 14.619 -1.469 -9.485 1.00 0.00 N ATOM 448 CZ ARG A 32 15.262 -1.987 -10.526 1.00 0.00 C ATOM 449 NH1 ARG A 32 16.068 -3.026 -10.361 1.00 0.00 N ATOM 450 NH2 ARG A 32 15.098 -1.465 -11.735 1.00 0.00 N ATOM 0 H ARG A 32 15.452 0.893 -5.706 1.00 0.00 H new ATOM 0 HA ARG A 32 13.211 -0.185 -4.647 1.00 0.00 H new ATOM 0 HB2 ARG A 32 15.658 -1.751 -5.553 1.00 0.00 H new ATOM 0 HB3 ARG A 32 14.006 -2.336 -5.530 1.00 0.00 H new ATOM 0 HG2 ARG A 32 13.379 -0.599 -7.206 1.00 0.00 H new ATOM 0 HG3 ARG A 32 15.042 -0.046 -7.243 1.00 0.00 H new ATOM 0 HD2 ARG A 32 15.757 -2.345 -7.962 1.00 0.00 H new ATOM 0 HD3 ARG A 32 14.075 -2.835 -7.995 1.00 0.00 H new ATOM 0 HE ARG A 32 14.006 -0.670 -9.646 1.00 0.00 H new ATOM 0 HH11 ARG A 32 16.196 -3.430 -9.433 1.00 0.00 H new ATOM 0 HH12 ARG A 32 16.560 -3.422 -11.162 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.478 -0.666 -11.866 1.00 0.00 H new ATOM 0 HH22 ARG A 32 15.592 -1.863 -12.534 1.00 0.00 H new ATOM 464 N ARG A 33 15.833 -1.201 -2.896 1.00 0.00 N ATOM 465 CA ARG A 33 16.236 -1.762 -1.612 1.00 0.00 C ATOM 466 C ARG A 33 15.787 -0.865 -0.462 1.00 0.00 C ATOM 467 O ARG A 33 15.056 -1.301 0.427 1.00 0.00 O ATOM 468 CB ARG A 33 17.754 -1.946 -1.566 1.00 0.00 C ATOM 469 CG ARG A 33 18.202 -3.094 -0.677 1.00 0.00 C ATOM 470 CD ARG A 33 19.633 -3.508 -0.979 1.00 0.00 C ATOM 471 NE ARG A 33 20.205 -4.322 0.090 1.00 0.00 N ATOM 472 CZ ARG A 33 20.660 -3.820 1.233 1.00 0.00 C ATOM 473 NH1 ARG A 33 20.609 -2.513 1.454 1.00 0.00 N ATOM 474 NH2 ARG A 33 21.166 -4.625 2.158 1.00 0.00 N ATOM 0 H ARG A 33 16.609 -0.967 -3.516 1.00 0.00 H new ATOM 0 HA ARG A 33 15.755 -2.734 -1.501 1.00 0.00 H new ATOM 0 HB2 ARG A 33 18.122 -2.117 -2.578 1.00 0.00 H new ATOM 0 HB3 ARG A 33 18.213 -1.023 -1.212 1.00 0.00 H new ATOM 0 HG2 ARG A 33 18.121 -2.798 0.369 1.00 0.00 H new ATOM 0 HG3 ARG A 33 17.538 -3.946 -0.820 1.00 0.00 H new ATOM 0 HD2 ARG A 33 19.659 -4.068 -1.914 1.00 0.00 H new ATOM 0 HD3 ARG A 33 20.245 -2.618 -1.124 1.00 0.00 H new ATOM 0 HE ARG A 33 20.258 -5.331 -0.048 1.00 0.00 H new ATOM 0 HH11 ARG A 33 20.220 -1.891 0.746 1.00 0.00 H new ATOM 0 HH12 ARG A 33 20.959 -2.130 2.332 1.00 0.00 H new ATOM 0 HH21 ARG A 33 21.206 -5.631 1.992 1.00 0.00 H new ATOM 0 HH22 ARG A 33 21.515 -4.238 3.035 1.00 0.00 H new ATOM 488 N GLU A 34 16.230 0.388 -0.487 1.00 0.00 N ATOM 489 CA GLU A 34 15.874 1.344 0.554 1.00 0.00 C ATOM 490 C GLU A 34 14.412 1.186 0.962 1.00 0.00 C ATOM 491 O GLU A 34 14.078 1.229 2.147 1.00 0.00 O ATOM 492 CB GLU A 34 16.129 2.774 0.073 1.00 0.00 C ATOM 493 CG GLU A 34 17.562 3.023 -0.364 1.00 0.00 C ATOM 494 CD GLU A 34 17.797 4.454 -0.809 1.00 0.00 C ATOM 495 OE1 GLU A 34 17.408 5.377 -0.063 1.00 0.00 O ATOM 496 OE2 GLU A 34 18.368 4.650 -1.902 1.00 0.00 O ATOM 0 H GLU A 34 16.836 0.764 -1.216 1.00 0.00 H new ATOM 0 HA GLU A 34 16.499 1.144 1.424 1.00 0.00 H new ATOM 0 HB2 GLU A 34 15.461 2.993 -0.760 1.00 0.00 H new ATOM 0 HB3 GLU A 34 15.877 3.468 0.875 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.235 2.788 0.460 1.00 0.00 H new ATOM 0 HG3 GLU A 34 17.811 2.347 -1.182 1.00 0.00 H new ATOM 503 N LEU A 35 13.545 1.003 -0.028 1.00 0.00 N ATOM 504 CA LEU A 35 12.118 0.838 0.226 1.00 0.00 C ATOM 505 C LEU A 35 11.849 -0.439 1.015 1.00 0.00 C ATOM 506 O LEU A 35 11.085 -0.435 1.981 1.00 0.00 O ATOM 507 CB LEU A 35 11.345 0.808 -1.094 1.00 0.00 C ATOM 508 CG LEU A 35 11.217 2.144 -1.827 1.00 0.00 C ATOM 509 CD1 LEU A 35 11.135 1.923 -3.329 1.00 0.00 C ATOM 510 CD2 LEU A 35 10.000 2.911 -1.332 1.00 0.00 C ATOM 0 H LEU A 35 13.805 0.965 -1.014 1.00 0.00 H new ATOM 0 HA LEU A 35 11.779 1.687 0.819 1.00 0.00 H new ATOM 0 HB2 LEU A 35 11.831 0.096 -1.761 1.00 0.00 H new ATOM 0 HB3 LEU A 35 10.343 0.427 -0.897 1.00 0.00 H new ATOM 0 HG LEU A 35 12.106 2.738 -1.616 1.00 0.00 H new ATOM 0 HD11 LEU A 35 11.044 2.885 -3.834 1.00 0.00 H new ATOM 0 HD12 LEU A 35 12.037 1.417 -3.672 1.00 0.00 H new ATOM 0 HD13 LEU A 35 10.265 1.309 -3.559 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.926 3.859 -1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 35 9.101 2.322 -1.512 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.100 3.103 -0.264 1.00 0.00 H new ATOM 522 N CYS A 36 12.482 -1.530 0.598 1.00 0.00 N ATOM 523 CA CYS A 36 12.312 -2.815 1.266 1.00 0.00 C ATOM 524 C CYS A 36 12.490 -2.672 2.774 1.00 0.00 C ATOM 525 O CYS A 36 11.934 -3.446 3.552 1.00 0.00 O ATOM 526 CB CYS A 36 13.310 -3.835 0.717 1.00 0.00 C ATOM 527 SG CYS A 36 14.902 -3.846 1.575 1.00 0.00 S ATOM 0 H CYS A 36 13.118 -1.550 -0.200 1.00 0.00 H new ATOM 0 HA CYS A 36 11.299 -3.167 1.070 1.00 0.00 H new ATOM 0 HB2 CYS A 36 12.868 -4.830 0.780 1.00 0.00 H new ATOM 0 HB3 CYS A 36 13.480 -3.628 -0.340 1.00 0.00 H new ATOM 0 HG CYS A 36 15.528 -2.730 1.343 1.00 0.00 H new ATOM 533 N SER A 37 13.272 -1.676 3.180 1.00 0.00 N ATOM 534 CA SER A 37 13.529 -1.434 4.595 1.00 0.00 C ATOM 535 C SER A 37 12.269 -0.940 5.299 1.00 0.00 C ATOM 536 O SER A 37 12.026 -1.264 6.461 1.00 0.00 O ATOM 537 CB SER A 37 14.655 -0.412 4.763 1.00 0.00 C ATOM 538 OG SER A 37 15.078 -0.337 6.113 1.00 0.00 O ATOM 0 H SER A 37 13.738 -1.024 2.549 1.00 0.00 H new ATOM 0 HA SER A 37 13.833 -2.377 5.050 1.00 0.00 H new ATOM 0 HB2 SER A 37 15.498 -0.687 4.129 1.00 0.00 H new ATOM 0 HB3 SER A 37 14.313 0.568 4.431 1.00 0.00 H new ATOM 0 HG SER A 37 15.799 0.322 6.194 1.00 0.00 H new ATOM 544 N VAL A 38 11.471 -0.152 4.586 1.00 0.00 N ATOM 545 CA VAL A 38 10.235 0.388 5.140 1.00 0.00 C ATOM 546 C VAL A 38 9.015 -0.208 4.447 1.00 0.00 C ATOM 547 O VAL A 38 7.930 0.372 4.470 1.00 0.00 O ATOM 548 CB VAL A 38 10.185 1.922 5.013 1.00 0.00 C ATOM 549 CG1 VAL A 38 11.245 2.566 5.895 1.00 0.00 C ATOM 550 CG2 VAL A 38 10.361 2.342 3.562 1.00 0.00 C ATOM 0 H VAL A 38 11.658 0.127 3.623 1.00 0.00 H new ATOM 0 HA VAL A 38 10.218 0.118 6.196 1.00 0.00 H new ATOM 0 HB VAL A 38 9.207 2.265 5.351 1.00 0.00 H new ATOM 0 HG11 VAL A 38 11.194 3.650 5.792 1.00 0.00 H new ATOM 0 HG12 VAL A 38 11.069 2.292 6.935 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.232 2.218 5.590 1.00 0.00 H new ATOM 0 HG21 VAL A 38 10.323 3.429 3.491 1.00 0.00 H new ATOM 0 HG22 VAL A 38 11.324 1.988 3.195 1.00 0.00 H new ATOM 0 HG23 VAL A 38 9.562 1.911 2.959 1.00 0.00 H new ATOM 560 N MET A 39 9.201 -1.371 3.830 1.00 0.00 N ATOM 561 CA MET A 39 8.115 -2.047 3.131 1.00 0.00 C ATOM 562 C MET A 39 7.345 -2.961 4.078 1.00 0.00 C ATOM 563 O MET A 39 7.863 -3.985 4.525 1.00 0.00 O ATOM 564 CB MET A 39 8.663 -2.857 1.954 1.00 0.00 C ATOM 565 CG MET A 39 8.728 -2.072 0.654 1.00 0.00 C ATOM 566 SD MET A 39 8.627 -3.131 -0.802 1.00 0.00 S ATOM 567 CE MET A 39 9.094 -1.979 -2.092 1.00 0.00 C ATOM 0 H MET A 39 10.093 -1.864 3.800 1.00 0.00 H new ATOM 0 HA MET A 39 7.431 -1.287 2.752 1.00 0.00 H new ATOM 0 HB2 MET A 39 9.662 -3.214 2.203 1.00 0.00 H new ATOM 0 HB3 MET A 39 8.037 -3.737 1.807 1.00 0.00 H new ATOM 0 HG2 MET A 39 7.913 -1.349 0.630 1.00 0.00 H new ATOM 0 HG3 MET A 39 9.658 -1.505 0.622 1.00 0.00 H new ATOM 0 HE1 MET A 39 9.148 -2.503 -3.046 1.00 0.00 H new ATOM 0 HE2 MET A 39 8.351 -1.184 -2.156 1.00 0.00 H new ATOM 0 HE3 MET A 39 10.068 -1.548 -1.860 1.00 0.00 H new ATOM 577 N ILE A 40 6.106 -2.586 4.379 1.00 0.00 N ATOM 578 CA ILE A 40 5.266 -3.373 5.272 1.00 0.00 C ATOM 579 C ILE A 40 4.596 -4.523 4.526 1.00 0.00 C ATOM 580 O ILE A 40 4.243 -4.394 3.354 1.00 0.00 O ATOM 581 CB ILE A 40 4.180 -2.505 5.935 1.00 0.00 C ATOM 582 CG1 ILE A 40 4.821 -1.437 6.823 1.00 0.00 C ATOM 583 CG2 ILE A 40 3.228 -3.373 6.743 1.00 0.00 C ATOM 584 CD1 ILE A 40 5.113 -0.142 6.098 1.00 0.00 C ATOM 0 H ILE A 40 5.662 -1.742 4.017 1.00 0.00 H new ATOM 0 HA ILE A 40 5.920 -3.776 6.045 1.00 0.00 H new ATOM 0 HB ILE A 40 3.609 -2.005 5.153 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.160 -1.231 7.665 1.00 0.00 H new ATOM 0 HG13 ILE A 40 5.750 -1.830 7.236 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.466 -2.745 7.205 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.750 -4.098 6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.785 -3.899 7.519 1.00 0.00 H new ATOM 0 HD11 ILE A 40 5.566 0.568 6.790 1.00 0.00 H new ATOM 0 HD12 ILE A 40 5.799 -0.334 5.273 1.00 0.00 H new ATOM 0 HD13 ILE A 40 4.184 0.274 5.708 1.00 0.00 H new ATOM 596 N PHE A 41 4.424 -5.646 5.214 1.00 0.00 N ATOM 597 CA PHE A 41 3.796 -6.819 4.618 1.00 0.00 C ATOM 598 C PHE A 41 2.321 -6.899 4.999 1.00 0.00 C ATOM 599 O PHE A 41 1.974 -6.918 6.179 1.00 0.00 O ATOM 600 CB PHE A 41 4.519 -8.093 5.062 1.00 0.00 C ATOM 601 CG PHE A 41 5.901 -8.228 4.490 1.00 0.00 C ATOM 602 CD1 PHE A 41 6.086 -8.435 3.132 1.00 0.00 C ATOM 603 CD2 PHE A 41 7.015 -8.148 5.309 1.00 0.00 C ATOM 604 CE1 PHE A 41 7.357 -8.559 2.603 1.00 0.00 C ATOM 605 CE2 PHE A 41 8.288 -8.271 4.785 1.00 0.00 C ATOM 606 CZ PHE A 41 8.459 -8.478 3.431 1.00 0.00 C ATOM 0 H PHE A 41 4.711 -5.769 6.185 1.00 0.00 H new ATOM 0 HA PHE A 41 3.869 -6.727 3.534 1.00 0.00 H new ATOM 0 HB2 PHE A 41 4.582 -8.105 6.150 1.00 0.00 H new ATOM 0 HB3 PHE A 41 3.926 -8.959 4.767 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.228 -8.500 2.480 1.00 0.00 H new ATOM 0 HD2 PHE A 41 6.887 -7.988 6.369 1.00 0.00 H new ATOM 0 HE1 PHE A 41 7.488 -8.719 1.543 1.00 0.00 H new ATOM 0 HE2 PHE A 41 9.148 -8.205 5.434 1.00 0.00 H new ATOM 0 HZ PHE A 41 9.453 -8.576 3.020 1.00 0.00 H new ATOM 616 N GLU A 42 1.456 -6.946 3.990 1.00 0.00 N ATOM 617 CA GLU A 42 0.018 -7.023 4.219 1.00 0.00 C ATOM 618 C GLU A 42 -0.648 -7.936 3.194 1.00 0.00 C ATOM 619 O GLU A 42 -0.341 -7.880 2.003 1.00 0.00 O ATOM 620 CB GLU A 42 -0.605 -5.627 4.157 1.00 0.00 C ATOM 621 CG GLU A 42 -0.507 -4.857 5.464 1.00 0.00 C ATOM 622 CD GLU A 42 -1.522 -5.320 6.491 1.00 0.00 C ATOM 623 OE1 GLU A 42 -2.585 -5.835 6.084 1.00 0.00 O ATOM 624 OE2 GLU A 42 -1.254 -5.167 7.701 1.00 0.00 O ATOM 0 H GLU A 42 1.726 -6.932 3.007 1.00 0.00 H new ATOM 0 HA GLU A 42 -0.145 -7.442 5.212 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -0.114 -5.054 3.370 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.654 -5.719 3.877 1.00 0.00 H new ATOM 0 HG2 GLU A 42 0.497 -4.970 5.874 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -0.653 -3.795 5.268 1.00 0.00 H new ATOM 631 N VAL A 43 -1.563 -8.777 3.666 1.00 0.00 N ATOM 632 CA VAL A 43 -2.274 -9.702 2.791 1.00 0.00 C ATOM 633 C VAL A 43 -3.744 -9.806 3.181 1.00 0.00 C ATOM 634 O VAL A 43 -4.095 -9.701 4.356 1.00 0.00 O ATOM 635 CB VAL A 43 -1.644 -11.107 2.829 1.00 0.00 C ATOM 636 CG1 VAL A 43 -2.464 -12.082 1.999 1.00 0.00 C ATOM 637 CG2 VAL A 43 -0.204 -11.057 2.340 1.00 0.00 C ATOM 0 H VAL A 43 -1.829 -8.837 4.649 1.00 0.00 H new ATOM 0 HA VAL A 43 -2.196 -9.304 1.779 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.642 -11.458 3.861 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -2.004 -13.069 2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.477 -12.138 2.398 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.500 -11.739 0.965 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.226 -12.058 2.373 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -0.180 -10.686 1.315 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.375 -10.392 2.981 1.00 0.00 H new ATOM 647 N VAL A 44 -4.601 -10.014 2.186 1.00 0.00 N ATOM 648 CA VAL A 44 -6.035 -10.134 2.425 1.00 0.00 C ATOM 649 C VAL A 44 -6.522 -11.550 2.137 1.00 0.00 C ATOM 650 O VAL A 44 -6.275 -12.096 1.063 1.00 0.00 O ATOM 651 CB VAL A 44 -6.833 -9.142 1.558 1.00 0.00 C ATOM 652 CG1 VAL A 44 -8.315 -9.215 1.891 1.00 0.00 C ATOM 653 CG2 VAL A 44 -6.305 -7.728 1.745 1.00 0.00 C ATOM 0 H VAL A 44 -4.327 -10.103 1.207 1.00 0.00 H new ATOM 0 HA VAL A 44 -6.202 -9.902 3.477 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.706 -9.417 0.511 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.863 -8.507 1.269 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.681 -10.224 1.702 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.465 -8.966 2.942 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.880 -7.040 1.125 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.400 -7.440 2.792 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.256 -7.690 1.452 1.00 0.00 H new ATOM 663 N GLU A 45 -7.218 -12.138 3.106 1.00 0.00 N ATOM 664 CA GLU A 45 -7.740 -13.491 2.956 1.00 0.00 C ATOM 665 C GLU A 45 -9.183 -13.466 2.460 1.00 0.00 C ATOM 666 O GLU A 45 -9.566 -14.251 1.594 1.00 0.00 O ATOM 667 CB GLU A 45 -7.660 -14.243 4.287 1.00 0.00 C ATOM 668 CG GLU A 45 -6.326 -14.932 4.517 1.00 0.00 C ATOM 669 CD GLU A 45 -6.396 -15.993 5.598 1.00 0.00 C ATOM 670 OE1 GLU A 45 -7.430 -16.689 5.679 1.00 0.00 O ATOM 671 OE2 GLU A 45 -5.418 -16.128 6.363 1.00 0.00 O ATOM 0 H GLU A 45 -7.433 -11.699 4.001 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.129 -14.009 2.217 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -7.843 -13.543 5.102 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.455 -14.988 4.322 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.992 -15.389 3.586 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.579 -14.187 4.792 1.00 0.00 H new ATOM 678 N GLN A 46 -9.978 -12.557 3.017 1.00 0.00 N ATOM 679 CA GLN A 46 -11.378 -12.430 2.632 1.00 0.00 C ATOM 680 C GLN A 46 -11.524 -11.566 1.384 1.00 0.00 C ATOM 681 O GLN A 46 -11.329 -10.351 1.432 1.00 0.00 O ATOM 682 CB GLN A 46 -12.192 -11.830 3.780 1.00 0.00 C ATOM 683 CG GLN A 46 -12.215 -12.698 5.028 1.00 0.00 C ATOM 684 CD GLN A 46 -12.747 -11.961 6.241 1.00 0.00 C ATOM 685 OE1 GLN A 46 -13.952 -11.953 6.498 1.00 0.00 O ATOM 686 NE2 GLN A 46 -11.851 -11.336 6.995 1.00 0.00 N ATOM 0 H GLN A 46 -9.676 -11.899 3.735 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.758 -13.427 2.408 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -11.781 -10.853 4.034 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -13.215 -11.667 3.442 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -12.831 -13.578 4.843 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -11.206 -13.054 5.237 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -10.863 -11.369 6.745 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -12.151 -10.823 7.824 1.00 0.00 H new ATOM 695 N ALA A 47 -11.866 -12.200 0.267 1.00 0.00 N ATOM 696 CA ALA A 47 -12.039 -11.488 -0.993 1.00 0.00 C ATOM 697 C ALA A 47 -13.040 -10.347 -0.847 1.00 0.00 C ATOM 698 O ALA A 47 -13.606 -10.139 0.225 1.00 0.00 O ATOM 699 CB ALA A 47 -12.487 -12.449 -2.085 1.00 0.00 C ATOM 0 H ALA A 47 -12.029 -13.205 0.209 1.00 0.00 H new ATOM 0 HA ALA A 47 -11.077 -11.059 -1.274 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -12.612 -11.904 -3.020 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -11.735 -13.227 -2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -13.435 -12.906 -1.801 1.00 0.00 H new ATOM 705 N GLY A 48 -13.253 -9.610 -1.933 1.00 0.00 N ATOM 706 CA GLY A 48 -14.186 -8.498 -1.903 1.00 0.00 C ATOM 707 C GLY A 48 -13.937 -7.564 -0.736 1.00 0.00 C ATOM 708 O GLY A 48 -14.812 -6.785 -0.358 1.00 0.00 O ATOM 0 H GLY A 48 -12.797 -9.763 -2.832 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -14.109 -7.938 -2.835 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -15.204 -8.883 -1.845 1.00 0.00 H new ATOM 712 N ALA A 49 -12.741 -7.642 -0.162 1.00 0.00 N ATOM 713 CA ALA A 49 -12.380 -6.796 0.969 1.00 0.00 C ATOM 714 C ALA A 49 -12.087 -5.369 0.516 1.00 0.00 C ATOM 715 O ALA A 49 -11.513 -5.153 -0.552 1.00 0.00 O ATOM 716 CB ALA A 49 -11.178 -7.377 1.700 1.00 0.00 C ATOM 0 H ALA A 49 -12.006 -8.282 -0.462 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.228 -6.765 1.653 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -10.919 -6.735 2.542 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.422 -8.375 2.065 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.331 -7.438 1.017 1.00 0.00 H new ATOM 722 N ILE A 50 -12.485 -4.401 1.333 1.00 0.00 N ATOM 723 CA ILE A 50 -12.265 -2.995 1.016 1.00 0.00 C ATOM 724 C ILE A 50 -10.837 -2.574 1.348 1.00 0.00 C ATOM 725 O ILE A 50 -10.410 -2.647 2.501 1.00 0.00 O ATOM 726 CB ILE A 50 -13.247 -2.085 1.777 1.00 0.00 C ATOM 727 CG1 ILE A 50 -14.691 -2.465 1.444 1.00 0.00 C ATOM 728 CG2 ILE A 50 -12.986 -0.625 1.439 1.00 0.00 C ATOM 729 CD1 ILE A 50 -15.109 -3.805 2.008 1.00 0.00 C ATOM 0 H ILE A 50 -12.962 -4.564 2.220 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.435 -2.883 -0.055 1.00 0.00 H new ATOM 0 HB ILE A 50 -13.093 -2.223 2.847 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -15.359 -1.694 1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -14.813 -2.482 0.361 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -13.688 0.006 1.984 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -11.967 -0.363 1.722 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -13.116 -0.471 0.368 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -16.144 -4.009 1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.465 -4.586 1.604 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -15.020 -3.787 3.094 1.00 0.00 H new ATOM 741 N ILE A 51 -10.105 -2.132 0.332 1.00 0.00 N ATOM 742 CA ILE A 51 -8.726 -1.696 0.517 1.00 0.00 C ATOM 743 C ILE A 51 -8.663 -0.225 0.912 1.00 0.00 C ATOM 744 O ILE A 51 -7.844 0.172 1.742 1.00 0.00 O ATOM 745 CB ILE A 51 -7.892 -1.909 -0.761 1.00 0.00 C ATOM 746 CG1 ILE A 51 -8.337 -3.184 -1.479 1.00 0.00 C ATOM 747 CG2 ILE A 51 -6.411 -1.975 -0.421 1.00 0.00 C ATOM 748 CD1 ILE A 51 -8.171 -4.436 -0.647 1.00 0.00 C ATOM 0 H ILE A 51 -10.443 -2.066 -0.628 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.308 -2.304 1.320 1.00 0.00 H new ATOM 0 HB ILE A 51 -8.054 -1.063 -1.429 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -9.384 -3.084 -1.765 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.764 -3.291 -2.400 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -5.835 -2.126 -1.334 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -6.104 -1.042 0.052 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -6.231 -2.805 0.263 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.506 -5.301 -1.220 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -7.121 -4.561 -0.383 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.766 -4.350 0.262 1.00 0.00 H new ATOM 760 N LEU A 52 -9.534 0.581 0.314 1.00 0.00 N ATOM 761 CA LEU A 52 -9.580 2.010 0.605 1.00 0.00 C ATOM 762 C LEU A 52 -10.979 2.569 0.368 1.00 0.00 C ATOM 763 O LEU A 52 -11.601 2.298 -0.658 1.00 0.00 O ATOM 764 CB LEU A 52 -8.566 2.759 -0.261 1.00 0.00 C ATOM 765 CG LEU A 52 -7.108 2.319 -0.120 1.00 0.00 C ATOM 766 CD1 LEU A 52 -6.281 2.830 -1.290 1.00 0.00 C ATOM 767 CD2 LEU A 52 -6.529 2.807 1.199 1.00 0.00 C ATOM 0 H LEU A 52 -10.218 0.269 -0.375 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.326 2.150 1.656 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.858 2.649 -1.305 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.629 3.821 -0.023 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.075 1.230 -0.127 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.246 2.507 -1.173 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.682 2.430 -2.221 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.321 3.919 -1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.491 2.485 1.282 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.575 3.895 1.236 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.105 2.391 2.025 1.00 0.00 H new ATOM 779 N GLU A 53 -11.467 3.353 1.325 1.00 0.00 N ATOM 780 CA GLU A 53 -12.792 3.951 1.219 1.00 0.00 C ATOM 781 C GLU A 53 -12.722 5.312 0.533 1.00 0.00 C ATOM 782 O GLU A 53 -11.684 5.974 0.548 1.00 0.00 O ATOM 783 CB GLU A 53 -13.421 4.100 2.606 1.00 0.00 C ATOM 784 CG GLU A 53 -14.062 2.823 3.124 1.00 0.00 C ATOM 785 CD GLU A 53 -14.965 3.066 4.318 1.00 0.00 C ATOM 786 OE1 GLU A 53 -14.459 3.541 5.357 1.00 0.00 O ATOM 787 OE2 GLU A 53 -16.176 2.782 4.214 1.00 0.00 O ATOM 0 H GLU A 53 -10.965 3.588 2.181 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.413 3.290 0.615 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -12.655 4.424 3.310 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.175 4.887 2.571 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -14.640 2.361 2.324 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.281 2.116 3.402 1.00 0.00 H new ATOM 794 N ASP A 54 -13.832 5.722 -0.070 1.00 0.00 N ATOM 795 CA ASP A 54 -13.898 7.004 -0.762 1.00 0.00 C ATOM 796 C ASP A 54 -13.701 8.160 0.214 1.00 0.00 C ATOM 797 O ASP A 54 -14.375 8.240 1.240 1.00 0.00 O ATOM 798 CB ASP A 54 -15.239 7.151 -1.483 1.00 0.00 C ATOM 799 CG ASP A 54 -16.315 7.735 -0.589 1.00 0.00 C ATOM 800 OD1 ASP A 54 -17.016 6.951 0.086 1.00 0.00 O ATOM 801 OD2 ASP A 54 -16.456 8.975 -0.564 1.00 0.00 O ATOM 0 H ASP A 54 -14.699 5.185 -0.094 1.00 0.00 H new ATOM 0 HA ASP A 54 -13.094 7.033 -1.498 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.110 7.790 -2.357 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -15.562 6.175 -1.846 1.00 0.00 H new ATOM 806 N GLY A 55 -12.773 9.053 -0.114 1.00 0.00 N ATOM 807 CA GLY A 55 -12.503 10.192 0.745 1.00 0.00 C ATOM 808 C GLY A 55 -11.491 9.875 1.828 1.00 0.00 C ATOM 809 O GLY A 55 -11.398 10.588 2.826 1.00 0.00 O ATOM 0 H GLY A 55 -12.203 9.009 -0.959 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.135 11.020 0.140 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -13.433 10.523 1.207 1.00 0.00 H new ATOM 813 N GLN A 56 -10.732 8.802 1.630 1.00 0.00 N ATOM 814 CA GLN A 56 -9.723 8.391 2.599 1.00 0.00 C ATOM 815 C GLN A 56 -8.387 9.069 2.315 1.00 0.00 C ATOM 816 O GLN A 56 -7.774 8.840 1.272 1.00 0.00 O ATOM 817 CB GLN A 56 -9.552 6.871 2.577 1.00 0.00 C ATOM 818 CG GLN A 56 -8.716 6.336 3.728 1.00 0.00 C ATOM 819 CD GLN A 56 -8.982 4.871 4.011 1.00 0.00 C ATOM 820 OE1 GLN A 56 -10.091 4.378 3.801 1.00 0.00 O ATOM 821 NE2 GLN A 56 -7.964 4.165 4.489 1.00 0.00 N ATOM 0 H GLN A 56 -10.797 8.202 0.808 1.00 0.00 H new ATOM 0 HA GLN A 56 -10.062 8.697 3.589 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -10.536 6.403 2.605 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -9.087 6.580 1.635 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -7.659 6.472 3.498 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -8.924 6.919 4.625 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.062 4.614 4.648 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -8.084 3.174 4.697 1.00 0.00 H new ATOM 830 N GLU A 57 -7.941 9.904 3.248 1.00 0.00 N ATOM 831 CA GLU A 57 -6.678 10.616 3.096 1.00 0.00 C ATOM 832 C GLU A 57 -5.520 9.637 2.920 1.00 0.00 C ATOM 833 O GLU A 57 -4.882 9.232 3.892 1.00 0.00 O ATOM 834 CB GLU A 57 -6.422 11.513 4.309 1.00 0.00 C ATOM 835 CG GLU A 57 -5.039 12.142 4.320 1.00 0.00 C ATOM 836 CD GLU A 57 -4.559 12.470 5.721 1.00 0.00 C ATOM 837 OE1 GLU A 57 -5.410 12.764 6.586 1.00 0.00 O ATOM 838 OE2 GLU A 57 -3.332 12.434 5.950 1.00 0.00 O ATOM 0 H GLU A 57 -8.436 10.104 4.117 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.746 11.237 2.203 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -7.172 12.304 4.330 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.552 10.926 5.218 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -4.331 11.462 3.847 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -5.053 13.053 3.722 1.00 0.00 H new ATOM 845 N LEU A 58 -5.255 9.262 1.674 1.00 0.00 N ATOM 846 CA LEU A 58 -4.175 8.330 1.369 1.00 0.00 C ATOM 847 C LEU A 58 -2.849 8.829 1.935 1.00 0.00 C ATOM 848 O LEU A 58 -2.366 9.899 1.562 1.00 0.00 O ATOM 849 CB LEU A 58 -4.055 8.135 -0.144 1.00 0.00 C ATOM 850 CG LEU A 58 -5.310 7.633 -0.857 1.00 0.00 C ATOM 851 CD1 LEU A 58 -5.236 7.937 -2.346 1.00 0.00 C ATOM 852 CD2 LEU A 58 -5.496 6.141 -0.624 1.00 0.00 C ATOM 0 H LEU A 58 -5.773 9.589 0.858 1.00 0.00 H new ATOM 0 HA LEU A 58 -4.411 7.373 1.835 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.763 9.085 -0.591 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.246 7.431 -0.336 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.173 8.155 -0.443 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.138 7.572 -2.837 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.152 9.014 -2.494 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.364 7.443 -2.775 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.395 5.802 -1.139 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.631 5.602 -1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.596 5.949 0.444 1.00 0.00 H new ATOM 864 N ASP A 59 -2.265 8.047 2.836 1.00 0.00 N ATOM 865 CA ASP A 59 -0.993 8.408 3.452 1.00 0.00 C ATOM 866 C ASP A 59 0.077 7.368 3.138 1.00 0.00 C ATOM 867 O ASP A 59 1.272 7.656 3.193 1.00 0.00 O ATOM 868 CB ASP A 59 -1.157 8.548 4.966 1.00 0.00 C ATOM 869 CG ASP A 59 0.108 9.040 5.642 1.00 0.00 C ATOM 870 OD1 ASP A 59 1.090 8.271 5.695 1.00 0.00 O ATOM 871 OD2 ASP A 59 0.115 10.195 6.117 1.00 0.00 O ATOM 0 H ASP A 59 -2.652 7.159 3.156 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.676 9.365 3.039 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -1.972 9.240 5.178 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -1.440 7.584 5.389 1.00 0.00 H new ATOM 876 N SER A 60 -0.361 6.156 2.809 1.00 0.00 N ATOM 877 CA SER A 60 0.560 5.071 2.491 1.00 0.00 C ATOM 878 C SER A 60 0.384 4.615 1.046 1.00 0.00 C ATOM 879 O SER A 60 -0.715 4.675 0.494 1.00 0.00 O ATOM 880 CB SER A 60 0.338 3.891 3.440 1.00 0.00 C ATOM 881 OG SER A 60 0.370 4.312 4.793 1.00 0.00 O ATOM 0 H SER A 60 -1.347 5.901 2.756 1.00 0.00 H new ATOM 0 HA SER A 60 1.577 5.443 2.615 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.622 3.422 3.224 1.00 0.00 H new ATOM 0 HB3 SER A 60 1.106 3.136 3.272 1.00 0.00 H new ATOM 0 HG SER A 60 0.224 3.540 5.379 1.00 0.00 H new ATOM 887 N TRP A 61 1.474 4.161 0.439 1.00 0.00 N ATOM 888 CA TRP A 61 1.442 3.695 -0.943 1.00 0.00 C ATOM 889 C TRP A 61 1.134 2.203 -1.007 1.00 0.00 C ATOM 890 O TRP A 61 1.721 1.406 -0.275 1.00 0.00 O ATOM 891 CB TRP A 61 2.777 3.983 -1.631 1.00 0.00 C ATOM 892 CG TRP A 61 2.761 3.695 -3.102 1.00 0.00 C ATOM 893 CD1 TRP A 61 1.755 3.976 -3.981 1.00 0.00 C ATOM 894 CD2 TRP A 61 3.798 3.068 -3.864 1.00 0.00 C ATOM 895 NE1 TRP A 61 2.104 3.562 -5.244 1.00 0.00 N ATOM 896 CE2 TRP A 61 3.353 3.002 -5.199 1.00 0.00 C ATOM 897 CE3 TRP A 61 5.060 2.557 -3.548 1.00 0.00 C ATOM 898 CZ2 TRP A 61 4.126 2.445 -6.214 1.00 0.00 C ATOM 899 CZ3 TRP A 61 5.826 2.004 -4.557 1.00 0.00 C ATOM 900 CH2 TRP A 61 5.358 1.952 -5.877 1.00 0.00 C ATOM 0 H TRP A 61 2.391 4.105 0.882 1.00 0.00 H new ATOM 0 HA TRP A 61 0.650 4.233 -1.464 1.00 0.00 H new ATOM 0 HB2 TRP A 61 3.039 5.029 -1.476 1.00 0.00 H new ATOM 0 HB3 TRP A 61 3.557 3.385 -1.159 1.00 0.00 H new ATOM 0 HD1 TRP A 61 0.822 4.454 -3.722 1.00 0.00 H new ATOM 0 HE1 TRP A 61 1.527 3.656 -6.079 1.00 0.00 H new ATOM 0 HE3 TRP A 61 5.430 2.594 -2.534 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 3.766 2.403 -7.232 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 6.802 1.605 -4.324 1.00 0.00 H new ATOM 0 HH2 TRP A 61 5.981 1.515 -6.643 1.00 0.00 H new ATOM 911 N TYR A 62 0.210 1.831 -1.886 1.00 0.00 N ATOM 912 CA TYR A 62 -0.177 0.435 -2.044 1.00 0.00 C ATOM 913 C TYR A 62 0.163 -0.070 -3.443 1.00 0.00 C ATOM 914 O TYR A 62 -0.138 0.584 -4.442 1.00 0.00 O ATOM 915 CB TYR A 62 -1.674 0.265 -1.778 1.00 0.00 C ATOM 916 CG TYR A 62 -2.104 0.746 -0.410 1.00 0.00 C ATOM 917 CD1 TYR A 62 -2.305 2.097 -0.158 1.00 0.00 C ATOM 918 CD2 TYR A 62 -2.309 -0.152 0.630 1.00 0.00 C ATOM 919 CE1 TYR A 62 -2.697 2.541 1.090 1.00 0.00 C ATOM 920 CE2 TYR A 62 -2.703 0.282 1.881 1.00 0.00 C ATOM 921 CZ TYR A 62 -2.895 1.629 2.106 1.00 0.00 C ATOM 922 OH TYR A 62 -3.287 2.067 3.350 1.00 0.00 O ATOM 0 H TYR A 62 -0.285 2.478 -2.500 1.00 0.00 H new ATOM 0 HA TYR A 62 0.383 -0.155 -1.318 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.234 0.810 -2.538 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.936 -0.788 -1.883 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.152 2.813 -0.952 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.158 -1.207 0.458 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.848 3.595 1.269 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.860 -0.430 2.678 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.384 1.299 3.952 1.00 0.00 H new ATOM 932 N VAL A 63 0.791 -1.240 -3.507 1.00 0.00 N ATOM 933 CA VAL A 63 1.171 -1.835 -4.782 1.00 0.00 C ATOM 934 C VAL A 63 0.704 -3.283 -4.874 1.00 0.00 C ATOM 935 O VAL A 63 1.124 -4.132 -4.087 1.00 0.00 O ATOM 936 CB VAL A 63 2.696 -1.785 -4.994 1.00 0.00 C ATOM 937 CG1 VAL A 63 3.077 -2.466 -6.299 1.00 0.00 C ATOM 938 CG2 VAL A 63 3.189 -0.346 -4.969 1.00 0.00 C ATOM 0 H VAL A 63 1.047 -1.794 -2.690 1.00 0.00 H new ATOM 0 HA VAL A 63 0.684 -1.249 -5.561 1.00 0.00 H new ATOM 0 HB VAL A 63 3.177 -2.324 -4.178 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.158 -2.420 -6.431 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.758 -3.508 -6.272 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.588 -1.958 -7.131 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.268 -0.328 -5.120 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.702 0.219 -5.764 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.950 0.104 -4.005 1.00 0.00 H new ATOM 948 N ILE A 64 -0.167 -3.559 -5.839 1.00 0.00 N ATOM 949 CA ILE A 64 -0.690 -4.905 -6.034 1.00 0.00 C ATOM 950 C ILE A 64 0.441 -5.918 -6.181 1.00 0.00 C ATOM 951 O ILE A 64 1.090 -5.993 -7.225 1.00 0.00 O ATOM 952 CB ILE A 64 -1.598 -4.982 -7.276 1.00 0.00 C ATOM 953 CG1 ILE A 64 -2.768 -4.006 -7.140 1.00 0.00 C ATOM 954 CG2 ILE A 64 -2.106 -6.403 -7.473 1.00 0.00 C ATOM 955 CD1 ILE A 64 -3.513 -3.772 -8.435 1.00 0.00 C ATOM 0 H ILE A 64 -0.525 -2.868 -6.498 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.278 -5.146 -5.149 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.015 -4.701 -8.153 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -3.464 -4.388 -6.394 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.394 -3.052 -6.768 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.746 -6.442 -8.354 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.260 -7.076 -7.609 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.676 -6.710 -6.596 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.329 -3.070 -8.264 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.830 -3.360 -9.178 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.918 -4.717 -8.798 1.00 0.00 H new ATOM 967 N LEU A 65 0.670 -6.697 -5.130 1.00 0.00 N ATOM 968 CA LEU A 65 1.721 -7.709 -5.142 1.00 0.00 C ATOM 969 C LEU A 65 1.238 -8.989 -5.816 1.00 0.00 C ATOM 970 O LEU A 65 2.003 -9.669 -6.498 1.00 0.00 O ATOM 971 CB LEU A 65 2.181 -8.012 -3.715 1.00 0.00 C ATOM 972 CG LEU A 65 2.851 -6.860 -2.966 1.00 0.00 C ATOM 973 CD1 LEU A 65 3.334 -7.321 -1.600 1.00 0.00 C ATOM 974 CD2 LEU A 65 4.006 -6.295 -3.780 1.00 0.00 C ATOM 0 H LEU A 65 0.142 -6.648 -4.259 1.00 0.00 H new ATOM 0 HA LEU A 65 2.563 -7.316 -5.713 1.00 0.00 H new ATOM 0 HB2 LEU A 65 1.316 -8.340 -3.138 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.877 -8.850 -3.749 1.00 0.00 H new ATOM 0 HG LEU A 65 2.115 -6.069 -2.820 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.808 -6.488 -1.081 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.486 -7.677 -1.015 1.00 0.00 H new ATOM 0 HD13 LEU A 65 4.055 -8.129 -1.723 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.471 -5.476 -3.232 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.743 -7.078 -3.957 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.632 -5.926 -4.735 1.00 0.00 H new ATOM 986 N ASN A 66 -0.037 -9.309 -5.622 1.00 0.00 N ATOM 987 CA ASN A 66 -0.623 -10.506 -6.212 1.00 0.00 C ATOM 988 C ASN A 66 -2.147 -10.444 -6.170 1.00 0.00 C ATOM 989 O ASN A 66 -2.733 -9.972 -5.196 1.00 0.00 O ATOM 990 CB ASN A 66 -0.132 -11.755 -5.477 1.00 0.00 C ATOM 991 CG ASN A 66 -0.454 -13.032 -6.230 1.00 0.00 C ATOM 992 OD1 ASN A 66 0.285 -13.440 -7.126 1.00 0.00 O ATOM 993 ND2 ASN A 66 -1.560 -13.670 -5.867 1.00 0.00 N ATOM 0 H ASN A 66 -0.684 -8.756 -5.060 1.00 0.00 H new ATOM 0 HA ASN A 66 -0.308 -10.558 -7.254 1.00 0.00 H new ATOM 0 HB2 ASN A 66 0.946 -11.686 -5.328 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -0.588 -11.794 -4.488 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -1.827 -14.535 -6.336 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -2.143 -13.295 -5.119 1.00 0.00 H new ATOM 1000 N GLY A 67 -2.784 -10.924 -7.234 1.00 0.00 N ATOM 1001 CA GLY A 67 -4.234 -10.914 -7.298 1.00 0.00 C ATOM 1002 C GLY A 67 -4.769 -9.771 -8.137 1.00 0.00 C ATOM 1003 O GLY A 67 -4.020 -9.123 -8.868 1.00 0.00 O ATOM 0 H GLY A 67 -2.322 -11.320 -8.053 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.583 -11.860 -7.713 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.639 -10.840 -6.289 1.00 0.00 H new ATOM 1007 N THR A 68 -6.071 -9.522 -8.033 1.00 0.00 N ATOM 1008 CA THR A 68 -6.707 -8.451 -8.790 1.00 0.00 C ATOM 1009 C THR A 68 -7.615 -7.612 -7.899 1.00 0.00 C ATOM 1010 O THR A 68 -8.346 -8.144 -7.063 1.00 0.00 O ATOM 1011 CB THR A 68 -7.533 -9.008 -9.965 1.00 0.00 C ATOM 1012 OG1 THR A 68 -6.673 -9.676 -10.895 1.00 0.00 O ATOM 1013 CG2 THR A 68 -8.285 -7.892 -10.675 1.00 0.00 C ATOM 0 H THR A 68 -6.705 -10.048 -7.432 1.00 0.00 H new ATOM 0 HA THR A 68 -5.907 -7.823 -9.182 1.00 0.00 H new ATOM 0 HB THR A 68 -8.258 -9.717 -9.566 1.00 0.00 H new ATOM 0 HG1 THR A 68 -7.206 -10.028 -11.638 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.861 -8.309 -11.501 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.960 -7.404 -9.972 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.573 -7.162 -11.061 1.00 0.00 H new ATOM 1021 N VAL A 69 -7.564 -6.296 -8.082 1.00 0.00 N ATOM 1022 CA VAL A 69 -8.384 -5.383 -7.295 1.00 0.00 C ATOM 1023 C VAL A 69 -9.278 -4.535 -8.193 1.00 0.00 C ATOM 1024 O VAL A 69 -8.829 -4.004 -9.208 1.00 0.00 O ATOM 1025 CB VAL A 69 -7.514 -4.452 -6.429 1.00 0.00 C ATOM 1026 CG1 VAL A 69 -6.793 -5.246 -5.351 1.00 0.00 C ATOM 1027 CG2 VAL A 69 -6.522 -3.692 -7.296 1.00 0.00 C ATOM 0 H VAL A 69 -6.964 -5.839 -8.768 1.00 0.00 H new ATOM 0 HA VAL A 69 -9.006 -5.997 -6.644 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.164 -3.727 -5.939 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -6.183 -4.572 -4.749 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -7.525 -5.741 -4.713 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -6.153 -5.995 -5.817 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.916 -3.039 -6.668 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.875 -4.400 -7.815 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -7.063 -3.092 -8.027 1.00 0.00 H new ATOM 1037 N GLU A 70 -10.545 -4.411 -7.810 1.00 0.00 N ATOM 1038 CA GLU A 70 -11.502 -3.627 -8.581 1.00 0.00 C ATOM 1039 C GLU A 70 -11.801 -2.300 -7.890 1.00 0.00 C ATOM 1040 O GLU A 70 -12.040 -2.256 -6.683 1.00 0.00 O ATOM 1041 CB GLU A 70 -12.799 -4.415 -8.778 1.00 0.00 C ATOM 1042 CG GLU A 70 -13.861 -3.655 -9.555 1.00 0.00 C ATOM 1043 CD GLU A 70 -15.245 -4.253 -9.391 1.00 0.00 C ATOM 1044 OE1 GLU A 70 -15.870 -4.018 -8.336 1.00 0.00 O ATOM 1045 OE2 GLU A 70 -15.701 -4.957 -10.316 1.00 0.00 O ATOM 0 H GLU A 70 -10.932 -4.843 -6.971 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.060 -3.418 -9.555 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.574 -5.344 -9.301 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.200 -4.688 -7.802 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.876 -2.617 -9.222 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.596 -3.647 -10.612 1.00 0.00 H new ATOM 1052 N ILE A 71 -11.785 -1.220 -8.664 1.00 0.00 N ATOM 1053 CA ILE A 71 -12.054 0.108 -8.127 1.00 0.00 C ATOM 1054 C ILE A 71 -13.383 0.650 -8.642 1.00 0.00 C ATOM 1055 O ILE A 71 -13.692 0.541 -9.829 1.00 0.00 O ATOM 1056 CB ILE A 71 -10.932 1.100 -8.490 1.00 0.00 C ATOM 1057 CG1 ILE A 71 -9.602 0.642 -7.888 1.00 0.00 C ATOM 1058 CG2 ILE A 71 -11.286 2.499 -8.007 1.00 0.00 C ATOM 1059 CD1 ILE A 71 -8.428 1.506 -8.291 1.00 0.00 C ATOM 0 H ILE A 71 -11.589 -1.239 -9.665 1.00 0.00 H new ATOM 0 HA ILE A 71 -12.101 0.007 -7.043 1.00 0.00 H new ATOM 0 HB ILE A 71 -10.827 1.127 -9.575 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -9.686 0.640 -6.801 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -9.408 -0.386 -8.194 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -10.484 3.189 -8.271 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -12.213 2.823 -8.479 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -11.414 2.489 -6.925 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -7.519 1.123 -7.828 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -8.318 1.488 -9.375 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -8.600 2.530 -7.961 1.00 0.00 H new ATOM 1071 N SER A 72 -14.165 1.237 -7.742 1.00 0.00 N ATOM 1072 CA SER A 72 -15.462 1.795 -8.104 1.00 0.00 C ATOM 1073 C SER A 72 -15.526 3.283 -7.771 1.00 0.00 C ATOM 1074 O SER A 72 -15.159 3.701 -6.672 1.00 0.00 O ATOM 1075 CB SER A 72 -16.583 1.050 -7.377 1.00 0.00 C ATOM 1076 OG SER A 72 -17.850 1.382 -7.917 1.00 0.00 O ATOM 0 H SER A 72 -13.923 1.338 -6.756 1.00 0.00 H new ATOM 0 HA SER A 72 -15.593 1.675 -9.179 1.00 0.00 H new ATOM 0 HB2 SER A 72 -16.421 -0.025 -7.457 1.00 0.00 H new ATOM 0 HB3 SER A 72 -16.560 1.298 -6.316 1.00 0.00 H new ATOM 0 HG SER A 72 -18.549 0.892 -7.436 1.00 0.00 H new ATOM 1082 N HIS A 73 -15.996 4.078 -8.727 1.00 0.00 N ATOM 1083 CA HIS A 73 -16.109 5.519 -8.536 1.00 0.00 C ATOM 1084 C HIS A 73 -17.554 5.918 -8.256 1.00 0.00 C ATOM 1085 O HIS A 73 -18.500 5.303 -8.748 1.00 0.00 O ATOM 1086 CB HIS A 73 -15.593 6.260 -9.770 1.00 0.00 C ATOM 1087 CG HIS A 73 -14.103 6.218 -9.915 1.00 0.00 C ATOM 1088 ND1 HIS A 73 -13.254 7.040 -9.205 1.00 0.00 N ATOM 1089 CD2 HIS A 73 -13.311 5.444 -10.694 1.00 0.00 C ATOM 1090 CE1 HIS A 73 -12.004 6.774 -9.541 1.00 0.00 C ATOM 1091 NE2 HIS A 73 -12.011 5.810 -10.443 1.00 0.00 N ATOM 0 H HIS A 73 -16.305 3.748 -9.642 1.00 0.00 H new ATOM 0 HA HIS A 73 -15.501 5.795 -7.675 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -16.049 5.827 -10.660 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -15.916 7.300 -9.720 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -13.545 7.744 -8.526 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -13.640 4.681 -11.384 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -11.126 7.262 -9.145 1.00 0.00 H new ATOM 1100 N PRO A 74 -17.731 6.972 -7.445 1.00 0.00 N ATOM 1101 CA PRO A 74 -19.059 7.476 -7.080 1.00 0.00 C ATOM 1102 C PRO A 74 -19.771 8.137 -8.256 1.00 0.00 C ATOM 1103 O PRO A 74 -20.991 8.298 -8.243 1.00 0.00 O ATOM 1104 CB PRO A 74 -18.759 8.506 -5.988 1.00 0.00 C ATOM 1105 CG PRO A 74 -17.363 8.950 -6.259 1.00 0.00 C ATOM 1106 CD PRO A 74 -16.649 7.752 -6.822 1.00 0.00 C ATOM 0 HA PRO A 74 -19.725 6.676 -6.758 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -19.456 9.343 -6.031 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -18.849 8.067 -4.994 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -17.348 9.781 -6.965 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -16.880 9.299 -5.346 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.891 8.041 -7.550 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -16.141 7.184 -6.043 1.00 0.00 H new ATOM 1114 N ASP A 75 -19.001 8.517 -9.269 1.00 0.00 N ATOM 1115 CA ASP A 75 -19.559 9.159 -10.454 1.00 0.00 C ATOM 1116 C ASP A 75 -20.231 8.135 -11.362 1.00 0.00 C ATOM 1117 O ASP A 75 -21.337 8.355 -11.852 1.00 0.00 O ATOM 1118 CB ASP A 75 -18.463 9.900 -11.222 1.00 0.00 C ATOM 1119 CG ASP A 75 -17.591 10.747 -10.316 1.00 0.00 C ATOM 1120 OD1 ASP A 75 -18.141 11.616 -9.607 1.00 0.00 O ATOM 1121 OD2 ASP A 75 -16.360 10.539 -10.315 1.00 0.00 O ATOM 0 H ASP A 75 -17.989 8.392 -9.294 1.00 0.00 H new ATOM 0 HA ASP A 75 -20.312 9.877 -10.128 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -17.840 9.177 -11.748 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -18.921 10.537 -11.979 1.00 0.00 H new ATOM 1126 N GLY A 76 -19.553 7.012 -11.583 1.00 0.00 N ATOM 1127 CA GLY A 76 -20.099 5.971 -12.434 1.00 0.00 C ATOM 1128 C GLY A 76 -19.038 5.300 -13.283 1.00 0.00 C ATOM 1129 O GLY A 76 -19.307 4.880 -14.409 1.00 0.00 O ATOM 0 H GLY A 76 -18.636 6.805 -11.188 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -20.592 5.222 -11.815 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -20.862 6.400 -13.084 1.00 0.00 H new ATOM 1133 N LYS A 77 -17.827 5.201 -12.746 1.00 0.00 N ATOM 1134 CA LYS A 77 -16.720 4.577 -13.461 1.00 0.00 C ATOM 1135 C LYS A 77 -16.031 3.530 -12.592 1.00 0.00 C ATOM 1136 O LYS A 77 -15.928 3.689 -11.375 1.00 0.00 O ATOM 1137 CB LYS A 77 -15.708 5.637 -13.901 1.00 0.00 C ATOM 1138 CG LYS A 77 -14.754 5.157 -14.980 1.00 0.00 C ATOM 1139 CD LYS A 77 -13.966 6.309 -15.581 1.00 0.00 C ATOM 1140 CE LYS A 77 -13.075 6.975 -14.543 1.00 0.00 C ATOM 1141 NZ LYS A 77 -12.502 8.255 -15.044 1.00 0.00 N ATOM 0 H LYS A 77 -17.587 5.545 -11.816 1.00 0.00 H new ATOM 0 HA LYS A 77 -17.124 4.081 -14.343 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -16.246 6.511 -14.267 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -15.131 5.958 -13.034 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -14.065 4.425 -14.558 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -15.316 4.651 -15.765 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.355 5.942 -16.406 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -14.654 7.044 -15.997 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -13.651 7.165 -13.638 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -12.266 6.297 -14.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -11.901 8.678 -14.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -11.931 8.071 -15.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -13.273 8.911 -15.281 1.00 0.00 H new ATOM 1155 N VAL A 78 -15.559 2.460 -13.224 1.00 0.00 N ATOM 1156 CA VAL A 78 -14.878 1.388 -12.508 1.00 0.00 C ATOM 1157 C VAL A 78 -13.521 1.085 -13.135 1.00 0.00 C ATOM 1158 O VAL A 78 -13.426 0.814 -14.331 1.00 0.00 O ATOM 1159 CB VAL A 78 -15.721 0.100 -12.489 1.00 0.00 C ATOM 1160 CG1 VAL A 78 -15.032 -0.979 -11.668 1.00 0.00 C ATOM 1161 CG2 VAL A 78 -17.115 0.384 -11.949 1.00 0.00 C ATOM 0 H VAL A 78 -15.636 2.313 -14.230 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.734 1.733 -11.484 1.00 0.00 H new ATOM 0 HB VAL A 78 -15.819 -0.264 -13.512 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -15.643 -1.881 -11.667 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -14.058 -1.201 -12.104 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -14.900 -0.629 -10.644 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -17.697 -0.537 -11.943 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -17.040 0.773 -10.933 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -17.608 1.120 -12.584 1.00 0.00 H new ATOM 1171 N GLU A 79 -12.474 1.134 -12.317 1.00 0.00 N ATOM 1172 CA GLU A 79 -11.122 0.865 -12.793 1.00 0.00 C ATOM 1173 C GLU A 79 -10.683 -0.548 -12.415 1.00 0.00 C ATOM 1174 O GLU A 79 -10.913 -1.001 -11.295 1.00 0.00 O ATOM 1175 CB GLU A 79 -10.141 1.886 -12.214 1.00 0.00 C ATOM 1176 CG GLU A 79 -9.975 3.127 -13.076 1.00 0.00 C ATOM 1177 CD GLU A 79 -11.227 3.461 -13.864 1.00 0.00 C ATOM 1178 OE1 GLU A 79 -12.203 3.940 -13.249 1.00 0.00 O ATOM 1179 OE2 GLU A 79 -11.230 3.244 -15.093 1.00 0.00 O ATOM 0 H GLU A 79 -12.536 1.357 -11.324 1.00 0.00 H new ATOM 0 HA GLU A 79 -11.124 0.949 -13.880 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.483 2.185 -11.223 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -9.169 1.411 -12.085 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.713 3.973 -12.441 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.145 2.977 -13.766 1.00 0.00 H new ATOM 1186 N ASN A 80 -10.052 -1.237 -13.360 1.00 0.00 N ATOM 1187 CA ASN A 80 -9.582 -2.598 -13.127 1.00 0.00 C ATOM 1188 C ASN A 80 -8.059 -2.665 -13.181 1.00 0.00 C ATOM 1189 O ASN A 80 -7.452 -2.404 -14.221 1.00 0.00 O ATOM 1190 CB ASN A 80 -10.183 -3.551 -14.164 1.00 0.00 C ATOM 1191 CG ASN A 80 -10.368 -2.891 -15.517 1.00 0.00 C ATOM 1192 OD1 ASN A 80 -11.201 -1.999 -15.676 1.00 0.00 O ATOM 1193 ND2 ASN A 80 -9.590 -3.329 -16.499 1.00 0.00 N ATOM 0 H ASN A 80 -9.854 -0.876 -14.293 1.00 0.00 H new ATOM 0 HA ASN A 80 -9.906 -2.902 -12.132 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -9.535 -4.421 -14.273 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -11.146 -3.914 -13.805 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -9.669 -2.924 -17.432 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -8.913 -4.071 -16.321 1.00 0.00 H new ATOM 1200 N LEU A 81 -7.448 -3.016 -12.056 1.00 0.00 N ATOM 1201 CA LEU A 81 -5.995 -3.118 -11.974 1.00 0.00 C ATOM 1202 C LEU A 81 -5.553 -4.577 -11.922 1.00 0.00 C ATOM 1203 O LEU A 81 -6.362 -5.473 -11.682 1.00 0.00 O ATOM 1204 CB LEU A 81 -5.480 -2.374 -10.740 1.00 0.00 C ATOM 1205 CG LEU A 81 -5.802 -0.880 -10.674 1.00 0.00 C ATOM 1206 CD1 LEU A 81 -5.570 -0.345 -9.270 1.00 0.00 C ATOM 1207 CD2 LEU A 81 -4.965 -0.110 -11.685 1.00 0.00 C ATOM 0 H LEU A 81 -7.936 -3.235 -11.187 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.573 -2.661 -12.869 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.893 -2.854 -9.853 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -4.398 -2.494 -10.693 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.854 -0.743 -10.923 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.804 0.719 -9.243 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.212 -0.876 -8.568 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.527 -0.494 -8.992 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.207 0.951 -11.625 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.907 -0.254 -11.466 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.181 -0.475 -12.689 1.00 0.00 H new ATOM 1219 N PHE A 82 -4.264 -4.808 -12.148 1.00 0.00 N ATOM 1220 CA PHE A 82 -3.714 -6.158 -12.126 1.00 0.00 C ATOM 1221 C PHE A 82 -2.285 -6.155 -11.593 1.00 0.00 C ATOM 1222 O PHE A 82 -1.660 -5.102 -11.469 1.00 0.00 O ATOM 1223 CB PHE A 82 -3.746 -6.767 -13.530 1.00 0.00 C ATOM 1224 CG PHE A 82 -5.124 -6.839 -14.121 1.00 0.00 C ATOM 1225 CD1 PHE A 82 -6.045 -7.763 -13.656 1.00 0.00 C ATOM 1226 CD2 PHE A 82 -5.499 -5.981 -15.143 1.00 0.00 C ATOM 1227 CE1 PHE A 82 -7.314 -7.831 -14.199 1.00 0.00 C ATOM 1228 CE2 PHE A 82 -6.767 -6.044 -15.690 1.00 0.00 C ATOM 1229 CZ PHE A 82 -7.676 -6.970 -15.216 1.00 0.00 C ATOM 0 H PHE A 82 -3.581 -4.078 -12.348 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.329 -6.763 -11.460 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.108 -6.177 -14.188 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -3.323 -7.771 -13.492 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -5.768 -8.438 -12.860 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -4.792 -5.255 -15.516 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -8.022 -8.557 -13.828 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -7.047 -5.370 -16.487 1.00 0.00 H new ATOM 0 HZ PHE A 82 -8.668 -7.020 -15.640 1.00 0.00 H new ATOM 1239 N MET A 83 -1.774 -7.341 -11.279 1.00 0.00 N ATOM 1240 CA MET A 83 -0.418 -7.475 -10.759 1.00 0.00 C ATOM 1241 C MET A 83 0.556 -6.606 -11.549 1.00 0.00 C ATOM 1242 O MET A 83 0.767 -6.821 -12.742 1.00 0.00 O ATOM 1243 CB MET A 83 0.029 -8.937 -10.811 1.00 0.00 C ATOM 1244 CG MET A 83 1.509 -9.131 -10.528 1.00 0.00 C ATOM 1245 SD MET A 83 1.950 -10.863 -10.289 1.00 0.00 S ATOM 1246 CE MET A 83 3.552 -10.700 -9.505 1.00 0.00 C ATOM 0 H MET A 83 -2.278 -8.223 -11.375 1.00 0.00 H new ATOM 0 HA MET A 83 -0.419 -7.139 -9.722 1.00 0.00 H new ATOM 0 HB2 MET A 83 -0.549 -9.511 -10.087 1.00 0.00 H new ATOM 0 HB3 MET A 83 -0.200 -9.344 -11.796 1.00 0.00 H new ATOM 0 HG2 MET A 83 2.090 -8.723 -11.356 1.00 0.00 H new ATOM 0 HG3 MET A 83 1.782 -8.565 -9.638 1.00 0.00 H new ATOM 0 HE1 MET A 83 4.239 -11.435 -9.924 1.00 0.00 H new ATOM 0 HE2 MET A 83 3.942 -9.697 -9.680 1.00 0.00 H new ATOM 0 HE3 MET A 83 3.451 -10.868 -8.433 1.00 0.00 H new ATOM 1256 N GLY A 84 1.145 -5.623 -10.875 1.00 0.00 N ATOM 1257 CA GLY A 84 2.088 -4.736 -11.531 1.00 0.00 C ATOM 1258 C GLY A 84 1.723 -3.274 -11.362 1.00 0.00 C ATOM 1259 O GLY A 84 2.599 -2.413 -11.291 1.00 0.00 O ATOM 0 H GLY A 84 0.986 -5.425 -9.887 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.085 -4.907 -11.126 1.00 0.00 H new ATOM 0 HA3 GLY A 84 2.130 -4.976 -12.593 1.00 0.00 H new ATOM 1263 N ASN A 85 0.426 -2.993 -11.300 1.00 0.00 N ATOM 1264 CA ASN A 85 -0.053 -1.625 -11.141 1.00 0.00 C ATOM 1265 C ASN A 85 0.251 -1.101 -9.741 1.00 0.00 C ATOM 1266 O ASN A 85 0.742 -1.837 -8.885 1.00 0.00 O ATOM 1267 CB ASN A 85 -1.558 -1.555 -11.408 1.00 0.00 C ATOM 1268 CG ASN A 85 -1.881 -1.524 -12.889 1.00 0.00 C ATOM 1269 OD1 ASN A 85 -2.402 -2.492 -13.443 1.00 0.00 O ATOM 1270 ND2 ASN A 85 -1.573 -0.407 -13.539 1.00 0.00 N ATOM 0 H ASN A 85 -0.312 -3.694 -11.357 1.00 0.00 H new ATOM 0 HA ASN A 85 0.467 -0.998 -11.865 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.046 -2.416 -10.950 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -1.968 -0.665 -10.931 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.768 -0.328 -14.537 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -1.142 0.371 -13.040 1.00 0.00 H new ATOM 1277 N SER A 86 -0.045 0.175 -9.515 1.00 0.00 N ATOM 1278 CA SER A 86 0.200 0.798 -8.219 1.00 0.00 C ATOM 1279 C SER A 86 -0.862 1.850 -7.914 1.00 0.00 C ATOM 1280 O SER A 86 -1.274 2.607 -8.793 1.00 0.00 O ATOM 1281 CB SER A 86 1.590 1.437 -8.191 1.00 0.00 C ATOM 1282 OG SER A 86 1.738 2.382 -9.237 1.00 0.00 O ATOM 0 H SER A 86 -0.454 0.797 -10.212 1.00 0.00 H new ATOM 0 HA SER A 86 0.149 0.023 -7.455 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.750 1.926 -7.230 1.00 0.00 H new ATOM 0 HB3 SER A 86 2.352 0.663 -8.286 1.00 0.00 H new ATOM 0 HG SER A 86 2.634 2.777 -9.196 1.00 0.00 H new ATOM 1288 N PHE A 87 -1.302 1.891 -6.660 1.00 0.00 N ATOM 1289 CA PHE A 87 -2.317 2.849 -6.237 1.00 0.00 C ATOM 1290 C PHE A 87 -2.083 3.286 -4.794 1.00 0.00 C ATOM 1291 O PHE A 87 -1.573 2.522 -3.977 1.00 0.00 O ATOM 1292 CB PHE A 87 -3.713 2.239 -6.377 1.00 0.00 C ATOM 1293 CG PHE A 87 -3.968 1.101 -5.432 1.00 0.00 C ATOM 1294 CD1 PHE A 87 -3.628 -0.196 -5.780 1.00 0.00 C ATOM 1295 CD2 PHE A 87 -4.549 1.327 -4.194 1.00 0.00 C ATOM 1296 CE1 PHE A 87 -3.861 -1.246 -4.912 1.00 0.00 C ATOM 1297 CE2 PHE A 87 -4.784 0.281 -3.322 1.00 0.00 C ATOM 1298 CZ PHE A 87 -4.441 -1.007 -3.682 1.00 0.00 C ATOM 0 H PHE A 87 -0.972 1.272 -5.920 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.245 3.726 -6.880 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.459 3.016 -6.207 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.846 1.888 -7.400 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.175 -0.389 -6.741 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -4.821 2.332 -3.908 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -3.590 -2.252 -5.195 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.236 0.471 -2.360 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.626 -1.826 -3.003 1.00 0.00 H new ATOM 1308 N GLY A 88 -2.460 4.524 -4.489 1.00 0.00 N ATOM 1309 CA GLY A 88 -2.284 5.044 -3.146 1.00 0.00 C ATOM 1310 C GLY A 88 -1.818 6.487 -3.138 1.00 0.00 C ATOM 1311 O GLY A 88 -2.431 7.347 -3.771 1.00 0.00 O ATOM 0 H GLY A 88 -2.884 5.176 -5.149 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.226 4.967 -2.604 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -1.559 4.428 -2.614 1.00 0.00 H new ATOM 1315 N ILE A 89 -0.733 6.753 -2.420 1.00 0.00 N ATOM 1316 CA ILE A 89 -0.186 8.101 -2.333 1.00 0.00 C ATOM 1317 C ILE A 89 0.915 8.316 -3.365 1.00 0.00 C ATOM 1318 O ILE A 89 1.250 7.411 -4.130 1.00 0.00 O ATOM 1319 CB ILE A 89 0.378 8.390 -0.929 1.00 0.00 C ATOM 1320 CG1 ILE A 89 1.510 7.416 -0.600 1.00 0.00 C ATOM 1321 CG2 ILE A 89 -0.726 8.300 0.114 1.00 0.00 C ATOM 1322 CD1 ILE A 89 2.496 7.954 0.413 1.00 0.00 C ATOM 0 H ILE A 89 -0.215 6.053 -1.890 1.00 0.00 H new ATOM 0 HA ILE A 89 -1.008 8.788 -2.534 1.00 0.00 H new ATOM 0 HB ILE A 89 0.781 9.403 -0.917 1.00 0.00 H new ATOM 0 HG12 ILE A 89 1.081 6.489 -0.220 1.00 0.00 H new ATOM 0 HG13 ILE A 89 2.043 7.168 -1.518 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.312 8.507 1.101 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.502 9.030 -0.114 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.156 7.298 0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 89 3.271 7.210 0.597 1.00 0.00 H new ATOM 0 HD12 ILE A 89 2.953 8.865 0.028 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.976 8.175 1.345 1.00 0.00 H new ATOM 1334 N THR A 90 1.477 9.521 -3.381 1.00 0.00 N ATOM 1335 CA THR A 90 2.541 9.855 -4.319 1.00 0.00 C ATOM 1336 C THR A 90 3.873 10.031 -3.599 1.00 0.00 C ATOM 1337 O THR A 90 3.928 10.245 -2.388 1.00 0.00 O ATOM 1338 CB THR A 90 2.219 11.144 -5.098 1.00 0.00 C ATOM 1339 OG1 THR A 90 1.408 12.011 -4.297 1.00 0.00 O ATOM 1340 CG2 THR A 90 1.496 10.824 -6.398 1.00 0.00 C ATOM 0 H THR A 90 1.213 10.281 -2.755 1.00 0.00 H new ATOM 0 HA THR A 90 2.616 9.024 -5.020 1.00 0.00 H new ATOM 0 HB THR A 90 3.159 11.643 -5.336 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.209 12.829 -4.799 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.279 11.750 -6.931 1.00 0.00 H new ATOM 0 HG22 THR A 90 2.127 10.188 -7.018 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.563 10.305 -6.177 1.00 0.00 H new ATOM 1348 N PRO A 91 4.975 9.939 -4.359 1.00 0.00 N ATOM 1349 CA PRO A 91 6.327 10.086 -3.814 1.00 0.00 C ATOM 1350 C PRO A 91 6.626 11.518 -3.382 1.00 0.00 C ATOM 1351 O PRO A 91 7.734 11.827 -2.942 1.00 0.00 O ATOM 1352 CB PRO A 91 7.227 9.683 -4.985 1.00 0.00 C ATOM 1353 CG PRO A 91 6.411 9.953 -6.201 1.00 0.00 C ATOM 1354 CD PRO A 91 4.984 9.686 -5.810 1.00 0.00 C ATOM 0 HA PRO A 91 6.473 9.482 -2.918 1.00 0.00 H new ATOM 0 HB2 PRO A 91 8.151 10.262 -4.992 1.00 0.00 H new ATOM 0 HB3 PRO A 91 7.510 8.632 -4.923 1.00 0.00 H new ATOM 0 HG2 PRO A 91 6.538 10.983 -6.535 1.00 0.00 H new ATOM 0 HG3 PRO A 91 6.716 9.310 -7.026 1.00 0.00 H new ATOM 0 HD2 PRO A 91 4.293 10.344 -6.337 1.00 0.00 H new ATOM 0 HD3 PRO A 91 4.689 8.663 -6.041 1.00 0.00 H new ATOM 1362 N THR A 92 5.630 12.390 -3.509 1.00 0.00 N ATOM 1363 CA THR A 92 5.786 13.789 -3.132 1.00 0.00 C ATOM 1364 C THR A 92 5.139 14.070 -1.781 1.00 0.00 C ATOM 1365 O THR A 92 4.043 13.586 -1.494 1.00 0.00 O ATOM 1366 CB THR A 92 5.172 14.727 -4.188 1.00 0.00 C ATOM 1367 OG1 THR A 92 3.760 14.505 -4.279 1.00 0.00 O ATOM 1368 CG2 THR A 92 5.814 14.504 -5.549 1.00 0.00 C ATOM 0 H THR A 92 4.706 12.151 -3.870 1.00 0.00 H new ATOM 0 HA THR A 92 6.857 13.981 -3.065 1.00 0.00 H new ATOM 0 HB THR A 92 5.359 15.756 -3.880 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.377 15.106 -4.951 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.364 15.178 -6.278 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.884 14.702 -5.484 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.655 13.472 -5.862 1.00 0.00 H new ATOM 1376 N LEU A 93 5.822 14.855 -0.955 1.00 0.00 N ATOM 1377 CA LEU A 93 5.312 15.201 0.367 1.00 0.00 C ATOM 1378 C LEU A 93 3.826 15.537 0.307 1.00 0.00 C ATOM 1379 O LEU A 93 3.103 15.378 1.290 1.00 0.00 O ATOM 1380 CB LEU A 93 6.092 16.385 0.941 1.00 0.00 C ATOM 1381 CG LEU A 93 7.453 16.058 1.556 1.00 0.00 C ATOM 1382 CD1 LEU A 93 8.023 17.275 2.269 1.00 0.00 C ATOM 1383 CD2 LEU A 93 7.337 14.882 2.514 1.00 0.00 C ATOM 0 H LEU A 93 6.730 15.264 -1.177 1.00 0.00 H new ATOM 0 HA LEU A 93 5.443 14.337 1.018 1.00 0.00 H new ATOM 0 HB2 LEU A 93 6.241 17.116 0.146 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.477 16.864 1.703 1.00 0.00 H new ATOM 0 HG LEU A 93 8.136 15.780 0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 93 8.992 17.023 2.700 1.00 0.00 H new ATOM 0 HD12 LEU A 93 8.144 18.091 1.556 1.00 0.00 H new ATOM 0 HD13 LEU A 93 7.342 17.584 3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 93 8.315 14.664 2.942 1.00 0.00 H new ATOM 0 HD22 LEU A 93 6.639 15.131 3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 93 6.974 14.007 1.974 1.00 0.00 H new ATOM 1395 N ASP A 94 3.376 16.001 -0.854 1.00 0.00 N ATOM 1396 CA ASP A 94 1.974 16.357 -1.044 1.00 0.00 C ATOM 1397 C ASP A 94 1.060 15.218 -0.603 1.00 0.00 C ATOM 1398 O ASP A 94 1.473 14.059 -0.552 1.00 0.00 O ATOM 1399 CB ASP A 94 1.708 16.702 -2.510 1.00 0.00 C ATOM 1400 CG ASP A 94 2.202 18.087 -2.878 1.00 0.00 C ATOM 1401 OD1 ASP A 94 2.399 18.910 -1.959 1.00 0.00 O ATOM 1402 OD2 ASP A 94 2.391 18.349 -4.084 1.00 0.00 O ATOM 0 H ASP A 94 3.962 16.139 -1.678 1.00 0.00 H new ATOM 0 HA ASP A 94 1.759 17.230 -0.428 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.195 15.964 -3.148 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.638 16.637 -2.707 1.00 0.00 H new ATOM 1407 N LYS A 95 -0.185 15.555 -0.283 1.00 0.00 N ATOM 1408 CA LYS A 95 -1.159 14.563 0.154 1.00 0.00 C ATOM 1409 C LYS A 95 -2.117 14.206 -0.977 1.00 0.00 C ATOM 1410 O LYS A 95 -2.084 14.816 -2.046 1.00 0.00 O ATOM 1411 CB LYS A 95 -1.946 15.086 1.358 1.00 0.00 C ATOM 1412 CG LYS A 95 -1.105 15.240 2.614 1.00 0.00 C ATOM 1413 CD LYS A 95 -1.600 16.386 3.479 1.00 0.00 C ATOM 1414 CE LYS A 95 -2.932 16.055 4.135 1.00 0.00 C ATOM 1415 NZ LYS A 95 -3.314 17.069 5.157 1.00 0.00 N ATOM 0 H LYS A 95 -0.543 16.509 -0.318 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.618 13.663 0.445 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -2.384 16.051 1.104 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.772 14.406 1.565 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.131 14.313 3.187 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -0.065 15.414 2.338 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -0.860 16.609 4.248 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -1.707 17.283 2.870 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -3.708 15.998 3.372 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -2.872 15.072 4.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.227 16.808 5.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.586 17.106 5.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -3.396 18.003 4.706 1.00 0.00 H new ATOM 1429 N GLN A 96 -2.971 13.216 -0.734 1.00 0.00 N ATOM 1430 CA GLN A 96 -3.939 12.780 -1.733 1.00 0.00 C ATOM 1431 C GLN A 96 -5.214 12.269 -1.070 1.00 0.00 C ATOM 1432 O GLN A 96 -5.238 12.010 0.134 1.00 0.00 O ATOM 1433 CB GLN A 96 -3.335 11.686 -2.616 1.00 0.00 C ATOM 1434 CG GLN A 96 -1.841 11.845 -2.845 1.00 0.00 C ATOM 1435 CD GLN A 96 -1.032 11.643 -1.579 1.00 0.00 C ATOM 1436 OE1 GLN A 96 -1.511 11.055 -0.609 1.00 0.00 O ATOM 1437 NE2 GLN A 96 0.204 12.129 -1.582 1.00 0.00 N ATOM 0 H GLN A 96 -3.012 12.701 0.146 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.194 13.639 -2.354 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -3.522 10.715 -2.157 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -3.844 11.686 -3.580 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -1.514 11.128 -3.599 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -1.642 12.840 -3.244 1.00 0.00 H new ATOM 0 HE21 GLN A 96 0.561 12.610 -2.408 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.796 12.022 -0.759 1.00 0.00 H new ATOM 1446 N TYR A 97 -6.271 12.127 -1.861 1.00 0.00 N ATOM 1447 CA TYR A 97 -7.550 11.649 -1.350 1.00 0.00 C ATOM 1448 C TYR A 97 -8.159 10.613 -2.289 1.00 0.00 C ATOM 1449 O TYR A 97 -8.264 10.837 -3.495 1.00 0.00 O ATOM 1450 CB TYR A 97 -8.518 12.819 -1.165 1.00 0.00 C ATOM 1451 CG TYR A 97 -7.902 14.011 -0.468 1.00 0.00 C ATOM 1452 CD1 TYR A 97 -7.492 13.929 0.857 1.00 0.00 C ATOM 1453 CD2 TYR A 97 -7.729 15.218 -1.134 1.00 0.00 C ATOM 1454 CE1 TYR A 97 -6.929 15.016 1.499 1.00 0.00 C ATOM 1455 CE2 TYR A 97 -7.166 16.309 -0.501 1.00 0.00 C ATOM 1456 CZ TYR A 97 -6.769 16.203 0.815 1.00 0.00 C ATOM 1457 OH TYR A 97 -6.207 17.287 1.450 1.00 0.00 O ATOM 0 H TYR A 97 -6.268 12.336 -2.859 1.00 0.00 H new ATOM 0 HA TYR A 97 -7.373 11.176 -0.384 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -8.888 13.131 -2.142 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -9.380 12.479 -0.591 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -7.615 13.000 1.394 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -8.040 15.305 -2.165 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -6.616 14.936 2.530 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -7.038 17.240 -1.034 1.00 0.00 H new ATOM 0 HH TYR A 97 -6.165 18.044 0.829 1.00 0.00 H new ATOM 1467 N MET A 98 -8.561 9.478 -1.726 1.00 0.00 N ATOM 1468 CA MET A 98 -9.163 8.407 -2.513 1.00 0.00 C ATOM 1469 C MET A 98 -10.423 8.894 -3.221 1.00 0.00 C ATOM 1470 O MET A 98 -11.422 9.218 -2.579 1.00 0.00 O ATOM 1471 CB MET A 98 -9.497 7.213 -1.616 1.00 0.00 C ATOM 1472 CG MET A 98 -9.576 5.893 -2.366 1.00 0.00 C ATOM 1473 SD MET A 98 -8.039 5.485 -3.216 1.00 0.00 S ATOM 1474 CE MET A 98 -8.666 4.612 -4.649 1.00 0.00 C ATOM 0 H MET A 98 -8.481 9.276 -0.729 1.00 0.00 H new ATOM 0 HA MET A 98 -8.442 8.095 -3.268 1.00 0.00 H new ATOM 0 HB2 MET A 98 -8.741 7.133 -0.835 1.00 0.00 H new ATOM 0 HB3 MET A 98 -10.450 7.397 -1.120 1.00 0.00 H new ATOM 0 HG2 MET A 98 -9.822 5.095 -1.665 1.00 0.00 H new ATOM 0 HG3 MET A 98 -10.387 5.940 -3.093 1.00 0.00 H new ATOM 0 HE1 MET A 98 -8.014 3.768 -4.875 1.00 0.00 H new ATOM 0 HE2 MET A 98 -9.672 4.248 -4.442 1.00 0.00 H new ATOM 0 HE3 MET A 98 -8.693 5.288 -5.504 1.00 0.00 H new ATOM 1484 N HIS A 99 -10.368 8.945 -4.548 1.00 0.00 N ATOM 1485 CA HIS A 99 -11.505 9.393 -5.344 1.00 0.00 C ATOM 1486 C HIS A 99 -12.404 8.218 -5.717 1.00 0.00 C ATOM 1487 O HIS A 99 -12.969 8.177 -6.809 1.00 0.00 O ATOM 1488 CB HIS A 99 -11.022 10.102 -6.610 1.00 0.00 C ATOM 1489 CG HIS A 99 -11.922 11.213 -7.055 1.00 0.00 C ATOM 1490 ND1 HIS A 99 -12.466 11.279 -8.320 1.00 0.00 N ATOM 1491 CD2 HIS A 99 -12.375 12.304 -6.394 1.00 0.00 C ATOM 1492 CE1 HIS A 99 -13.213 12.364 -8.419 1.00 0.00 C ATOM 1493 NE2 HIS A 99 -13.175 13.004 -7.264 1.00 0.00 N ATOM 0 H HIS A 99 -9.548 8.682 -5.095 1.00 0.00 H new ATOM 0 HA HIS A 99 -12.083 10.094 -4.742 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -10.024 10.503 -6.434 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -10.935 9.372 -7.415 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -12.149 12.574 -5.373 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -13.762 12.675 -9.296 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -13.661 13.876 -7.053 1.00 0.00 H new ATOM 1502 N GLY A 100 -12.531 7.262 -4.801 1.00 0.00 N ATOM 1503 CA GLY A 100 -13.362 6.099 -5.052 1.00 0.00 C ATOM 1504 C GLY A 100 -13.157 5.006 -4.022 1.00 0.00 C ATOM 1505 O GLY A 100 -12.428 5.192 -3.047 1.00 0.00 O ATOM 0 H GLY A 100 -12.073 7.273 -3.890 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -14.410 6.399 -5.055 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -13.140 5.705 -6.044 1.00 0.00 H new ATOM 1509 N ILE A 101 -13.802 3.865 -4.236 1.00 0.00 N ATOM 1510 CA ILE A 101 -13.687 2.739 -3.318 1.00 0.00 C ATOM 1511 C ILE A 101 -12.957 1.569 -3.970 1.00 0.00 C ATOM 1512 O ILE A 101 -13.225 1.220 -5.120 1.00 0.00 O ATOM 1513 CB ILE A 101 -15.070 2.262 -2.836 1.00 0.00 C ATOM 1514 CG1 ILE A 101 -15.799 3.394 -2.109 1.00 0.00 C ATOM 1515 CG2 ILE A 101 -14.925 1.049 -1.929 1.00 0.00 C ATOM 1516 CD1 ILE A 101 -17.292 3.177 -1.997 1.00 0.00 C ATOM 0 H ILE A 101 -14.410 3.696 -5.037 1.00 0.00 H new ATOM 0 HA ILE A 101 -13.113 3.089 -2.460 1.00 0.00 H new ATOM 0 HB ILE A 101 -15.662 1.973 -3.705 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -15.380 3.502 -1.109 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -15.615 4.331 -2.635 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -15.911 0.723 -1.596 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -14.442 0.240 -2.477 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -14.319 1.313 -1.063 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -17.743 4.018 -1.471 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -17.724 3.099 -2.995 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -17.486 2.257 -1.445 1.00 0.00 H new ATOM 1528 N VAL A 102 -12.034 0.967 -3.228 1.00 0.00 N ATOM 1529 CA VAL A 102 -11.267 -0.166 -3.732 1.00 0.00 C ATOM 1530 C VAL A 102 -11.697 -1.464 -3.058 1.00 0.00 C ATOM 1531 O VAL A 102 -11.902 -1.508 -1.845 1.00 0.00 O ATOM 1532 CB VAL A 102 -9.756 0.038 -3.514 1.00 0.00 C ATOM 1533 CG1 VAL A 102 -8.964 -1.067 -4.197 1.00 0.00 C ATOM 1534 CG2 VAL A 102 -9.325 1.405 -4.021 1.00 0.00 C ATOM 0 H VAL A 102 -11.799 1.245 -2.275 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.466 -0.233 -4.802 1.00 0.00 H new ATOM 0 HB VAL A 102 -9.551 -0.009 -2.444 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.899 -0.906 -4.032 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -9.254 -2.032 -3.782 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.171 -1.055 -5.267 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -8.255 1.532 -3.859 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -9.543 1.483 -5.086 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -9.868 2.181 -3.482 1.00 0.00 H new ATOM 1544 N ARG A 103 -11.830 -2.521 -3.853 1.00 0.00 N ATOM 1545 CA ARG A 103 -12.236 -3.821 -3.334 1.00 0.00 C ATOM 1546 C ARG A 103 -11.585 -4.951 -4.127 1.00 0.00 C ATOM 1547 O ARG A 103 -11.616 -4.958 -5.358 1.00 0.00 O ATOM 1548 CB ARG A 103 -13.758 -3.961 -3.382 1.00 0.00 C ATOM 1549 CG ARG A 103 -14.474 -3.210 -2.271 1.00 0.00 C ATOM 1550 CD ARG A 103 -15.856 -3.789 -2.008 1.00 0.00 C ATOM 1551 NE ARG A 103 -16.882 -3.152 -2.829 1.00 0.00 N ATOM 1552 CZ ARG A 103 -18.053 -3.713 -3.107 1.00 0.00 C ATOM 1553 NH1 ARG A 103 -18.346 -4.916 -2.632 1.00 0.00 N ATOM 1554 NH2 ARG A 103 -18.936 -3.070 -3.861 1.00 0.00 N ATOM 0 H ARG A 103 -11.662 -2.502 -4.859 1.00 0.00 H new ATOM 0 HA ARG A 103 -11.904 -3.890 -2.298 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -14.118 -3.598 -4.345 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -14.019 -5.018 -3.322 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -13.880 -3.255 -1.358 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -14.564 -2.158 -2.541 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -15.844 -4.860 -2.209 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -16.106 -3.665 -0.954 1.00 0.00 H new ATOM 0 HE ARG A 103 -16.689 -2.226 -3.210 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -17.671 -5.413 -2.051 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -19.246 -5.344 -2.847 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -18.715 -2.144 -4.228 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -19.835 -3.502 -4.074 1.00 0.00 H new ATOM 1568 N THR A 104 -10.996 -5.905 -3.413 1.00 0.00 N ATOM 1569 CA THR A 104 -10.337 -7.039 -4.050 1.00 0.00 C ATOM 1570 C THR A 104 -11.319 -7.845 -4.891 1.00 0.00 C ATOM 1571 O THR A 104 -12.534 -7.718 -4.738 1.00 0.00 O ATOM 1572 CB THR A 104 -9.687 -7.968 -3.008 1.00 0.00 C ATOM 1573 OG1 THR A 104 -10.672 -8.422 -2.074 1.00 0.00 O ATOM 1574 CG2 THR A 104 -8.569 -7.251 -2.265 1.00 0.00 C ATOM 0 H THR A 104 -10.962 -5.915 -2.394 1.00 0.00 H new ATOM 0 HA THR A 104 -9.560 -6.631 -4.697 1.00 0.00 H new ATOM 0 HB THR A 104 -9.262 -8.824 -3.533 1.00 0.00 H new ATOM 0 HG1 THR A 104 -10.251 -9.014 -1.416 1.00 0.00 H new ATOM 0 HG21 THR A 104 -8.125 -7.927 -1.535 1.00 0.00 H new ATOM 0 HG22 THR A 104 -7.806 -6.933 -2.975 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.974 -6.378 -1.752 1.00 0.00 H new ATOM 1582 N LYS A 105 -10.787 -8.677 -5.779 1.00 0.00 N ATOM 1583 CA LYS A 105 -11.617 -9.507 -6.644 1.00 0.00 C ATOM 1584 C LYS A 105 -11.489 -10.981 -6.270 1.00 0.00 C ATOM 1585 O LYS A 105 -12.382 -11.781 -6.546 1.00 0.00 O ATOM 1586 CB LYS A 105 -11.223 -9.306 -8.109 1.00 0.00 C ATOM 1587 CG LYS A 105 -11.990 -8.191 -8.798 1.00 0.00 C ATOM 1588 CD LYS A 105 -13.322 -8.682 -9.339 1.00 0.00 C ATOM 1589 CE LYS A 105 -13.136 -9.555 -10.570 1.00 0.00 C ATOM 1590 NZ LYS A 105 -14.437 -9.905 -11.205 1.00 0.00 N ATOM 0 H LYS A 105 -9.784 -8.795 -5.919 1.00 0.00 H new ATOM 0 HA LYS A 105 -12.655 -9.204 -6.508 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -10.156 -9.089 -8.163 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -11.387 -10.237 -8.651 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -12.160 -7.376 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -11.391 -7.787 -9.614 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.844 -9.247 -8.566 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -13.951 -7.828 -9.589 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -12.508 -9.034 -11.293 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -12.611 -10.469 -10.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -14.266 -10.501 -12.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.027 -10.424 -10.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -14.927 -9.035 -11.495 1.00 0.00 H new ATOM 1604 N VAL A 106 -10.373 -11.332 -5.639 1.00 0.00 N ATOM 1605 CA VAL A 106 -10.129 -12.708 -5.225 1.00 0.00 C ATOM 1606 C VAL A 106 -9.463 -12.760 -3.855 1.00 0.00 C ATOM 1607 O VAL A 106 -9.178 -11.725 -3.252 1.00 0.00 O ATOM 1608 CB VAL A 106 -9.245 -13.453 -6.242 1.00 0.00 C ATOM 1609 CG1 VAL A 106 -9.883 -13.429 -7.623 1.00 0.00 C ATOM 1610 CG2 VAL A 106 -7.850 -12.846 -6.280 1.00 0.00 C ATOM 0 H VAL A 106 -9.623 -10.682 -5.403 1.00 0.00 H new ATOM 0 HA VAL A 106 -11.101 -13.199 -5.172 1.00 0.00 H new ATOM 0 HB VAL A 106 -9.156 -14.493 -5.927 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.244 -13.960 -8.328 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -10.859 -13.913 -7.582 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -10.004 -12.396 -7.950 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -7.238 -13.385 -7.004 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -7.917 -11.798 -6.570 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -7.394 -12.921 -5.293 1.00 0.00 H new ATOM 1620 N ASP A 107 -9.215 -13.971 -3.369 1.00 0.00 N ATOM 1621 CA ASP A 107 -8.580 -14.159 -2.069 1.00 0.00 C ATOM 1622 C ASP A 107 -7.068 -14.298 -2.219 1.00 0.00 C ATOM 1623 O ASP A 107 -6.537 -14.252 -3.329 1.00 0.00 O ATOM 1624 CB ASP A 107 -9.152 -15.394 -1.372 1.00 0.00 C ATOM 1625 CG ASP A 107 -9.261 -16.586 -2.302 1.00 0.00 C ATOM 1626 OD1 ASP A 107 -8.360 -16.761 -3.149 1.00 0.00 O ATOM 1627 OD2 ASP A 107 -10.248 -17.343 -2.184 1.00 0.00 O ATOM 0 H ASP A 107 -9.444 -14.838 -3.856 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.788 -13.279 -1.459 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -8.518 -15.655 -0.524 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -10.138 -15.158 -0.972 1.00 0.00 H new ATOM 1632 N ASP A 108 -6.381 -14.467 -1.095 1.00 0.00 N ATOM 1633 CA ASP A 108 -4.930 -14.614 -1.100 1.00 0.00 C ATOM 1634 C ASP A 108 -4.268 -13.436 -1.808 1.00 0.00 C ATOM 1635 O ASP A 108 -3.179 -13.568 -2.368 1.00 0.00 O ATOM 1636 CB ASP A 108 -4.530 -15.924 -1.781 1.00 0.00 C ATOM 1637 CG ASP A 108 -3.231 -16.486 -1.238 1.00 0.00 C ATOM 1638 OD1 ASP A 108 -3.013 -16.397 -0.011 1.00 0.00 O ATOM 1639 OD2 ASP A 108 -2.433 -17.015 -2.039 1.00 0.00 O ATOM 0 H ASP A 108 -6.805 -14.506 -0.168 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.588 -14.633 -0.065 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.325 -16.658 -1.646 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.430 -15.757 -2.853 1.00 0.00 H new ATOM 1644 N CYS A 109 -4.932 -12.286 -1.780 1.00 0.00 N ATOM 1645 CA CYS A 109 -4.409 -11.085 -2.421 1.00 0.00 C ATOM 1646 C CYS A 109 -3.330 -10.435 -1.560 1.00 0.00 C ATOM 1647 O CYS A 109 -3.568 -10.098 -0.401 1.00 0.00 O ATOM 1648 CB CYS A 109 -5.539 -10.088 -2.682 1.00 0.00 C ATOM 1649 SG CYS A 109 -6.404 -10.346 -4.249 1.00 0.00 S ATOM 0 H CYS A 109 -5.834 -12.160 -1.320 1.00 0.00 H new ATOM 0 HA CYS A 109 -3.963 -11.375 -3.372 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -6.260 -10.151 -1.867 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -5.129 -9.078 -2.668 1.00 0.00 H new ATOM 0 HG CYS A 109 -7.547 -10.923 -4.024 1.00 0.00 H new ATOM 1655 N GLN A 110 -2.145 -10.264 -2.136 1.00 0.00 N ATOM 1656 CA GLN A 110 -1.029 -9.657 -1.420 1.00 0.00 C ATOM 1657 C GLN A 110 -0.926 -8.169 -1.734 1.00 0.00 C ATOM 1658 O GLN A 110 -1.245 -7.733 -2.841 1.00 0.00 O ATOM 1659 CB GLN A 110 0.281 -10.359 -1.785 1.00 0.00 C ATOM 1660 CG GLN A 110 0.422 -11.742 -1.169 1.00 0.00 C ATOM 1661 CD GLN A 110 1.406 -12.617 -1.919 1.00 0.00 C ATOM 1662 OE1 GLN A 110 2.166 -12.136 -2.760 1.00 0.00 O ATOM 1663 NE2 GLN A 110 1.398 -13.911 -1.618 1.00 0.00 N ATOM 0 H GLN A 110 -1.933 -10.537 -3.096 1.00 0.00 H new ATOM 0 HA GLN A 110 -1.210 -9.773 -0.351 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.348 -10.445 -2.870 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.118 -9.740 -1.462 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.746 -11.643 -0.133 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -0.553 -12.229 -1.153 1.00 0.00 H new ATOM 0 HE21 GLN A 110 0.751 -14.267 -0.914 1.00 0.00 H new ATOM 0 HE22 GLN A 110 2.039 -14.549 -2.091 1.00 0.00 H new ATOM 1672 N PHE A 111 -0.479 -7.392 -0.753 1.00 0.00 N ATOM 1673 CA PHE A 111 -0.335 -5.951 -0.924 1.00 0.00 C ATOM 1674 C PHE A 111 0.788 -5.408 -0.045 1.00 0.00 C ATOM 1675 O PHE A 111 0.948 -5.821 1.103 1.00 0.00 O ATOM 1676 CB PHE A 111 -1.649 -5.242 -0.587 1.00 0.00 C ATOM 1677 CG PHE A 111 -2.805 -5.686 -1.438 1.00 0.00 C ATOM 1678 CD1 PHE A 111 -2.836 -5.397 -2.793 1.00 0.00 C ATOM 1679 CD2 PHE A 111 -3.860 -6.392 -0.883 1.00 0.00 C ATOM 1680 CE1 PHE A 111 -3.898 -5.804 -3.577 1.00 0.00 C ATOM 1681 CE2 PHE A 111 -4.925 -6.802 -1.663 1.00 0.00 C ATOM 1682 CZ PHE A 111 -4.943 -6.508 -3.012 1.00 0.00 C ATOM 0 H PHE A 111 -0.210 -7.736 0.169 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.082 -5.758 -1.967 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -1.890 -5.420 0.461 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.513 -4.167 -0.705 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -2.021 -4.848 -3.241 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -3.850 -6.625 0.172 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -3.911 -5.572 -4.632 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -5.742 -7.351 -1.218 1.00 0.00 H new ATOM 0 HZ PHE A 111 -5.773 -6.828 -3.624 1.00 0.00 H new ATOM 1692 N VAL A 112 1.564 -4.479 -0.594 1.00 0.00 N ATOM 1693 CA VAL A 112 2.673 -3.879 0.138 1.00 0.00 C ATOM 1694 C VAL A 112 2.363 -2.434 0.516 1.00 0.00 C ATOM 1695 O VAL A 112 1.701 -1.714 -0.232 1.00 0.00 O ATOM 1696 CB VAL A 112 3.974 -3.915 -0.685 1.00 0.00 C ATOM 1697 CG1 VAL A 112 3.822 -3.102 -1.961 1.00 0.00 C ATOM 1698 CG2 VAL A 112 5.143 -3.406 0.145 1.00 0.00 C ATOM 0 H VAL A 112 1.445 -4.126 -1.543 1.00 0.00 H new ATOM 0 HA VAL A 112 2.810 -4.468 1.045 1.00 0.00 H new ATOM 0 HB VAL A 112 4.178 -4.949 -0.964 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.751 -3.139 -2.529 1.00 0.00 H new ATOM 0 HG12 VAL A 112 3.012 -3.516 -2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.593 -2.067 -1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 112 6.054 -3.438 -0.452 1.00 0.00 H new ATOM 0 HG22 VAL A 112 4.949 -2.379 0.456 1.00 0.00 H new ATOM 0 HG23 VAL A 112 5.264 -4.035 1.027 1.00 0.00 H new ATOM 1708 N CYS A 113 2.847 -2.017 1.681 1.00 0.00 N ATOM 1709 CA CYS A 113 2.622 -0.658 2.159 1.00 0.00 C ATOM 1710 C CYS A 113 3.946 0.045 2.443 1.00 0.00 C ATOM 1711 O CYS A 113 4.911 -0.582 2.880 1.00 0.00 O ATOM 1712 CB CYS A 113 1.759 -0.676 3.422 1.00 0.00 C ATOM 1713 SG CYS A 113 -0.018 -0.581 3.103 1.00 0.00 S ATOM 0 H CYS A 113 3.397 -2.600 2.311 1.00 0.00 H new ATOM 0 HA CYS A 113 2.099 -0.106 1.378 1.00 0.00 H new ATOM 0 HB2 CYS A 113 1.969 -1.589 3.980 1.00 0.00 H new ATOM 0 HB3 CYS A 113 2.048 0.160 4.059 1.00 0.00 H new ATOM 0 HG CYS A 113 -0.222 -0.422 1.829 1.00 0.00 H new ATOM 1719 N ILE A 114 3.983 1.349 2.191 1.00 0.00 N ATOM 1720 CA ILE A 114 5.189 2.136 2.419 1.00 0.00 C ATOM 1721 C ILE A 114 4.844 3.557 2.853 1.00 0.00 C ATOM 1722 O ILE A 114 4.154 4.284 2.139 1.00 0.00 O ATOM 1723 CB ILE A 114 6.069 2.196 1.157 1.00 0.00 C ATOM 1724 CG1 ILE A 114 6.474 0.786 0.724 1.00 0.00 C ATOM 1725 CG2 ILE A 114 7.301 3.052 1.411 1.00 0.00 C ATOM 1726 CD1 ILE A 114 6.998 0.716 -0.694 1.00 0.00 C ATOM 0 H ILE A 114 3.193 1.883 1.829 1.00 0.00 H new ATOM 0 HA ILE A 114 5.744 1.640 3.215 1.00 0.00 H new ATOM 0 HB ILE A 114 5.493 2.652 0.352 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.239 0.411 1.404 1.00 0.00 H new ATOM 0 HG13 ILE A 114 5.613 0.125 0.818 1.00 0.00 H new ATOM 0 HG21 ILE A 114 7.913 3.085 0.510 1.00 0.00 H new ATOM 0 HG22 ILE A 114 6.993 4.063 1.678 1.00 0.00 H new ATOM 0 HG23 ILE A 114 7.881 2.622 2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.266 -0.313 -0.933 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.227 1.060 -1.384 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.879 1.351 -0.788 1.00 0.00 H new ATOM 1738 N ALA A 115 5.330 3.946 4.027 1.00 0.00 N ATOM 1739 CA ALA A 115 5.077 5.281 4.554 1.00 0.00 C ATOM 1740 C ALA A 115 5.452 6.353 3.537 1.00 0.00 C ATOM 1741 O ALA A 115 6.379 6.175 2.748 1.00 0.00 O ATOM 1742 CB ALA A 115 5.843 5.490 5.852 1.00 0.00 C ATOM 0 H ALA A 115 5.901 3.355 4.631 1.00 0.00 H new ATOM 0 HA ALA A 115 4.010 5.368 4.757 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.645 6.491 6.234 1.00 0.00 H new ATOM 0 HB2 ALA A 115 5.523 4.751 6.587 1.00 0.00 H new ATOM 0 HB3 ALA A 115 6.911 5.378 5.666 1.00 0.00 H new ATOM 1748 N GLN A 116 4.725 7.466 3.561 1.00 0.00 N ATOM 1749 CA GLN A 116 4.982 8.566 2.640 1.00 0.00 C ATOM 1750 C GLN A 116 6.397 9.107 2.819 1.00 0.00 C ATOM 1751 O GLN A 116 7.202 9.084 1.888 1.00 0.00 O ATOM 1752 CB GLN A 116 3.964 9.687 2.854 1.00 0.00 C ATOM 1753 CG GLN A 116 4.024 10.774 1.793 1.00 0.00 C ATOM 1754 CD GLN A 116 2.717 11.531 1.658 1.00 0.00 C ATOM 1755 OE1 GLN A 116 1.733 11.004 1.139 1.00 0.00 O ATOM 1756 NE2 GLN A 116 2.701 12.773 2.126 1.00 0.00 N ATOM 0 H GLN A 116 3.954 7.629 4.208 1.00 0.00 H new ATOM 0 HA GLN A 116 4.884 8.185 1.623 1.00 0.00 H new ATOM 0 HB2 GLN A 116 2.962 9.259 2.867 1.00 0.00 H new ATOM 0 HB3 GLN A 116 4.131 10.137 3.833 1.00 0.00 H new ATOM 0 HG2 GLN A 116 4.821 11.475 2.041 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.281 10.326 0.833 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.540 13.170 2.549 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.849 13.331 2.063 1.00 0.00 H new ATOM 1765 N GLN A 117 6.691 9.594 4.020 1.00 0.00 N ATOM 1766 CA GLN A 117 8.009 10.142 4.320 1.00 0.00 C ATOM 1767 C GLN A 117 9.100 9.364 3.592 1.00 0.00 C ATOM 1768 O GLN A 117 9.815 9.914 2.754 1.00 0.00 O ATOM 1769 CB GLN A 117 8.265 10.114 5.827 1.00 0.00 C ATOM 1770 CG GLN A 117 7.711 11.325 6.561 1.00 0.00 C ATOM 1771 CD GLN A 117 8.687 12.484 6.594 1.00 0.00 C ATOM 1772 OE1 GLN A 117 9.601 12.519 7.419 1.00 0.00 O ATOM 1773 NE2 GLN A 117 8.499 13.442 5.694 1.00 0.00 N ATOM 0 H GLN A 117 6.035 9.620 4.801 1.00 0.00 H new ATOM 0 HA GLN A 117 8.033 11.175 3.974 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.821 9.211 6.246 1.00 0.00 H new ATOM 0 HB3 GLN A 117 9.339 10.052 6.004 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.788 11.646 6.079 1.00 0.00 H new ATOM 0 HG3 GLN A 117 7.456 11.041 7.582 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.729 13.373 5.029 1.00 0.00 H new ATOM 0 HE22 GLN A 117 9.125 14.247 5.668 1.00 0.00 H new ATOM 1782 N ASP A 118 9.223 8.082 3.918 1.00 0.00 N ATOM 1783 CA ASP A 118 10.227 7.228 3.295 1.00 0.00 C ATOM 1784 C ASP A 118 10.063 7.212 1.778 1.00 0.00 C ATOM 1785 O ASP A 118 11.045 7.168 1.037 1.00 0.00 O ATOM 1786 CB ASP A 118 10.130 5.804 3.845 1.00 0.00 C ATOM 1787 CG ASP A 118 10.619 5.702 5.277 1.00 0.00 C ATOM 1788 OD1 ASP A 118 9.804 5.913 6.198 1.00 0.00 O ATOM 1789 OD2 ASP A 118 11.818 5.412 5.475 1.00 0.00 O ATOM 0 H ASP A 118 8.640 7.612 4.610 1.00 0.00 H new ATOM 0 HA ASP A 118 11.210 7.635 3.532 1.00 0.00 H new ATOM 0 HB2 ASP A 118 9.095 5.467 3.793 1.00 0.00 H new ATOM 0 HB3 ASP A 118 10.715 5.134 3.216 1.00 0.00 H new ATOM 1794 N TYR A 119 8.815 7.248 1.324 1.00 0.00 N ATOM 1795 CA TYR A 119 8.521 7.235 -0.104 1.00 0.00 C ATOM 1796 C TYR A 119 8.978 8.531 -0.767 1.00 0.00 C ATOM 1797 O TYR A 119 9.027 8.631 -1.993 1.00 0.00 O ATOM 1798 CB TYR A 119 7.023 7.031 -0.336 1.00 0.00 C ATOM 1799 CG TYR A 119 6.686 6.555 -1.731 1.00 0.00 C ATOM 1800 CD1 TYR A 119 7.368 5.489 -2.307 1.00 0.00 C ATOM 1801 CD2 TYR A 119 5.686 7.170 -2.474 1.00 0.00 C ATOM 1802 CE1 TYR A 119 7.063 5.051 -3.581 1.00 0.00 C ATOM 1803 CE2 TYR A 119 5.374 6.738 -3.748 1.00 0.00 C ATOM 1804 CZ TYR A 119 6.065 5.679 -4.298 1.00 0.00 C ATOM 1805 OH TYR A 119 5.758 5.246 -5.567 1.00 0.00 O ATOM 0 H TYR A 119 7.991 7.286 1.924 1.00 0.00 H new ATOM 0 HA TYR A 119 9.068 6.406 -0.554 1.00 0.00 H new ATOM 0 HB2 TYR A 119 6.647 6.307 0.387 1.00 0.00 H new ATOM 0 HB3 TYR A 119 6.503 7.970 -0.146 1.00 0.00 H new ATOM 0 HD1 TYR A 119 8.150 4.995 -1.749 1.00 0.00 H new ATOM 0 HD2 TYR A 119 5.143 8.001 -2.048 1.00 0.00 H new ATOM 0 HE1 TYR A 119 7.603 4.222 -4.014 1.00 0.00 H new ATOM 0 HE2 TYR A 119 4.593 7.227 -4.311 1.00 0.00 H new ATOM 0 HH TYR A 119 5.347 4.358 -5.519 1.00 0.00 H new ATOM 1815 N TRP A 120 9.313 9.520 0.054 1.00 0.00 N ATOM 1816 CA TRP A 120 9.767 10.811 -0.452 1.00 0.00 C ATOM 1817 C TRP A 120 11.201 11.092 -0.017 1.00 0.00 C ATOM 1818 O TRP A 120 11.763 12.139 -0.337 1.00 0.00 O ATOM 1819 CB TRP A 120 8.844 11.927 0.040 1.00 0.00 C ATOM 1820 CG TRP A 120 9.428 13.297 -0.127 1.00 0.00 C ATOM 1821 CD1 TRP A 120 9.478 14.032 -1.277 1.00 0.00 C ATOM 1822 CD2 TRP A 120 10.047 14.095 0.889 1.00 0.00 C ATOM 1823 NE1 TRP A 120 10.091 15.239 -1.037 1.00 0.00 N ATOM 1824 CE2 TRP A 120 10.448 15.302 0.283 1.00 0.00 C ATOM 1825 CE3 TRP A 120 10.299 13.908 2.250 1.00 0.00 C ATOM 1826 CZ2 TRP A 120 11.088 16.314 0.994 1.00 0.00 C ATOM 1827 CZ3 TRP A 120 10.934 14.913 2.954 1.00 0.00 C ATOM 1828 CH2 TRP A 120 11.322 16.104 2.326 1.00 0.00 C ATOM 0 H TRP A 120 9.279 9.453 1.071 1.00 0.00 H new ATOM 0 HA TRP A 120 9.737 10.778 -1.541 1.00 0.00 H new ATOM 0 HB2 TRP A 120 7.900 11.874 -0.502 1.00 0.00 H new ATOM 0 HB3 TRP A 120 8.616 11.763 1.093 1.00 0.00 H new ATOM 0 HD1 TRP A 120 9.093 13.712 -2.234 1.00 0.00 H new ATOM 0 HE1 TRP A 120 10.253 15.969 -1.730 1.00 0.00 H new ATOM 0 HE3 TRP A 120 10.003 12.994 2.743 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 11.389 17.232 0.511 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 11.135 14.778 4.007 1.00 0.00 H new ATOM 0 HH2 TRP A 120 11.815 16.871 2.904 1.00 0.00 H new ATOM 1839 N ARG A 121 11.788 10.150 0.714 1.00 0.00 N ATOM 1840 CA ARG A 121 13.157 10.298 1.194 1.00 0.00 C ATOM 1841 C ARG A 121 14.103 9.376 0.429 1.00 0.00 C ATOM 1842 O ARG A 121 15.321 9.436 0.605 1.00 0.00 O ATOM 1843 CB ARG A 121 13.232 9.994 2.691 1.00 0.00 C ATOM 1844 CG ARG A 121 12.898 11.186 3.572 1.00 0.00 C ATOM 1845 CD ARG A 121 13.563 11.076 4.935 1.00 0.00 C ATOM 1846 NE ARG A 121 13.096 9.909 5.679 1.00 0.00 N ATOM 1847 CZ ARG A 121 13.619 9.516 6.835 1.00 0.00 C ATOM 1848 NH1 ARG A 121 14.622 10.194 7.377 1.00 0.00 N ATOM 1849 NH2 ARG A 121 13.140 8.444 7.452 1.00 0.00 N ATOM 0 H ARG A 121 11.337 9.277 0.987 1.00 0.00 H new ATOM 0 HA ARG A 121 13.465 11.330 1.025 1.00 0.00 H new ATOM 0 HB2 ARG A 121 12.547 9.179 2.922 1.00 0.00 H new ATOM 0 HB3 ARG A 121 14.236 9.645 2.932 1.00 0.00 H new ATOM 0 HG2 ARG A 121 13.221 12.104 3.081 1.00 0.00 H new ATOM 0 HG3 ARG A 121 11.818 11.255 3.698 1.00 0.00 H new ATOM 0 HD2 ARG A 121 14.644 11.016 4.807 1.00 0.00 H new ATOM 0 HD3 ARG A 121 13.360 11.979 5.511 1.00 0.00 H new ATOM 0 HE ARG A 121 12.326 9.366 5.289 1.00 0.00 H new ATOM 0 HH11 ARG A 121 14.993 11.019 6.906 1.00 0.00 H new ATOM 0 HH12 ARG A 121 15.022 9.890 8.265 1.00 0.00 H new ATOM 0 HH21 ARG A 121 12.369 7.920 7.039 1.00 0.00 H new ATOM 0 HH22 ARG A 121 13.543 8.144 8.340 1.00 0.00 H new ATOM 1863 N ILE A 122 13.535 8.525 -0.418 1.00 0.00 N ATOM 1864 CA ILE A 122 14.328 7.592 -1.209 1.00 0.00 C ATOM 1865 C ILE A 122 14.380 8.018 -2.672 1.00 0.00 C ATOM 1866 O ILE A 122 15.459 8.199 -3.239 1.00 0.00 O ATOM 1867 CB ILE A 122 13.765 6.161 -1.123 1.00 0.00 C ATOM 1868 CG1 ILE A 122 13.785 5.668 0.326 1.00 0.00 C ATOM 1869 CG2 ILE A 122 14.562 5.223 -2.018 1.00 0.00 C ATOM 1870 CD1 ILE A 122 13.032 4.372 0.534 1.00 0.00 C ATOM 0 H ILE A 122 12.529 8.462 -0.574 1.00 0.00 H new ATOM 0 HA ILE A 122 15.336 7.603 -0.793 1.00 0.00 H new ATOM 0 HB ILE A 122 12.732 6.172 -1.470 1.00 0.00 H new ATOM 0 HG12 ILE A 122 14.820 5.532 0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 122 13.355 6.436 0.969 1.00 0.00 H new ATOM 0 HG21 ILE A 122 14.152 4.216 -1.946 1.00 0.00 H new ATOM 0 HG22 ILE A 122 14.502 5.567 -3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 122 15.604 5.214 -1.699 1.00 0.00 H new ATOM 0 HD11 ILE A 122 13.088 4.083 1.583 1.00 0.00 H new ATOM 0 HD12 ILE A 122 11.988 4.508 0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 122 13.476 3.590 -0.082 1.00 0.00 H new ATOM 1882 N LEU A 123 13.209 8.178 -3.278 1.00 0.00 N ATOM 1883 CA LEU A 123 13.120 8.585 -4.676 1.00 0.00 C ATOM 1884 C LEU A 123 13.657 10.000 -4.866 1.00 0.00 C ATOM 1885 O LEU A 123 14.504 10.243 -5.725 1.00 0.00 O ATOM 1886 CB LEU A 123 11.671 8.508 -5.159 1.00 0.00 C ATOM 1887 CG LEU A 123 11.146 7.110 -5.488 1.00 0.00 C ATOM 1888 CD1 LEU A 123 10.531 6.467 -4.255 1.00 0.00 C ATOM 1889 CD2 LEU A 123 10.132 7.173 -6.621 1.00 0.00 C ATOM 0 H LEU A 123 12.308 8.032 -2.823 1.00 0.00 H new ATOM 0 HA LEU A 123 13.730 7.902 -5.267 1.00 0.00 H new ATOM 0 HB2 LEU A 123 11.030 8.944 -4.393 1.00 0.00 H new ATOM 0 HB3 LEU A 123 11.572 9.130 -6.049 1.00 0.00 H new ATOM 0 HG LEU A 123 11.985 6.495 -5.813 1.00 0.00 H new ATOM 0 HD11 LEU A 123 10.163 5.473 -4.508 1.00 0.00 H new ATOM 0 HD12 LEU A 123 11.285 6.386 -3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.703 7.081 -3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 123 9.770 6.169 -6.841 1.00 0.00 H new ATOM 0 HD22 LEU A 123 9.294 7.804 -6.325 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.605 7.591 -7.510 1.00 0.00 H new ATOM 1901 N ASN A 124 13.160 10.930 -4.057 1.00 0.00 N ATOM 1902 CA ASN A 124 13.591 12.321 -4.135 1.00 0.00 C ATOM 1903 C ASN A 124 15.090 12.441 -3.880 1.00 0.00 C ATOM 1904 O ASN A 124 15.783 11.438 -3.702 1.00 0.00 O ATOM 1905 CB ASN A 124 12.821 13.172 -3.124 1.00 0.00 C ATOM 1906 CG ASN A 124 11.355 13.315 -3.486 1.00 0.00 C ATOM 1907 OD1 ASN A 124 10.575 12.274 -3.218 1.00 0.00 O flip ATOM 1908 ND2 ASN A 124 10.929 14.350 -4.000 1.00 0.00 N flip ATOM 0 H ASN A 124 12.458 10.746 -3.340 1.00 0.00 H new ATOM 0 HA ASN A 124 13.381 12.685 -5.141 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.906 12.722 -2.135 1.00 0.00 H new ATOM 0 HB3 ASN A 124 13.276 14.161 -3.064 1.00 0.00 H new ATOM 0 HD21 ASN A 124 11.565 15.125 -4.188 1.00 0.00 H new ATOM 0 HD22 ASN A 124 9.940 14.432 -4.237 1.00 0.00 H new ATOM 1915 N HIS A 125 15.585 13.674 -3.864 1.00 0.00 N ATOM 1916 CA HIS A 125 17.003 13.926 -3.630 1.00 0.00 C ATOM 1917 C HIS A 125 17.257 14.284 -2.169 1.00 0.00 C ATOM 1918 O HIS A 125 17.992 15.225 -1.868 1.00 0.00 O ATOM 1919 CB HIS A 125 17.499 15.052 -4.537 1.00 0.00 C ATOM 1920 CG HIS A 125 18.992 15.162 -4.594 1.00 0.00 C ATOM 1921 ND1 HIS A 125 19.813 14.100 -4.908 1.00 0.00 N ATOM 1922 CD2 HIS A 125 19.810 16.218 -4.375 1.00 0.00 C ATOM 1923 CE1 HIS A 125 21.073 14.497 -4.879 1.00 0.00 C ATOM 1924 NE2 HIS A 125 21.099 15.779 -4.559 1.00 0.00 N ATOM 0 H HIS A 125 15.026 14.514 -4.010 1.00 0.00 H new ATOM 0 HA HIS A 125 17.552 13.014 -3.863 1.00 0.00 H new ATOM 0 HB2 HIS A 125 17.116 14.891 -5.545 1.00 0.00 H new ATOM 0 HB3 HIS A 125 17.086 15.998 -4.187 1.00 0.00 H new ATOM 0 HD2 HIS A 125 19.506 17.219 -4.106 1.00 0.00 H new ATOM 0 HE1 HIS A 125 21.935 13.879 -5.082 1.00 0.00 H new ATOM 0 HE2 HIS A 125 21.939 16.350 -4.464 1.00 0.00 H new ATOM 1933 N VAL A 126 16.644 13.528 -1.264 1.00 0.00 N ATOM 1934 CA VAL A 126 16.804 13.765 0.166 1.00 0.00 C ATOM 1935 C VAL A 126 17.708 12.714 0.800 1.00 0.00 C ATOM 1936 O VAL A 126 17.636 11.534 0.460 1.00 0.00 O ATOM 1937 CB VAL A 126 15.445 13.761 0.891 1.00 0.00 C ATOM 1938 CG1 VAL A 126 15.602 14.249 2.323 1.00 0.00 C ATOM 1939 CG2 VAL A 126 14.436 14.615 0.136 1.00 0.00 C ATOM 0 H VAL A 126 16.032 12.746 -1.496 1.00 0.00 H new ATOM 0 HA VAL A 126 17.263 14.748 0.274 1.00 0.00 H new ATOM 0 HB VAL A 126 15.072 12.737 0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 126 14.632 14.239 2.819 1.00 0.00 H new ATOM 0 HG12 VAL A 126 16.289 13.593 2.858 1.00 0.00 H new ATOM 0 HG13 VAL A 126 15.998 15.265 2.320 1.00 0.00 H new ATOM 0 HG21 VAL A 126 13.481 14.601 0.662 1.00 0.00 H new ATOM 0 HG22 VAL A 126 14.801 15.640 0.074 1.00 0.00 H new ATOM 0 HG23 VAL A 126 14.302 14.216 -0.870 1.00 0.00 H new ATOM 1949 N GLU A 127 18.559 13.152 1.723 1.00 0.00 N ATOM 1950 CA GLU A 127 19.478 12.248 2.404 1.00 0.00 C ATOM 1951 C GLU A 127 19.980 11.165 1.453 1.00 0.00 C ATOM 1952 O GLU A 127 20.049 9.989 1.814 1.00 0.00 O ATOM 1953 CB GLU A 127 18.794 11.605 3.612 1.00 0.00 C ATOM 1954 CG GLU A 127 19.767 11.063 4.645 1.00 0.00 C ATOM 1955 CD GLU A 127 19.068 10.498 5.866 1.00 0.00 C ATOM 1956 OE1 GLU A 127 18.616 9.335 5.807 1.00 0.00 O ATOM 1957 OE2 GLU A 127 18.972 11.219 6.881 1.00 0.00 O ATOM 0 H GLU A 127 18.631 14.126 2.016 1.00 0.00 H new ATOM 0 HA GLU A 127 20.333 12.830 2.747 1.00 0.00 H new ATOM 0 HB2 GLU A 127 18.146 12.342 4.087 1.00 0.00 H new ATOM 0 HB3 GLU A 127 18.154 10.793 3.267 1.00 0.00 H new ATOM 0 HG2 GLU A 127 20.379 10.285 4.189 1.00 0.00 H new ATOM 0 HG3 GLU A 127 20.443 11.860 4.955 1.00 0.00 H new ATOM 1964 N LYS A 128 20.329 11.569 0.237 1.00 0.00 N ATOM 1965 CA LYS A 128 20.826 10.635 -0.767 1.00 0.00 C ATOM 1966 C LYS A 128 21.692 9.556 -0.125 1.00 0.00 C ATOM 1967 O LYS A 128 21.704 8.409 -0.572 1.00 0.00 O ATOM 1968 CB LYS A 128 21.630 11.382 -1.834 1.00 0.00 C ATOM 1969 CG LYS A 128 22.947 11.940 -1.324 1.00 0.00 C ATOM 1970 CD LYS A 128 24.077 10.937 -1.485 1.00 0.00 C ATOM 1971 CE LYS A 128 24.724 11.042 -2.858 1.00 0.00 C ATOM 1972 NZ LYS A 128 25.740 12.129 -2.910 1.00 0.00 N ATOM 0 H LYS A 128 20.277 12.538 -0.078 1.00 0.00 H new ATOM 0 HA LYS A 128 19.968 10.155 -1.237 1.00 0.00 H new ATOM 0 HB2 LYS A 128 21.829 10.706 -2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 128 21.026 12.200 -2.226 1.00 0.00 H new ATOM 0 HG2 LYS A 128 23.190 12.854 -1.866 1.00 0.00 H new ATOM 0 HG3 LYS A 128 22.846 12.210 -0.273 1.00 0.00 H new ATOM 0 HD2 LYS A 128 24.828 11.107 -0.714 1.00 0.00 H new ATOM 0 HD3 LYS A 128 23.693 9.928 -1.339 1.00 0.00 H new ATOM 0 HE2 LYS A 128 25.195 10.092 -3.111 1.00 0.00 H new ATOM 0 HE3 LYS A 128 23.955 11.227 -3.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 26.158 12.168 -3.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 25.286 13.039 -2.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 26.487 11.940 -2.212 1.00 0.00 H new ATOM 1986 N SER A 129 22.414 9.931 0.926 1.00 0.00 N ATOM 1987 CA SER A 129 23.284 8.995 1.628 1.00 0.00 C ATOM 1988 C SER A 129 22.469 8.034 2.488 1.00 0.00 C ATOM 1989 O SER A 129 22.526 8.081 3.716 1.00 0.00 O ATOM 1990 CB SER A 129 24.286 9.754 2.500 1.00 0.00 C ATOM 1991 OG SER A 129 25.449 8.978 2.734 1.00 0.00 O ATOM 0 H SER A 129 22.414 10.876 1.310 1.00 0.00 H new ATOM 0 HA SER A 129 23.828 8.414 0.883 1.00 0.00 H new ATOM 0 HB2 SER A 129 24.561 10.690 2.013 1.00 0.00 H new ATOM 0 HB3 SER A 129 23.821 10.014 3.451 1.00 0.00 H new ATOM 0 HG SER A 129 26.074 9.486 3.292 1.00 0.00 H new ATOM 1997 N GLY A 130 21.708 7.163 1.832 1.00 0.00 N ATOM 1998 CA GLY A 130 20.891 6.203 2.551 1.00 0.00 C ATOM 1999 C GLY A 130 21.680 4.988 2.997 1.00 0.00 C ATOM 2000 O GLY A 130 22.904 5.028 3.122 1.00 0.00 O ATOM 0 H GLY A 130 21.643 7.105 0.816 1.00 0.00 H new ATOM 0 HA2 GLY A 130 20.451 6.686 3.423 1.00 0.00 H new ATOM 0 HA3 GLY A 130 20.067 5.883 1.914 1.00 0.00 H new ATOM 2004 N PRO A 131 20.972 3.877 3.247 1.00 0.00 N ATOM 2005 CA PRO A 131 21.594 2.624 3.687 1.00 0.00 C ATOM 2006 C PRO A 131 22.419 1.968 2.585 1.00 0.00 C ATOM 2007 O PRO A 131 22.981 0.890 2.776 1.00 0.00 O ATOM 2008 CB PRO A 131 20.397 1.744 4.055 1.00 0.00 C ATOM 2009 CG PRO A 131 19.270 2.278 3.241 1.00 0.00 C ATOM 2010 CD PRO A 131 19.510 3.757 3.120 1.00 0.00 C ATOM 0 HA PRO A 131 22.293 2.782 4.509 1.00 0.00 H new ATOM 0 HB2 PRO A 131 20.590 0.696 3.825 1.00 0.00 H new ATOM 0 HB3 PRO A 131 20.177 1.801 5.121 1.00 0.00 H new ATOM 0 HG2 PRO A 131 19.240 1.806 2.259 1.00 0.00 H new ATOM 0 HG3 PRO A 131 18.312 2.076 3.721 1.00 0.00 H new ATOM 0 HD2 PRO A 131 19.157 4.145 2.165 1.00 0.00 H new ATOM 0 HD3 PRO A 131 18.992 4.313 3.901 1.00 0.00 H new ATOM 2018 N SER A 132 22.488 2.626 1.433 1.00 0.00 N ATOM 2019 CA SER A 132 23.242 2.105 0.298 1.00 0.00 C ATOM 2020 C SER A 132 24.739 2.114 0.591 1.00 0.00 C ATOM 2021 O SER A 132 25.411 3.130 0.416 1.00 0.00 O ATOM 2022 CB SER A 132 22.951 2.929 -0.957 1.00 0.00 C ATOM 2023 OG SER A 132 23.676 2.436 -2.070 1.00 0.00 O ATOM 0 H SER A 132 22.031 3.521 1.260 1.00 0.00 H new ATOM 0 HA SER A 132 22.929 1.075 0.127 1.00 0.00 H new ATOM 0 HB2 SER A 132 21.883 2.902 -1.174 1.00 0.00 H new ATOM 0 HB3 SER A 132 23.214 3.972 -0.780 1.00 0.00 H new ATOM 0 HG SER A 132 23.472 2.979 -2.860 1.00 0.00 H new ATOM 2029 N SER A 133 25.255 0.973 1.039 1.00 0.00 N ATOM 2030 CA SER A 133 26.672 0.849 1.360 1.00 0.00 C ATOM 2031 C SER A 133 27.509 0.736 0.090 1.00 0.00 C ATOM 2032 O SER A 133 27.077 0.149 -0.901 1.00 0.00 O ATOM 2033 CB SER A 133 26.909 -0.371 2.252 1.00 0.00 C ATOM 2034 OG SER A 133 26.582 -1.570 1.573 1.00 0.00 O ATOM 0 H SER A 133 24.713 0.122 1.188 1.00 0.00 H new ATOM 0 HA SER A 133 26.978 1.747 1.896 1.00 0.00 H new ATOM 0 HB2 SER A 133 27.953 -0.400 2.565 1.00 0.00 H new ATOM 0 HB3 SER A 133 26.307 -0.286 3.157 1.00 0.00 H new ATOM 0 HG SER A 133 26.744 -2.335 2.164 1.00 0.00 H new ATOM 2040 N GLY A 134 28.711 1.302 0.128 1.00 0.00 N ATOM 2041 CA GLY A 134 29.591 1.254 -1.025 1.00 0.00 C ATOM 2042 C GLY A 134 30.563 0.093 -0.965 1.00 0.00 C ATOM 2043 O GLY A 134 31.579 0.161 -0.273 1.00 0.00 O ATOM 0 H GLY A 134 29.091 1.793 0.937 1.00 0.00 H new ATOM 0 HA2 GLY A 134 28.992 1.176 -1.932 1.00 0.00 H new ATOM 0 HA3 GLY A 134 30.149 2.188 -1.091 1.00 0.00 H new TER 2047 GLY A 134