USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=33 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= 0.0412 USER MOD Set 1.2: A 92 THR OG1 : rot 180:sc=-0.00575 USER MOD Set 1.3: A 96 GLN : amide:sc= -2.92 X(o=-2.9,f=-3.1) USER MOD Set 2.1: A 18 MET CE :methyl -163:sc= -0.735 (180deg=-1.43) USER MOD Set 2.2: A 36 CYS SG : rot 66:sc= 0.71 USER MOD Set 2.3: A 39 MET CE :methyl -113:sc= -2.74! (180deg=-5.38!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -66:sc= 0.0804 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 26 ASN :FLIP amide:sc= -0.164 F(o=-0.93,f=-0.16) USER MOD Single : A 27 MET CE :methyl 168:sc= -1.57 (180deg=-1.85) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0571 USER MOD Single : A 29 MET CE :methyl -140:sc= -0.163 (180deg=-1.74!) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc=-0.00702 K(o=-0.007,f=-0.65) USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0.041) 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= -0.0922 X(o=-0.092,f=-0.078) USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.0161 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= 0.0824 K(o=0.082,f=-1.2) USER MOD Single : A 77 LYS NZ :NH3+ -130:sc=-0.000911 (180deg=-0.154) USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=0.24) USER MOD Single : A 83 MET CE :methyl -178:sc= -0.761 (180deg=-0.784) USER MOD Single : A 85 ASN : amide:sc= -0.0756 K(o=-0.076,f=-3.3!) 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 -131:sc= -0.114 (180deg=-2.75!) USER MOD Single : A 99 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 104 THR OG1 : rot -170:sc= 0.243 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 CYS SG : rot 97:sc= 0.821 USER MOD Single : A 110 GLN : amide:sc= -0.0261 K(o=-0.026,f=-1.9!) USER MOD Single : A 113 CYS SG : rot -22:sc= -2.7! USER MOD Single : A 116 GLN : amide:sc= -0.0642 K(o=-0.064,f=-3.9!) USER MOD Single : A 117 GLN : amide:sc= -0.273 X(o=-0.27,f=-0.53) USER MOD Single : A 119 TYR OH : rot 83:sc= 0.609 USER MOD Single : A 124 ASN :FLIP amide:sc= -0.435 F(o=-1.7,f=-0.43) USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=0) 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 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 45:sc= 0.771 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.192 -17.389 9.431 1.00 0.00 N ATOM 2 CA GLY A 1 7.671 -17.848 8.157 1.00 0.00 C ATOM 3 C GLY A 1 8.528 -18.933 7.537 1.00 0.00 C ATOM 4 O GLY A 1 9.673 -18.688 7.157 1.00 0.00 O ATOM 0 H1 GLY A 1 7.571 -16.648 9.813 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.231 -18.186 10.098 1.00 0.00 H new ATOM 0 H3 GLY A 1 9.148 -17.003 9.296 1.00 0.00 H new ATOM 0 HA2 GLY A 1 6.658 -18.225 8.297 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.605 -17.004 7.470 1.00 0.00 H new ATOM 8 N SER A 2 7.973 -20.137 7.435 1.00 0.00 N ATOM 9 CA SER A 2 8.697 -21.266 6.862 1.00 0.00 C ATOM 10 C SER A 2 8.348 -21.442 5.387 1.00 0.00 C ATOM 11 O SER A 2 7.334 -22.051 5.046 1.00 0.00 O ATOM 12 CB SER A 2 8.375 -22.549 7.631 1.00 0.00 C ATOM 13 OG SER A 2 9.107 -22.615 8.842 1.00 0.00 O ATOM 0 H SER A 2 7.025 -20.355 7.742 1.00 0.00 H new ATOM 0 HA SER A 2 9.764 -21.061 6.943 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.307 -22.590 7.845 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.610 -23.416 7.013 1.00 0.00 H new ATOM 0 HG SER A 2 8.882 -23.443 9.315 1.00 0.00 H new ATOM 19 N SER A 3 9.196 -20.904 4.517 1.00 0.00 N ATOM 20 CA SER A 3 8.977 -20.998 3.078 1.00 0.00 C ATOM 21 C SER A 3 10.304 -21.088 2.331 1.00 0.00 C ATOM 22 O SER A 3 11.264 -20.394 2.661 1.00 0.00 O ATOM 23 CB SER A 3 8.182 -19.788 2.582 1.00 0.00 C ATOM 24 OG SER A 3 8.974 -18.614 2.602 1.00 0.00 O ATOM 0 H SER A 3 10.041 -20.398 4.783 1.00 0.00 H new ATOM 0 HA SER A 3 8.406 -21.906 2.881 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.827 -19.973 1.568 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.301 -19.647 3.208 1.00 0.00 H new ATOM 0 HG SER A 3 8.443 -17.856 2.279 1.00 0.00 H new ATOM 30 N GLY A 4 10.350 -21.952 1.321 1.00 0.00 N ATOM 31 CA GLY A 4 11.563 -22.119 0.542 1.00 0.00 C ATOM 32 C GLY A 4 12.117 -20.800 0.041 1.00 0.00 C ATOM 33 O GLY A 4 11.639 -20.258 -0.956 1.00 0.00 O ATOM 0 H GLY A 4 9.569 -22.539 1.029 1.00 0.00 H new ATOM 0 HA2 GLY A 4 12.317 -22.618 1.151 1.00 0.00 H new ATOM 0 HA3 GLY A 4 11.358 -22.770 -0.308 1.00 0.00 H new ATOM 37 N SER A 5 13.125 -20.282 0.734 1.00 0.00 N ATOM 38 CA SER A 5 13.741 -19.015 0.357 1.00 0.00 C ATOM 39 C SER A 5 15.018 -18.772 1.155 1.00 0.00 C ATOM 40 O SER A 5 15.178 -19.286 2.262 1.00 0.00 O ATOM 41 CB SER A 5 12.761 -17.861 0.578 1.00 0.00 C ATOM 42 OG SER A 5 12.596 -17.590 1.959 1.00 0.00 O ATOM 0 H SER A 5 13.533 -20.720 1.560 1.00 0.00 H new ATOM 0 HA SER A 5 13.999 -19.066 -0.701 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.125 -16.968 0.070 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.796 -18.109 0.135 1.00 0.00 H new ATOM 0 HG SER A 5 12.164 -18.355 2.393 1.00 0.00 H new ATOM 48 N SER A 6 15.925 -17.986 0.584 1.00 0.00 N ATOM 49 CA SER A 6 17.191 -17.678 1.239 1.00 0.00 C ATOM 50 C SER A 6 16.958 -16.898 2.530 1.00 0.00 C ATOM 51 O SER A 6 15.897 -16.309 2.730 1.00 0.00 O ATOM 52 CB SER A 6 18.093 -16.875 0.300 1.00 0.00 C ATOM 53 OG SER A 6 18.327 -17.578 -0.908 1.00 0.00 O ATOM 0 H SER A 6 15.807 -17.551 -0.331 1.00 0.00 H new ATOM 0 HA SER A 6 17.683 -18.619 1.487 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.630 -15.913 0.081 1.00 0.00 H new ATOM 0 HB3 SER A 6 19.043 -16.667 0.793 1.00 0.00 H new ATOM 0 HG SER A 6 18.905 -17.043 -1.491 1.00 0.00 H new ATOM 59 N GLY A 7 17.961 -16.900 3.404 1.00 0.00 N ATOM 60 CA GLY A 7 17.847 -16.190 4.664 1.00 0.00 C ATOM 61 C GLY A 7 18.770 -14.990 4.739 1.00 0.00 C ATOM 62 O GLY A 7 18.312 -13.849 4.805 1.00 0.00 O ATOM 0 H GLY A 7 18.849 -17.380 3.261 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.817 -15.861 4.800 1.00 0.00 H new ATOM 0 HA3 GLY A 7 18.075 -16.872 5.483 1.00 0.00 H new ATOM 66 N ASP A 8 20.073 -15.247 4.731 1.00 0.00 N ATOM 67 CA ASP A 8 21.063 -14.178 4.800 1.00 0.00 C ATOM 68 C ASP A 8 20.652 -12.999 3.924 1.00 0.00 C ATOM 69 O ASP A 8 20.735 -11.844 4.341 1.00 0.00 O ATOM 70 CB ASP A 8 22.435 -14.697 4.367 1.00 0.00 C ATOM 71 CG ASP A 8 23.540 -13.689 4.616 1.00 0.00 C ATOM 72 OD1 ASP A 8 24.099 -13.685 5.732 1.00 0.00 O ATOM 73 OD2 ASP A 8 23.846 -12.904 3.694 1.00 0.00 O ATOM 0 H ASP A 8 20.469 -16.186 4.677 1.00 0.00 H new ATOM 0 HA ASP A 8 21.121 -13.836 5.833 1.00 0.00 H new ATOM 0 HB2 ASP A 8 22.659 -15.618 4.906 1.00 0.00 H new ATOM 0 HB3 ASP A 8 22.408 -14.947 3.306 1.00 0.00 H new ATOM 78 N ASP A 9 20.210 -13.299 2.707 1.00 0.00 N ATOM 79 CA ASP A 9 19.786 -12.264 1.772 1.00 0.00 C ATOM 80 C ASP A 9 18.332 -12.469 1.356 1.00 0.00 C ATOM 81 O ASP A 9 18.053 -13.031 0.297 1.00 0.00 O ATOM 82 CB ASP A 9 20.687 -12.263 0.536 1.00 0.00 C ATOM 83 CG ASP A 9 20.958 -13.661 0.016 1.00 0.00 C ATOM 84 OD1 ASP A 9 21.648 -14.430 0.717 1.00 0.00 O ATOM 85 OD2 ASP A 9 20.482 -13.985 -1.092 1.00 0.00 O ATOM 0 H ASP A 9 20.136 -14.250 2.346 1.00 0.00 H new ATOM 0 HA ASP A 9 19.869 -11.300 2.274 1.00 0.00 H new ATOM 0 HB2 ASP A 9 20.220 -11.670 -0.250 1.00 0.00 H new ATOM 0 HB3 ASP A 9 21.633 -11.779 0.780 1.00 0.00 H new ATOM 90 N ASP A 10 17.411 -12.012 2.197 1.00 0.00 N ATOM 91 CA ASP A 10 15.986 -12.145 1.918 1.00 0.00 C ATOM 92 C ASP A 10 15.514 -11.048 0.969 1.00 0.00 C ATOM 93 O ASP A 10 14.895 -11.327 -0.059 1.00 0.00 O ATOM 94 CB ASP A 10 15.183 -12.094 3.218 1.00 0.00 C ATOM 95 CG ASP A 10 13.687 -12.083 2.974 1.00 0.00 C ATOM 96 OD1 ASP A 10 13.157 -11.023 2.580 1.00 0.00 O ATOM 97 OD2 ASP A 10 13.045 -13.135 3.176 1.00 0.00 O ATOM 0 H ASP A 10 17.626 -11.546 3.078 1.00 0.00 H new ATOM 0 HA ASP A 10 15.823 -13.110 1.438 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.441 -12.955 3.835 1.00 0.00 H new ATOM 0 HB3 ASP A 10 15.463 -11.203 3.780 1.00 0.00 H new ATOM 102 N ILE A 11 15.808 -9.801 1.321 1.00 0.00 N ATOM 103 CA ILE A 11 15.412 -8.663 0.501 1.00 0.00 C ATOM 104 C ILE A 11 15.768 -8.891 -0.964 1.00 0.00 C ATOM 105 O ILE A 11 14.969 -8.610 -1.857 1.00 0.00 O ATOM 106 CB ILE A 11 16.081 -7.362 0.984 1.00 0.00 C ATOM 107 CG1 ILE A 11 15.449 -6.894 2.296 1.00 0.00 C ATOM 108 CG2 ILE A 11 15.967 -6.281 -0.081 1.00 0.00 C ATOM 109 CD1 ILE A 11 16.203 -5.764 2.961 1.00 0.00 C ATOM 0 H ILE A 11 16.319 -9.553 2.168 1.00 0.00 H new ATOM 0 HA ILE A 11 14.331 -8.564 0.598 1.00 0.00 H new ATOM 0 HB ILE A 11 17.138 -7.559 1.162 1.00 0.00 H new ATOM 0 HG12 ILE A 11 14.426 -6.573 2.102 1.00 0.00 H new ATOM 0 HG13 ILE A 11 15.394 -7.737 2.984 1.00 0.00 H new ATOM 0 HG21 ILE A 11 16.444 -5.368 0.275 1.00 0.00 H new ATOM 0 HG22 ILE A 11 16.460 -6.616 -0.994 1.00 0.00 H new ATOM 0 HG23 ILE A 11 14.915 -6.084 -0.288 1.00 0.00 H new ATOM 0 HD11 ILE A 11 15.698 -5.484 3.885 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.219 -6.088 3.186 1.00 0.00 H new ATOM 0 HD13 ILE A 11 16.236 -4.905 2.291 1.00 0.00 H new ATOM 121 N GLU A 12 16.971 -9.404 -1.202 1.00 0.00 N ATOM 122 CA GLU A 12 17.431 -9.670 -2.560 1.00 0.00 C ATOM 123 C GLU A 12 16.390 -10.466 -3.341 1.00 0.00 C ATOM 124 O GLU A 12 15.938 -10.040 -4.404 1.00 0.00 O ATOM 125 CB GLU A 12 18.757 -10.434 -2.532 1.00 0.00 C ATOM 126 CG GLU A 12 19.947 -9.574 -2.144 1.00 0.00 C ATOM 127 CD GLU A 12 20.615 -8.927 -3.342 1.00 0.00 C ATOM 128 OE1 GLU A 12 19.947 -8.778 -4.386 1.00 0.00 O ATOM 129 OE2 GLU A 12 21.808 -8.571 -3.235 1.00 0.00 O ATOM 0 H GLU A 12 17.644 -9.643 -0.474 1.00 0.00 H new ATOM 0 HA GLU A 12 17.581 -8.713 -3.059 1.00 0.00 H new ATOM 0 HB2 GLU A 12 18.674 -11.263 -1.829 1.00 0.00 H new ATOM 0 HB3 GLU A 12 18.938 -10.867 -3.516 1.00 0.00 H new ATOM 0 HG2 GLU A 12 19.619 -8.798 -1.452 1.00 0.00 H new ATOM 0 HG3 GLU A 12 20.676 -10.187 -1.613 1.00 0.00 H new ATOM 136 N GLN A 13 16.014 -11.623 -2.806 1.00 0.00 N ATOM 137 CA GLN A 13 15.027 -12.479 -3.454 1.00 0.00 C ATOM 138 C GLN A 13 13.775 -11.688 -3.817 1.00 0.00 C ATOM 139 O GLN A 13 13.173 -11.907 -4.869 1.00 0.00 O ATOM 140 CB GLN A 13 14.658 -13.649 -2.540 1.00 0.00 C ATOM 141 CG GLN A 13 15.840 -14.530 -2.171 1.00 0.00 C ATOM 142 CD GLN A 13 16.107 -15.610 -3.201 1.00 0.00 C ATOM 143 OE1 GLN A 13 15.219 -16.391 -3.543 1.00 0.00 O ATOM 144 NE2 GLN A 13 17.336 -15.659 -3.703 1.00 0.00 N ATOM 0 H GLN A 13 16.378 -11.989 -1.926 1.00 0.00 H new ATOM 0 HA GLN A 13 15.467 -12.868 -4.372 1.00 0.00 H new ATOM 0 HB2 GLN A 13 14.208 -13.258 -1.627 1.00 0.00 H new ATOM 0 HB3 GLN A 13 13.901 -14.259 -3.033 1.00 0.00 H new ATOM 0 HG2 GLN A 13 16.730 -13.910 -2.061 1.00 0.00 H new ATOM 0 HG3 GLN A 13 15.654 -14.995 -1.203 1.00 0.00 H new ATOM 0 HE21 GLN A 13 18.041 -14.992 -3.391 1.00 0.00 H new ATOM 0 HE22 GLN A 13 17.574 -16.364 -4.401 1.00 0.00 H new ATOM 153 N LEU A 14 13.388 -10.767 -2.941 1.00 0.00 N ATOM 154 CA LEU A 14 12.207 -9.942 -3.170 1.00 0.00 C ATOM 155 C LEU A 14 12.483 -8.875 -4.224 1.00 0.00 C ATOM 156 O LEU A 14 11.613 -8.543 -5.030 1.00 0.00 O ATOM 157 CB LEU A 14 11.762 -9.281 -1.864 1.00 0.00 C ATOM 158 CG LEU A 14 10.952 -7.992 -2.006 1.00 0.00 C ATOM 159 CD1 LEU A 14 9.605 -8.276 -2.650 1.00 0.00 C ATOM 160 CD2 LEU A 14 10.768 -7.326 -0.650 1.00 0.00 C ATOM 0 H LEU A 14 13.875 -10.573 -2.066 1.00 0.00 H new ATOM 0 HA LEU A 14 11.408 -10.588 -3.535 1.00 0.00 H new ATOM 0 HB2 LEU A 14 11.167 -10.000 -1.301 1.00 0.00 H new ATOM 0 HB3 LEU A 14 12.649 -9.065 -1.269 1.00 0.00 H new ATOM 0 HG LEU A 14 11.503 -7.309 -2.652 1.00 0.00 H new ATOM 0 HD11 LEU A 14 9.043 -7.347 -2.743 1.00 0.00 H new ATOM 0 HD12 LEU A 14 9.758 -8.708 -3.639 1.00 0.00 H new ATOM 0 HD13 LEU A 14 9.046 -8.978 -2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 14 10.189 -6.410 -0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 14 10.239 -8.004 0.020 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.744 -7.086 -0.227 1.00 0.00 H new ATOM 172 N LEU A 15 13.701 -8.344 -4.216 1.00 0.00 N ATOM 173 CA LEU A 15 14.094 -7.316 -5.173 1.00 0.00 C ATOM 174 C LEU A 15 13.881 -7.796 -6.605 1.00 0.00 C ATOM 175 O LEU A 15 13.263 -7.106 -7.416 1.00 0.00 O ATOM 176 CB LEU A 15 15.559 -6.930 -4.965 1.00 0.00 C ATOM 177 CG LEU A 15 15.851 -6.027 -3.766 1.00 0.00 C ATOM 178 CD1 LEU A 15 17.351 -5.886 -3.557 1.00 0.00 C ATOM 179 CD2 LEU A 15 15.207 -4.661 -3.958 1.00 0.00 C ATOM 0 H LEU A 15 14.433 -8.609 -3.557 1.00 0.00 H new ATOM 0 HA LEU A 15 13.467 -6.440 -5.006 1.00 0.00 H new ATOM 0 HB2 LEU A 15 16.143 -7.844 -4.857 1.00 0.00 H new ATOM 0 HB3 LEU A 15 15.914 -6.430 -5.866 1.00 0.00 H new ATOM 0 HG LEU A 15 15.422 -6.487 -2.876 1.00 0.00 H new ATOM 0 HD11 LEU A 15 17.540 -5.240 -2.700 1.00 0.00 H new ATOM 0 HD12 LEU A 15 17.787 -6.868 -3.374 1.00 0.00 H new ATOM 0 HD13 LEU A 15 17.803 -5.449 -4.447 1.00 0.00 H new ATOM 0 HD21 LEU A 15 15.425 -4.031 -3.095 1.00 0.00 H new ATOM 0 HD22 LEU A 15 15.606 -4.194 -4.858 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.128 -4.778 -4.058 1.00 0.00 H new ATOM 191 N GLU A 16 14.396 -8.984 -6.909 1.00 0.00 N ATOM 192 CA GLU A 16 14.261 -9.556 -8.243 1.00 0.00 C ATOM 193 C GLU A 16 12.829 -9.416 -8.753 1.00 0.00 C ATOM 194 O GLU A 16 12.603 -9.120 -9.926 1.00 0.00 O ATOM 195 CB GLU A 16 14.668 -11.031 -8.233 1.00 0.00 C ATOM 196 CG GLU A 16 16.056 -11.275 -7.665 1.00 0.00 C ATOM 197 CD GLU A 16 16.732 -12.487 -8.277 1.00 0.00 C ATOM 198 OE1 GLU A 16 16.135 -13.583 -8.236 1.00 0.00 O ATOM 199 OE2 GLU A 16 17.858 -12.339 -8.796 1.00 0.00 O ATOM 0 H GLU A 16 14.910 -9.568 -6.249 1.00 0.00 H new ATOM 0 HA GLU A 16 14.923 -9.008 -8.914 1.00 0.00 H new ATOM 0 HB2 GLU A 16 13.941 -11.596 -7.649 1.00 0.00 H new ATOM 0 HB3 GLU A 16 14.628 -11.417 -9.252 1.00 0.00 H new ATOM 0 HG2 GLU A 16 16.674 -10.394 -7.836 1.00 0.00 H new ATOM 0 HG3 GLU A 16 15.984 -11.410 -6.586 1.00 0.00 H new ATOM 206 N PHE A 17 11.867 -9.631 -7.862 1.00 0.00 N ATOM 207 CA PHE A 17 10.457 -9.531 -8.221 1.00 0.00 C ATOM 208 C PHE A 17 10.055 -8.076 -8.445 1.00 0.00 C ATOM 209 O PHE A 17 9.270 -7.769 -9.341 1.00 0.00 O ATOM 210 CB PHE A 17 9.585 -10.150 -7.127 1.00 0.00 C ATOM 211 CG PHE A 17 8.205 -9.561 -7.055 1.00 0.00 C ATOM 212 CD1 PHE A 17 7.962 -8.420 -6.307 1.00 0.00 C ATOM 213 CD2 PHE A 17 7.151 -10.148 -7.736 1.00 0.00 C ATOM 214 CE1 PHE A 17 6.693 -7.877 -6.239 1.00 0.00 C ATOM 215 CE2 PHE A 17 5.880 -9.609 -7.672 1.00 0.00 C ATOM 216 CZ PHE A 17 5.651 -8.471 -6.923 1.00 0.00 C ATOM 0 H PHE A 17 12.038 -9.875 -6.887 1.00 0.00 H new ATOM 0 HA PHE A 17 10.305 -10.079 -9.151 1.00 0.00 H new ATOM 0 HB2 PHE A 17 9.505 -11.223 -7.301 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.078 -10.020 -6.164 1.00 0.00 H new ATOM 0 HD1 PHE A 17 8.773 -7.950 -5.771 1.00 0.00 H new ATOM 0 HD2 PHE A 17 7.325 -11.037 -8.324 1.00 0.00 H new ATOM 0 HE1 PHE A 17 6.516 -6.988 -5.651 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.067 -10.077 -8.207 1.00 0.00 H new ATOM 0 HZ PHE A 17 4.659 -8.047 -6.873 1.00 0.00 H new ATOM 226 N MET A 18 10.600 -7.185 -7.623 1.00 0.00 N ATOM 227 CA MET A 18 10.299 -5.762 -7.732 1.00 0.00 C ATOM 228 C MET A 18 10.582 -5.252 -9.141 1.00 0.00 C ATOM 229 O MET A 18 9.800 -4.485 -9.703 1.00 0.00 O ATOM 230 CB MET A 18 11.119 -4.966 -6.715 1.00 0.00 C ATOM 231 CG MET A 18 10.567 -5.037 -5.300 1.00 0.00 C ATOM 232 SD MET A 18 9.357 -3.744 -4.961 1.00 0.00 S ATOM 233 CE MET A 18 10.432 -2.385 -4.508 1.00 0.00 C ATOM 0 H MET A 18 11.252 -7.423 -6.875 1.00 0.00 H new ATOM 0 HA MET A 18 9.239 -5.624 -7.521 1.00 0.00 H new ATOM 0 HB2 MET A 18 12.144 -5.338 -6.716 1.00 0.00 H new ATOM 0 HB3 MET A 18 11.158 -3.923 -7.029 1.00 0.00 H new ATOM 0 HG2 MET A 18 10.105 -6.012 -5.143 1.00 0.00 H new ATOM 0 HG3 MET A 18 11.389 -4.955 -4.589 1.00 0.00 H new ATOM 0 HE1 MET A 18 9.854 -1.621 -3.988 1.00 0.00 H new ATOM 0 HE2 MET A 18 11.223 -2.750 -3.853 1.00 0.00 H new ATOM 0 HE3 MET A 18 10.874 -1.956 -5.407 1.00 0.00 H new ATOM 243 N HIS A 19 11.705 -5.683 -9.707 1.00 0.00 N ATOM 244 CA HIS A 19 12.091 -5.270 -11.052 1.00 0.00 C ATOM 245 C HIS A 19 11.058 -5.726 -12.078 1.00 0.00 C ATOM 246 O HIS A 19 10.750 -5.003 -13.025 1.00 0.00 O ATOM 247 CB HIS A 19 13.465 -5.837 -11.408 1.00 0.00 C ATOM 248 CG HIS A 19 13.723 -5.903 -12.882 1.00 0.00 C ATOM 249 ND1 HIS A 19 13.875 -4.782 -13.670 1.00 0.00 N ATOM 250 CD2 HIS A 19 13.856 -6.965 -13.711 1.00 0.00 C ATOM 251 CE1 HIS A 19 14.089 -5.151 -14.920 1.00 0.00 C ATOM 252 NE2 HIS A 19 14.083 -6.470 -14.972 1.00 0.00 N ATOM 0 H HIS A 19 12.363 -6.318 -9.255 1.00 0.00 H new ATOM 0 HA HIS A 19 12.140 -4.181 -11.071 1.00 0.00 H new ATOM 0 HB2 HIS A 19 14.234 -5.223 -10.940 1.00 0.00 H new ATOM 0 HB3 HIS A 19 13.556 -6.838 -10.987 1.00 0.00 H new ATOM 0 HD2 HIS A 19 13.795 -8.007 -13.433 1.00 0.00 H new ATOM 0 HE1 HIS A 19 14.243 -4.486 -15.757 1.00 0.00 H new ATOM 0 HE2 HIS A 19 14.224 -7.031 -15.812 1.00 0.00 H new ATOM 261 N GLN A 20 10.527 -6.928 -11.881 1.00 0.00 N ATOM 262 CA GLN A 20 9.530 -7.480 -12.791 1.00 0.00 C ATOM 263 C GLN A 20 8.386 -6.494 -13.008 1.00 0.00 C ATOM 264 O GLN A 20 7.913 -6.314 -14.131 1.00 0.00 O ATOM 265 CB GLN A 20 8.984 -8.800 -12.243 1.00 0.00 C ATOM 266 CG GLN A 20 10.031 -9.897 -12.142 1.00 0.00 C ATOM 267 CD GLN A 20 9.422 -11.266 -11.913 1.00 0.00 C ATOM 268 OE1 GLN A 20 8.338 -11.389 -11.342 1.00 0.00 O ATOM 269 NE2 GLN A 20 10.118 -12.306 -12.359 1.00 0.00 N ATOM 0 H GLN A 20 10.770 -7.538 -11.100 1.00 0.00 H new ATOM 0 HA GLN A 20 10.013 -7.665 -13.750 1.00 0.00 H new ATOM 0 HB2 GLN A 20 8.557 -8.625 -11.255 1.00 0.00 H new ATOM 0 HB3 GLN A 20 8.172 -9.142 -12.885 1.00 0.00 H new ATOM 0 HG2 GLN A 20 10.622 -9.915 -13.058 1.00 0.00 H new ATOM 0 HG3 GLN A 20 10.715 -9.667 -11.325 1.00 0.00 H new ATOM 0 HE21 GLN A 20 11.012 -12.158 -12.827 1.00 0.00 H new ATOM 0 HE22 GLN A 20 9.758 -13.252 -12.234 1.00 0.00 H new ATOM 278 N LEU A 21 7.947 -5.858 -11.928 1.00 0.00 N ATOM 279 CA LEU A 21 6.858 -4.890 -12.000 1.00 0.00 C ATOM 280 C LEU A 21 7.361 -3.541 -12.503 1.00 0.00 C ATOM 281 O LEU A 21 8.464 -3.101 -12.177 1.00 0.00 O ATOM 282 CB LEU A 21 6.206 -4.724 -10.626 1.00 0.00 C ATOM 283 CG LEU A 21 5.877 -6.016 -9.878 1.00 0.00 C ATOM 284 CD1 LEU A 21 5.088 -5.715 -8.613 1.00 0.00 C ATOM 285 CD2 LEU A 21 5.105 -6.971 -10.776 1.00 0.00 C ATOM 0 H LEU A 21 8.328 -5.995 -10.992 1.00 0.00 H new ATOM 0 HA LEU A 21 6.116 -5.266 -12.705 1.00 0.00 H new ATOM 0 HB2 LEU A 21 6.869 -4.125 -10.002 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.285 -4.155 -10.750 1.00 0.00 H new ATOM 0 HG LEU A 21 6.813 -6.495 -9.592 1.00 0.00 H new ATOM 0 HD11 LEU A 21 4.863 -6.647 -8.094 1.00 0.00 H new ATOM 0 HD12 LEU A 21 5.677 -5.070 -7.961 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.157 -5.212 -8.876 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.880 -7.885 -10.227 1.00 0.00 H new ATOM 0 HD22 LEU A 21 4.175 -6.500 -11.094 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.707 -7.213 -11.652 1.00 0.00 H new ATOM 297 N PRO A 22 6.535 -2.867 -13.316 1.00 0.00 N ATOM 298 CA PRO A 22 6.873 -1.556 -13.880 1.00 0.00 C ATOM 299 C PRO A 22 6.890 -0.457 -12.823 1.00 0.00 C ATOM 300 O PRO A 22 7.814 0.353 -12.771 1.00 0.00 O ATOM 301 CB PRO A 22 5.754 -1.306 -14.894 1.00 0.00 C ATOM 302 CG PRO A 22 4.605 -2.115 -14.397 1.00 0.00 C ATOM 303 CD PRO A 22 5.205 -3.331 -13.747 1.00 0.00 C ATOM 0 HA PRO A 22 7.872 -1.546 -14.316 1.00 0.00 H new ATOM 0 HB2 PRO A 22 5.499 -0.248 -14.949 1.00 0.00 H new ATOM 0 HB3 PRO A 22 6.052 -1.615 -15.896 1.00 0.00 H new ATOM 0 HG2 PRO A 22 4.007 -1.547 -13.685 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.943 -2.397 -15.216 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.606 -3.672 -12.903 1.00 0.00 H new ATOM 0 HD3 PRO A 22 5.277 -4.165 -14.445 1.00 0.00 H new ATOM 311 N ALA A 23 5.861 -0.436 -11.982 1.00 0.00 N ATOM 312 CA ALA A 23 5.759 0.562 -10.924 1.00 0.00 C ATOM 313 C ALA A 23 7.006 0.561 -10.047 1.00 0.00 C ATOM 314 O ALA A 23 7.454 1.612 -9.587 1.00 0.00 O ATOM 315 CB ALA A 23 4.518 0.312 -10.080 1.00 0.00 C ATOM 0 H ALA A 23 5.086 -1.099 -12.013 1.00 0.00 H new ATOM 0 HA ALA A 23 5.676 1.543 -11.391 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.455 1.065 -9.294 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.631 0.371 -10.711 1.00 0.00 H new ATOM 0 HB3 ALA A 23 4.578 -0.679 -9.630 1.00 0.00 H new ATOM 321 N PHE A 24 7.562 -0.623 -9.817 1.00 0.00 N ATOM 322 CA PHE A 24 8.757 -0.760 -8.993 1.00 0.00 C ATOM 323 C PHE A 24 10.020 -0.570 -9.830 1.00 0.00 C ATOM 324 O PHE A 24 11.123 -0.472 -9.294 1.00 0.00 O ATOM 325 CB PHE A 24 8.782 -2.132 -8.317 1.00 0.00 C ATOM 326 CG PHE A 24 7.893 -2.222 -7.110 1.00 0.00 C ATOM 327 CD1 PHE A 24 7.939 -1.248 -6.125 1.00 0.00 C ATOM 328 CD2 PHE A 24 7.010 -3.279 -6.960 1.00 0.00 C ATOM 329 CE1 PHE A 24 7.122 -1.329 -5.013 1.00 0.00 C ATOM 330 CE2 PHE A 24 6.190 -3.365 -5.851 1.00 0.00 C ATOM 331 CZ PHE A 24 6.246 -2.388 -4.876 1.00 0.00 C ATOM 0 H PHE A 24 7.204 -1.502 -10.190 1.00 0.00 H new ATOM 0 HA PHE A 24 8.730 0.015 -8.227 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.478 -2.890 -9.039 1.00 0.00 H new ATOM 0 HB3 PHE A 24 9.805 -2.365 -8.023 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.621 -0.417 -6.227 1.00 0.00 H new ATOM 0 HD2 PHE A 24 6.962 -4.045 -7.719 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.169 -0.565 -4.252 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.506 -4.195 -5.747 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.606 -2.452 -4.008 1.00 0.00 H new ATOM 341 N ALA A 25 9.848 -0.520 -11.146 1.00 0.00 N ATOM 342 CA ALA A 25 10.971 -0.341 -12.057 1.00 0.00 C ATOM 343 C ALA A 25 11.192 1.135 -12.373 1.00 0.00 C ATOM 344 O ALA A 25 12.314 1.560 -12.642 1.00 0.00 O ATOM 345 CB ALA A 25 10.742 -1.128 -13.339 1.00 0.00 C ATOM 0 H ALA A 25 8.941 -0.601 -11.606 1.00 0.00 H new ATOM 0 HA ALA A 25 11.868 -0.719 -11.567 1.00 0.00 H new ATOM 0 HB1 ALA A 25 11.589 -0.985 -14.010 1.00 0.00 H new ATOM 0 HB2 ALA A 25 10.641 -2.187 -13.103 1.00 0.00 H new ATOM 0 HB3 ALA A 25 9.831 -0.776 -13.824 1.00 0.00 H new ATOM 351 N ASN A 26 10.114 1.911 -12.337 1.00 0.00 N ATOM 352 CA ASN A 26 10.190 3.339 -12.621 1.00 0.00 C ATOM 353 C ASN A 26 11.367 3.977 -11.888 1.00 0.00 C ATOM 354 O ASN A 26 11.933 4.969 -12.348 1.00 0.00 O ATOM 355 CB ASN A 26 8.887 4.031 -12.215 1.00 0.00 C ATOM 356 CG ASN A 26 8.728 5.392 -12.865 1.00 0.00 C ATOM 357 OD1 ASN A 26 9.594 6.329 -12.495 1.00 0.00 O flip ATOM 358 ND2 ASN A 26 7.839 5.598 -13.691 1.00 0.00 N flip ATOM 0 H ASN A 26 9.177 1.575 -12.114 1.00 0.00 H new ATOM 0 HA ASN A 26 10.341 3.464 -13.693 1.00 0.00 H new ATOM 0 HB2 ASN A 26 8.042 3.399 -12.490 1.00 0.00 H new ATOM 0 HB3 ASN A 26 8.861 4.144 -11.131 1.00 0.00 H new ATOM 0 HD21 ASN A 26 7.196 4.848 -13.945 1.00 0.00 H new ATOM 0 HD22 ASN A 26 7.746 6.518 -14.121 1.00 0.00 H new ATOM 365 N MET A 27 11.730 3.400 -10.748 1.00 0.00 N ATOM 366 CA MET A 27 12.841 3.911 -9.953 1.00 0.00 C ATOM 367 C MET A 27 14.008 2.929 -9.956 1.00 0.00 C ATOM 368 O MET A 27 13.814 1.717 -10.052 1.00 0.00 O ATOM 369 CB MET A 27 12.387 4.177 -8.516 1.00 0.00 C ATOM 370 CG MET A 27 11.820 2.950 -7.821 1.00 0.00 C ATOM 371 SD MET A 27 10.566 3.365 -6.593 1.00 0.00 S ATOM 372 CE MET A 27 9.417 2.009 -6.811 1.00 0.00 C ATOM 0 H MET A 27 11.272 2.579 -10.354 1.00 0.00 H new ATOM 0 HA MET A 27 13.176 4.847 -10.400 1.00 0.00 H new ATOM 0 HB2 MET A 27 13.233 4.552 -7.940 1.00 0.00 H new ATOM 0 HB3 MET A 27 11.632 4.963 -8.522 1.00 0.00 H new ATOM 0 HG2 MET A 27 11.387 2.283 -8.566 1.00 0.00 H new ATOM 0 HG3 MET A 27 12.630 2.404 -7.337 1.00 0.00 H new ATOM 0 HE1 MET A 27 8.702 2.002 -5.988 1.00 0.00 H new ATOM 0 HE2 MET A 27 8.884 2.132 -7.754 1.00 0.00 H new ATOM 0 HE3 MET A 27 9.965 1.067 -6.824 1.00 0.00 H new ATOM 382 N THR A 28 15.223 3.461 -9.852 1.00 0.00 N ATOM 383 CA THR A 28 16.421 2.632 -9.845 1.00 0.00 C ATOM 384 C THR A 28 16.303 1.503 -8.828 1.00 0.00 C ATOM 385 O THR A 28 15.386 1.487 -8.008 1.00 0.00 O ATOM 386 CB THR A 28 17.678 3.464 -9.527 1.00 0.00 C ATOM 387 OG1 THR A 28 18.855 2.717 -9.850 1.00 0.00 O ATOM 388 CG2 THR A 28 17.709 3.858 -8.058 1.00 0.00 C ATOM 0 H THR A 28 15.402 4.462 -9.772 1.00 0.00 H new ATOM 0 HA THR A 28 16.517 2.208 -10.845 1.00 0.00 H new ATOM 0 HB THR A 28 17.648 4.372 -10.130 1.00 0.00 H new ATOM 0 HG1 THR A 28 19.649 3.254 -9.646 1.00 0.00 H new ATOM 0 HG21 THR A 28 18.606 4.445 -7.857 1.00 0.00 H new ATOM 0 HG22 THR A 28 16.826 4.452 -7.822 1.00 0.00 H new ATOM 0 HG23 THR A 28 17.718 2.960 -7.440 1.00 0.00 H new ATOM 396 N MET A 29 17.237 0.559 -8.886 1.00 0.00 N ATOM 397 CA MET A 29 17.238 -0.574 -7.968 1.00 0.00 C ATOM 398 C MET A 29 17.407 -0.104 -6.526 1.00 0.00 C ATOM 399 O MET A 29 16.585 -0.412 -5.663 1.00 0.00 O ATOM 400 CB MET A 29 18.356 -1.552 -8.332 1.00 0.00 C ATOM 401 CG MET A 29 18.844 -2.382 -7.156 1.00 0.00 C ATOM 402 SD MET A 29 17.565 -3.463 -6.489 1.00 0.00 S ATOM 403 CE MET A 29 17.996 -5.018 -7.266 1.00 0.00 C ATOM 0 H MET A 29 18.003 0.556 -9.559 1.00 0.00 H new ATOM 0 HA MET A 29 16.278 -1.082 -8.056 1.00 0.00 H new ATOM 0 HB2 MET A 29 18.001 -2.221 -9.116 1.00 0.00 H new ATOM 0 HB3 MET A 29 19.196 -0.994 -8.745 1.00 0.00 H new ATOM 0 HG2 MET A 29 19.696 -2.985 -7.471 1.00 0.00 H new ATOM 0 HG3 MET A 29 19.198 -1.716 -6.369 1.00 0.00 H new ATOM 0 HE1 MET A 29 17.087 -5.536 -7.573 1.00 0.00 H new ATOM 0 HE2 MET A 29 18.618 -4.828 -8.141 1.00 0.00 H new ATOM 0 HE3 MET A 29 18.545 -5.639 -6.558 1.00 0.00 H new ATOM 413 N SER A 30 18.478 0.641 -6.273 1.00 0.00 N ATOM 414 CA SER A 30 18.756 1.149 -4.934 1.00 0.00 C ATOM 415 C SER A 30 17.467 1.563 -4.231 1.00 0.00 C ATOM 416 O SER A 30 17.220 1.181 -3.087 1.00 0.00 O ATOM 417 CB SER A 30 19.715 2.339 -5.007 1.00 0.00 C ATOM 418 OG SER A 30 20.920 1.983 -5.662 1.00 0.00 O ATOM 0 H SER A 30 19.167 0.906 -6.977 1.00 0.00 H new ATOM 0 HA SER A 30 19.222 0.349 -4.358 1.00 0.00 H new ATOM 0 HB2 SER A 30 19.238 3.162 -5.539 1.00 0.00 H new ATOM 0 HB3 SER A 30 19.936 2.695 -4.001 1.00 0.00 H new ATOM 0 HG SER A 30 21.515 2.761 -5.697 1.00 0.00 H new ATOM 424 N VAL A 31 16.647 2.346 -4.925 1.00 0.00 N ATOM 425 CA VAL A 31 15.382 2.811 -4.369 1.00 0.00 C ATOM 426 C VAL A 31 14.497 1.639 -3.959 1.00 0.00 C ATOM 427 O VAL A 31 13.828 1.685 -2.927 1.00 0.00 O ATOM 428 CB VAL A 31 14.616 3.691 -5.376 1.00 0.00 C ATOM 429 CG1 VAL A 31 13.308 4.178 -4.772 1.00 0.00 C ATOM 430 CG2 VAL A 31 15.477 4.863 -5.821 1.00 0.00 C ATOM 0 H VAL A 31 16.836 2.671 -5.873 1.00 0.00 H new ATOM 0 HA VAL A 31 15.623 3.405 -3.488 1.00 0.00 H new ATOM 0 HB VAL A 31 14.381 3.089 -6.254 1.00 0.00 H new ATOM 0 HG11 VAL A 31 12.781 4.798 -5.497 1.00 0.00 H new ATOM 0 HG12 VAL A 31 12.688 3.321 -4.508 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.517 4.764 -3.877 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.921 5.474 -6.532 1.00 0.00 H new ATOM 0 HG22 VAL A 31 15.745 5.468 -4.954 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.384 4.489 -6.296 1.00 0.00 H new ATOM 440 N ARG A 32 14.499 0.590 -4.775 1.00 0.00 N ATOM 441 CA ARG A 32 13.696 -0.595 -4.498 1.00 0.00 C ATOM 442 C ARG A 32 14.112 -1.237 -3.178 1.00 0.00 C ATOM 443 O ARG A 32 13.286 -1.443 -2.289 1.00 0.00 O ATOM 444 CB ARG A 32 13.833 -1.608 -5.636 1.00 0.00 C ATOM 445 CG ARG A 32 13.365 -1.079 -6.982 1.00 0.00 C ATOM 446 CD ARG A 32 13.850 -1.957 -8.125 1.00 0.00 C ATOM 447 NE ARG A 32 14.018 -1.201 -9.363 1.00 0.00 N ATOM 448 CZ ARG A 32 14.461 -1.735 -10.496 1.00 0.00 C ATOM 449 NH1 ARG A 32 14.777 -3.021 -10.547 1.00 0.00 N ATOM 450 NH2 ARG A 32 14.587 -0.981 -11.581 1.00 0.00 N ATOM 0 H ARG A 32 15.048 0.537 -5.633 1.00 0.00 H new ATOM 0 HA ARG A 32 12.654 -0.286 -4.420 1.00 0.00 H new ATOM 0 HB2 ARG A 32 14.877 -1.911 -5.717 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.260 -2.501 -5.387 1.00 0.00 H new ATOM 0 HG2 ARG A 32 12.276 -1.030 -6.996 1.00 0.00 H new ATOM 0 HG3 ARG A 32 13.732 -0.062 -7.122 1.00 0.00 H new ATOM 0 HD2 ARG A 32 14.799 -2.418 -7.850 1.00 0.00 H new ATOM 0 HD3 ARG A 32 13.138 -2.766 -8.288 1.00 0.00 H new ATOM 0 HE ARG A 32 13.782 -0.209 -9.358 1.00 0.00 H new ATOM 0 HH11 ARG A 32 14.680 -3.603 -9.715 1.00 0.00 H new ATOM 0 HH12 ARG A 32 15.117 -3.428 -11.418 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.344 0.009 -11.545 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.927 -1.391 -12.451 1.00 0.00 H new ATOM 464 N ARG A 33 15.398 -1.551 -3.058 1.00 0.00 N ATOM 465 CA ARG A 33 15.923 -2.172 -1.848 1.00 0.00 C ATOM 466 C ARG A 33 15.597 -1.328 -0.619 1.00 0.00 C ATOM 467 O ARG A 33 15.227 -1.857 0.428 1.00 0.00 O ATOM 468 CB ARG A 33 17.437 -2.362 -1.962 1.00 0.00 C ATOM 469 CG ARG A 33 18.114 -2.670 -0.637 1.00 0.00 C ATOM 470 CD ARG A 33 18.513 -1.398 0.094 1.00 0.00 C ATOM 471 NE ARG A 33 19.873 -0.980 -0.238 1.00 0.00 N ATOM 472 CZ ARG A 33 20.534 -0.036 0.424 1.00 0.00 C ATOM 473 NH1 ARG A 33 19.963 0.583 1.448 1.00 0.00 N ATOM 474 NH2 ARG A 33 21.768 0.288 0.061 1.00 0.00 N ATOM 0 H ARG A 33 16.095 -1.386 -3.784 1.00 0.00 H new ATOM 0 HA ARG A 33 15.449 -3.147 -1.735 1.00 0.00 H new ATOM 0 HB2 ARG A 33 17.641 -3.173 -2.662 1.00 0.00 H new ATOM 0 HB3 ARG A 33 17.877 -1.458 -2.384 1.00 0.00 H new ATOM 0 HG2 ARG A 33 17.441 -3.255 -0.010 1.00 0.00 H new ATOM 0 HG3 ARG A 33 18.998 -3.282 -0.813 1.00 0.00 H new ATOM 0 HD2 ARG A 33 17.816 -0.600 -0.161 1.00 0.00 H new ATOM 0 HD3 ARG A 33 18.435 -1.558 1.169 1.00 0.00 H new ATOM 0 HE ARG A 33 20.341 -1.438 -1.020 1.00 0.00 H new ATOM 0 HH11 ARG A 33 19.014 0.335 1.729 1.00 0.00 H new ATOM 0 HH12 ARG A 33 20.472 1.307 1.955 1.00 0.00 H new ATOM 0 HH21 ARG A 33 22.209 -0.187 -0.726 1.00 0.00 H new ATOM 0 HH22 ARG A 33 22.275 1.013 0.569 1.00 0.00 H new ATOM 488 N GLU A 34 15.739 -0.013 -0.755 1.00 0.00 N ATOM 489 CA GLU A 34 15.461 0.903 0.345 1.00 0.00 C ATOM 490 C GLU A 34 13.997 0.819 0.766 1.00 0.00 C ATOM 491 O GLU A 34 13.682 0.787 1.956 1.00 0.00 O ATOM 492 CB GLU A 34 15.806 2.338 -0.058 1.00 0.00 C ATOM 493 CG GLU A 34 17.297 2.583 -0.221 1.00 0.00 C ATOM 494 CD GLU A 34 17.667 4.046 -0.077 1.00 0.00 C ATOM 495 OE1 GLU A 34 17.020 4.745 0.731 1.00 0.00 O ATOM 496 OE2 GLU A 34 18.603 4.494 -0.772 1.00 0.00 O ATOM 0 H GLU A 34 16.045 0.441 -1.616 1.00 0.00 H new ATOM 0 HA GLU A 34 16.082 0.612 1.192 1.00 0.00 H new ATOM 0 HB2 GLU A 34 15.303 2.574 -0.996 1.00 0.00 H new ATOM 0 HB3 GLU A 34 15.414 3.022 0.695 1.00 0.00 H new ATOM 0 HG2 GLU A 34 17.841 2.000 0.522 1.00 0.00 H new ATOM 0 HG3 GLU A 34 17.615 2.226 -1.201 1.00 0.00 H new ATOM 503 N LEU A 35 13.106 0.784 -0.219 1.00 0.00 N ATOM 504 CA LEU A 35 11.674 0.705 0.048 1.00 0.00 C ATOM 505 C LEU A 35 11.332 -0.572 0.810 1.00 0.00 C ATOM 506 O LEU A 35 10.520 -0.555 1.736 1.00 0.00 O ATOM 507 CB LEU A 35 10.887 0.756 -1.263 1.00 0.00 C ATOM 508 CG LEU A 35 10.866 2.106 -1.981 1.00 0.00 C ATOM 509 CD1 LEU A 35 10.673 1.912 -3.477 1.00 0.00 C ATOM 510 CD2 LEU A 35 9.771 2.995 -1.411 1.00 0.00 C ATOM 0 H LEU A 35 13.350 0.809 -1.209 1.00 0.00 H new ATOM 0 HA LEU A 35 11.397 1.560 0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 35 11.303 0.012 -1.942 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.858 0.460 -1.058 1.00 0.00 H new ATOM 0 HG LEU A 35 11.826 2.597 -1.820 1.00 0.00 H new ATOM 0 HD11 LEU A 35 10.661 2.883 -3.971 1.00 0.00 H new ATOM 0 HD12 LEU A 35 11.492 1.313 -3.875 1.00 0.00 H new ATOM 0 HD13 LEU A 35 9.728 1.400 -3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.770 3.952 -1.933 1.00 0.00 H new ATOM 0 HD22 LEU A 35 8.804 2.510 -1.541 1.00 0.00 H new ATOM 0 HD23 LEU A 35 9.953 3.162 -0.349 1.00 0.00 H new ATOM 522 N CYS A 36 11.958 -1.675 0.416 1.00 0.00 N ATOM 523 CA CYS A 36 11.721 -2.961 1.063 1.00 0.00 C ATOM 524 C CYS A 36 12.040 -2.886 2.553 1.00 0.00 C ATOM 525 O CYS A 36 11.611 -3.737 3.333 1.00 0.00 O ATOM 526 CB CYS A 36 12.566 -4.051 0.402 1.00 0.00 C ATOM 527 SG CYS A 36 12.226 -4.282 -1.359 1.00 0.00 S ATOM 0 H CYS A 36 12.633 -1.705 -0.348 1.00 0.00 H new ATOM 0 HA CYS A 36 10.666 -3.210 0.948 1.00 0.00 H new ATOM 0 HB2 CYS A 36 13.620 -3.805 0.528 1.00 0.00 H new ATOM 0 HB3 CYS A 36 12.394 -4.994 0.921 1.00 0.00 H new ATOM 0 HG CYS A 36 12.580 -3.215 -2.013 1.00 0.00 H new ATOM 533 N SER A 37 12.797 -1.865 2.941 1.00 0.00 N ATOM 534 CA SER A 37 13.178 -1.682 4.336 1.00 0.00 C ATOM 535 C SER A 37 12.227 -0.717 5.038 1.00 0.00 C ATOM 536 O SER A 37 12.264 -0.569 6.259 1.00 0.00 O ATOM 537 CB SER A 37 14.613 -1.161 4.431 1.00 0.00 C ATOM 538 OG SER A 37 15.540 -2.230 4.505 1.00 0.00 O ATOM 0 H SER A 37 13.159 -1.151 2.308 1.00 0.00 H new ATOM 0 HA SER A 37 13.117 -2.650 4.833 1.00 0.00 H new ATOM 0 HB2 SER A 37 14.836 -0.541 3.563 1.00 0.00 H new ATOM 0 HB3 SER A 37 14.715 -0.526 5.311 1.00 0.00 H new ATOM 0 HG SER A 37 16.450 -1.871 4.563 1.00 0.00 H new ATOM 544 N VAL A 38 11.375 -0.063 4.255 1.00 0.00 N ATOM 545 CA VAL A 38 10.412 0.888 4.800 1.00 0.00 C ATOM 546 C VAL A 38 8.997 0.563 4.335 1.00 0.00 C ATOM 547 O VAL A 38 8.096 1.397 4.427 1.00 0.00 O ATOM 548 CB VAL A 38 10.757 2.332 4.390 1.00 0.00 C ATOM 549 CG1 VAL A 38 12.229 2.621 4.639 1.00 0.00 C ATOM 550 CG2 VAL A 38 10.397 2.572 2.932 1.00 0.00 C ATOM 0 H VAL A 38 11.332 -0.174 3.242 1.00 0.00 H new ATOM 0 HA VAL A 38 10.463 0.805 5.886 1.00 0.00 H new ATOM 0 HB VAL A 38 10.169 3.015 5.003 1.00 0.00 H new ATOM 0 HG11 VAL A 38 12.454 3.646 4.343 1.00 0.00 H new ATOM 0 HG12 VAL A 38 12.451 2.492 5.698 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.839 1.933 4.054 1.00 0.00 H new ATOM 0 HG21 VAL A 38 10.647 3.597 2.659 1.00 0.00 H new ATOM 0 HG22 VAL A 38 10.956 1.882 2.301 1.00 0.00 H new ATOM 0 HG23 VAL A 38 9.329 2.409 2.789 1.00 0.00 H new ATOM 560 N MET A 39 8.808 -0.654 3.837 1.00 0.00 N ATOM 561 CA MET A 39 7.500 -1.090 3.360 1.00 0.00 C ATOM 562 C MET A 39 6.933 -2.188 4.254 1.00 0.00 C ATOM 563 O MET A 39 7.652 -3.100 4.664 1.00 0.00 O ATOM 564 CB MET A 39 7.601 -1.591 1.918 1.00 0.00 C ATOM 565 CG MET A 39 8.023 -3.047 1.809 1.00 0.00 C ATOM 566 SD MET A 39 7.863 -3.693 0.133 1.00 0.00 S ATOM 567 CE MET A 39 8.622 -2.374 -0.812 1.00 0.00 C ATOM 0 H MET A 39 9.543 -1.356 3.753 1.00 0.00 H new ATOM 0 HA MET A 39 6.825 -0.235 3.394 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.635 -1.464 1.429 1.00 0.00 H new ATOM 0 HB3 MET A 39 8.316 -0.972 1.376 1.00 0.00 H new ATOM 0 HG2 MET A 39 9.058 -3.147 2.135 1.00 0.00 H new ATOM 0 HG3 MET A 39 7.416 -3.649 2.486 1.00 0.00 H new ATOM 0 HE1 MET A 39 7.866 -1.885 -1.426 1.00 0.00 H new ATOM 0 HE2 MET A 39 9.063 -1.646 -0.131 1.00 0.00 H new ATOM 0 HE3 MET A 39 9.400 -2.787 -1.454 1.00 0.00 H new ATOM 577 N ILE A 40 5.642 -2.094 4.552 1.00 0.00 N ATOM 578 CA ILE A 40 4.980 -3.081 5.397 1.00 0.00 C ATOM 579 C ILE A 40 4.527 -4.287 4.581 1.00 0.00 C ATOM 580 O ILE A 40 4.355 -4.199 3.366 1.00 0.00 O ATOM 581 CB ILE A 40 3.761 -2.476 6.119 1.00 0.00 C ATOM 582 CG1 ILE A 40 4.166 -1.210 6.876 1.00 0.00 C ATOM 583 CG2 ILE A 40 3.149 -3.495 7.068 1.00 0.00 C ATOM 584 CD1 ILE A 40 3.031 -0.227 7.060 1.00 0.00 C ATOM 0 H ILE A 40 5.033 -1.345 4.221 1.00 0.00 H new ATOM 0 HA ILE A 40 5.710 -3.402 6.140 1.00 0.00 H new ATOM 0 HB ILE A 40 3.012 -2.207 5.374 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.555 -1.490 7.855 1.00 0.00 H new ATOM 0 HG13 ILE A 40 4.978 -0.719 6.339 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.289 -3.053 7.571 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.829 -4.371 6.504 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.890 -3.792 7.810 1.00 0.00 H new ATOM 0 HD11 ILE A 40 3.391 0.646 7.604 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.656 0.083 6.084 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.227 -0.701 7.624 1.00 0.00 H new ATOM 596 N PHE A 41 4.334 -5.414 5.259 1.00 0.00 N ATOM 597 CA PHE A 41 3.900 -6.639 4.598 1.00 0.00 C ATOM 598 C PHE A 41 2.455 -6.970 4.961 1.00 0.00 C ATOM 599 O PHE A 41 2.138 -7.221 6.123 1.00 0.00 O ATOM 600 CB PHE A 41 4.814 -7.804 4.985 1.00 0.00 C ATOM 601 CG PHE A 41 6.198 -7.695 4.412 1.00 0.00 C ATOM 602 CD1 PHE A 41 6.392 -7.632 3.041 1.00 0.00 C ATOM 603 CD2 PHE A 41 7.306 -7.657 5.244 1.00 0.00 C ATOM 604 CE1 PHE A 41 7.664 -7.531 2.511 1.00 0.00 C ATOM 605 CE2 PHE A 41 8.580 -7.556 4.719 1.00 0.00 C ATOM 606 CZ PHE A 41 8.760 -7.495 3.351 1.00 0.00 C ATOM 0 H PHE A 41 4.471 -5.504 6.266 1.00 0.00 H new ATOM 0 HA PHE A 41 3.959 -6.482 3.521 1.00 0.00 H new ATOM 0 HB2 PHE A 41 4.882 -7.857 6.072 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.362 -8.737 4.648 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.539 -7.662 2.379 1.00 0.00 H new ATOM 0 HD2 PHE A 41 7.172 -7.707 6.314 1.00 0.00 H new ATOM 0 HE1 PHE A 41 7.801 -7.480 1.441 1.00 0.00 H new ATOM 0 HE2 PHE A 41 9.435 -7.525 5.378 1.00 0.00 H new ATOM 0 HZ PHE A 41 9.755 -7.419 2.939 1.00 0.00 H new ATOM 616 N GLU A 42 1.584 -6.967 3.957 1.00 0.00 N ATOM 617 CA GLU A 42 0.173 -7.265 4.170 1.00 0.00 C ATOM 618 C GLU A 42 -0.392 -8.081 3.011 1.00 0.00 C ATOM 619 O GLU A 42 -0.038 -7.863 1.852 1.00 0.00 O ATOM 620 CB GLU A 42 -0.626 -5.970 4.333 1.00 0.00 C ATOM 621 CG GLU A 42 -0.726 -5.494 5.773 1.00 0.00 C ATOM 622 CD GLU A 42 -1.487 -6.464 6.656 1.00 0.00 C ATOM 623 OE1 GLU A 42 -2.612 -6.853 6.278 1.00 0.00 O ATOM 624 OE2 GLU A 42 -0.959 -6.833 7.725 1.00 0.00 O ATOM 0 H GLU A 42 1.831 -6.762 2.989 1.00 0.00 H new ATOM 0 HA GLU A 42 0.087 -7.854 5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -0.161 -5.188 3.732 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.631 -6.121 3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 42 0.277 -5.352 6.175 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -1.219 -4.522 5.797 1.00 0.00 H new ATOM 631 N VAL A 43 -1.273 -9.023 3.332 1.00 0.00 N ATOM 632 CA VAL A 43 -1.888 -9.872 2.319 1.00 0.00 C ATOM 633 C VAL A 43 -3.315 -10.245 2.706 1.00 0.00 C ATOM 634 O VAL A 43 -3.543 -10.896 3.725 1.00 0.00 O ATOM 635 CB VAL A 43 -1.075 -11.162 2.098 1.00 0.00 C ATOM 636 CG1 VAL A 43 -0.702 -11.793 3.430 1.00 0.00 C ATOM 637 CG2 VAL A 43 -1.854 -12.141 1.233 1.00 0.00 C ATOM 0 H VAL A 43 -1.577 -9.217 4.286 1.00 0.00 H new ATOM 0 HA VAL A 43 -1.904 -9.297 1.393 1.00 0.00 H new ATOM 0 HB VAL A 43 -0.154 -10.905 1.575 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -0.128 -12.703 3.254 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -0.101 -11.092 4.009 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.609 -12.037 3.983 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -1.265 -13.046 1.087 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -2.793 -12.394 1.725 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.064 -11.685 0.266 1.00 0.00 H new ATOM 647 N VAL A 44 -4.273 -9.827 1.885 1.00 0.00 N ATOM 648 CA VAL A 44 -5.679 -10.118 2.140 1.00 0.00 C ATOM 649 C VAL A 44 -6.015 -11.561 1.781 1.00 0.00 C ATOM 650 O VAL A 44 -5.726 -12.020 0.677 1.00 0.00 O ATOM 651 CB VAL A 44 -6.601 -9.175 1.345 1.00 0.00 C ATOM 652 CG1 VAL A 44 -8.060 -9.550 1.557 1.00 0.00 C ATOM 653 CG2 VAL A 44 -6.350 -7.728 1.741 1.00 0.00 C ATOM 0 H VAL A 44 -4.101 -9.286 1.038 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.846 -9.963 3.206 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.375 -9.282 0.284 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.696 -8.873 0.987 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.225 -10.573 1.219 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.305 -9.473 2.616 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.010 -7.075 1.170 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.548 -7.603 2.806 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -5.312 -7.468 1.532 1.00 0.00 H new ATOM 663 N GLU A 45 -6.628 -12.272 2.723 1.00 0.00 N ATOM 664 CA GLU A 45 -7.004 -13.664 2.505 1.00 0.00 C ATOM 665 C GLU A 45 -8.442 -13.768 2.006 1.00 0.00 C ATOM 666 O GLU A 45 -8.741 -14.550 1.104 1.00 0.00 O ATOM 667 CB GLU A 45 -6.842 -14.467 3.798 1.00 0.00 C ATOM 668 CG GLU A 45 -5.429 -14.976 4.025 1.00 0.00 C ATOM 669 CD GLU A 45 -5.145 -16.264 3.276 1.00 0.00 C ATOM 670 OE1 GLU A 45 -5.210 -16.251 2.029 1.00 0.00 O ATOM 671 OE2 GLU A 45 -4.859 -17.285 3.937 1.00 0.00 O ATOM 0 H GLU A 45 -6.874 -11.907 3.643 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.343 -14.077 1.743 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -7.134 -13.843 4.642 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.526 -15.316 3.777 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -4.717 -14.213 3.711 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.272 -15.138 5.091 1.00 0.00 H new ATOM 678 N GLN A 46 -9.327 -12.974 2.600 1.00 0.00 N ATOM 679 CA GLN A 46 -10.734 -12.978 2.216 1.00 0.00 C ATOM 680 C GLN A 46 -10.987 -12.010 1.064 1.00 0.00 C ATOM 681 O GLN A 46 -11.033 -10.796 1.260 1.00 0.00 O ATOM 682 CB GLN A 46 -11.612 -12.606 3.412 1.00 0.00 C ATOM 683 CG GLN A 46 -11.841 -13.756 4.379 1.00 0.00 C ATOM 684 CD GLN A 46 -12.515 -13.313 5.663 1.00 0.00 C ATOM 685 OE1 GLN A 46 -12.215 -12.246 6.199 1.00 0.00 O ATOM 686 NE2 GLN A 46 -13.431 -14.133 6.164 1.00 0.00 N ATOM 0 H GLN A 46 -9.095 -12.320 3.348 1.00 0.00 H new ATOM 0 HA GLN A 46 -10.991 -13.984 1.884 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -11.149 -11.778 3.948 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -12.576 -12.251 3.048 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -12.454 -14.516 3.895 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -10.885 -14.222 4.617 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -13.648 -15.008 5.686 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -13.917 -13.888 7.026 1.00 0.00 H new ATOM 695 N ALA A 47 -11.149 -12.556 -0.136 1.00 0.00 N ATOM 696 CA ALA A 47 -11.398 -11.742 -1.319 1.00 0.00 C ATOM 697 C ALA A 47 -12.531 -10.751 -1.074 1.00 0.00 C ATOM 698 O ALA A 47 -13.091 -10.691 0.020 1.00 0.00 O ATOM 699 CB ALA A 47 -11.719 -12.629 -2.513 1.00 0.00 C ATOM 0 H ALA A 47 -11.112 -13.560 -0.315 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.493 -11.174 -1.536 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -11.903 -12.007 -3.389 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -10.877 -13.293 -2.709 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -12.607 -13.223 -2.297 1.00 0.00 H new ATOM 705 N GLY A 48 -12.864 -9.974 -2.100 1.00 0.00 N ATOM 706 CA GLY A 48 -13.929 -8.995 -1.975 1.00 0.00 C ATOM 707 C GLY A 48 -13.758 -8.105 -0.760 1.00 0.00 C ATOM 708 O GLY A 48 -14.738 -7.633 -0.185 1.00 0.00 O ATOM 0 H GLY A 48 -12.416 -10.005 -3.016 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -13.958 -8.378 -2.873 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -14.887 -9.511 -1.912 1.00 0.00 H new ATOM 712 N ALA A 49 -12.509 -7.875 -0.368 1.00 0.00 N ATOM 713 CA ALA A 49 -12.213 -7.035 0.786 1.00 0.00 C ATOM 714 C ALA A 49 -11.928 -5.599 0.360 1.00 0.00 C ATOM 715 O ALA A 49 -11.338 -5.359 -0.694 1.00 0.00 O ATOM 716 CB ALA A 49 -11.033 -7.602 1.562 1.00 0.00 C ATOM 0 H ALA A 49 -11.686 -8.259 -0.833 1.00 0.00 H new ATOM 0 HA ALA A 49 -13.090 -7.027 1.434 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -10.823 -6.965 2.421 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.273 -8.608 1.906 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -10.157 -7.640 0.915 1.00 0.00 H new ATOM 722 N ILE A 50 -12.351 -4.647 1.186 1.00 0.00 N ATOM 723 CA ILE A 50 -12.140 -3.235 0.894 1.00 0.00 C ATOM 724 C ILE A 50 -10.719 -2.807 1.247 1.00 0.00 C ATOM 725 O ILE A 50 -10.266 -2.995 2.376 1.00 0.00 O ATOM 726 CB ILE A 50 -13.137 -2.347 1.662 1.00 0.00 C ATOM 727 CG1 ILE A 50 -14.573 -2.687 1.258 1.00 0.00 C ATOM 728 CG2 ILE A 50 -12.843 -0.876 1.405 1.00 0.00 C ATOM 729 CD1 ILE A 50 -14.986 -4.095 1.627 1.00 0.00 C ATOM 0 H ILE A 50 -12.841 -4.828 2.062 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.300 -3.106 -0.176 1.00 0.00 H new ATOM 0 HB ILE A 50 -13.025 -2.539 2.729 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -15.253 -1.981 1.734 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -14.680 -2.556 0.181 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -13.556 -0.261 1.954 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -11.831 -0.644 1.738 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -12.931 -0.668 0.339 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -16.015 -4.267 1.311 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.329 -4.809 1.130 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -14.912 -4.225 2.707 1.00 0.00 H new ATOM 741 N ILE A 51 -10.023 -2.228 0.274 1.00 0.00 N ATOM 742 CA ILE A 51 -8.655 -1.771 0.483 1.00 0.00 C ATOM 743 C ILE A 51 -8.622 -0.299 0.880 1.00 0.00 C ATOM 744 O ILE A 51 -7.842 0.106 1.743 1.00 0.00 O ATOM 745 CB ILE A 51 -7.796 -1.969 -0.780 1.00 0.00 C ATOM 746 CG1 ILE A 51 -8.237 -3.228 -1.530 1.00 0.00 C ATOM 747 CG2 ILE A 51 -6.323 -2.054 -0.411 1.00 0.00 C ATOM 748 CD1 ILE A 51 -7.951 -4.510 -0.780 1.00 0.00 C ATOM 0 H ILE A 51 -10.384 -2.065 -0.666 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.241 -2.373 1.292 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.936 -1.110 -1.436 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -9.306 -3.165 -1.731 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.732 -3.261 -2.496 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -5.729 -2.194 -1.314 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -6.018 -1.132 0.084 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -6.164 -2.897 0.262 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.290 -5.361 -1.371 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -6.879 -4.596 -0.602 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.478 -4.498 0.174 1.00 0.00 H new ATOM 760 N LEU A 52 -9.476 0.498 0.246 1.00 0.00 N ATOM 761 CA LEU A 52 -9.547 1.927 0.535 1.00 0.00 C ATOM 762 C LEU A 52 -10.966 2.451 0.343 1.00 0.00 C ATOM 763 O LEU A 52 -11.680 2.019 -0.562 1.00 0.00 O ATOM 764 CB LEU A 52 -8.580 2.697 -0.366 1.00 0.00 C ATOM 765 CG LEU A 52 -7.100 2.339 -0.224 1.00 0.00 C ATOM 766 CD1 LEU A 52 -6.299 2.913 -1.382 1.00 0.00 C ATOM 767 CD2 LEU A 52 -6.555 2.842 1.105 1.00 0.00 C ATOM 0 H LEU A 52 -10.128 0.180 -0.471 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.262 2.078 1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.874 2.535 -1.403 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.697 3.762 -0.164 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.004 1.253 -0.246 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.248 2.648 -1.264 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.673 2.505 -2.321 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.401 3.998 -1.392 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.501 2.578 1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.663 3.925 1.156 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -7.110 2.383 1.923 1.00 0.00 H new ATOM 779 N GLU A 53 -11.367 3.386 1.199 1.00 0.00 N ATOM 780 CA GLU A 53 -12.701 3.969 1.121 1.00 0.00 C ATOM 781 C GLU A 53 -12.650 5.363 0.502 1.00 0.00 C ATOM 782 O GLU A 53 -11.599 6.003 0.474 1.00 0.00 O ATOM 783 CB GLU A 53 -13.332 4.041 2.514 1.00 0.00 C ATOM 784 CG GLU A 53 -13.419 2.694 3.212 1.00 0.00 C ATOM 785 CD GLU A 53 -12.117 2.299 3.881 1.00 0.00 C ATOM 786 OE1 GLU A 53 -11.195 1.853 3.167 1.00 0.00 O ATOM 787 OE2 GLU A 53 -12.020 2.436 5.119 1.00 0.00 O ATOM 0 H GLU A 53 -10.788 3.755 1.953 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.313 3.329 0.485 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -12.750 4.725 3.132 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.334 4.462 2.429 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -14.212 2.727 3.959 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -13.697 1.930 2.486 1.00 0.00 H new ATOM 794 N ASP A 54 -13.792 5.826 0.007 1.00 0.00 N ATOM 795 CA ASP A 54 -13.879 7.144 -0.611 1.00 0.00 C ATOM 796 C ASP A 54 -13.855 8.243 0.446 1.00 0.00 C ATOM 797 O ASP A 54 -14.625 8.214 1.405 1.00 0.00 O ATOM 798 CB ASP A 54 -15.153 7.254 -1.450 1.00 0.00 C ATOM 799 CG ASP A 54 -16.410 7.104 -0.616 1.00 0.00 C ATOM 800 OD1 ASP A 54 -16.668 5.984 -0.128 1.00 0.00 O ATOM 801 OD2 ASP A 54 -17.136 8.107 -0.452 1.00 0.00 O ATOM 0 H ASP A 54 -14.671 5.308 0.022 1.00 0.00 H new ATOM 0 HA ASP A 54 -13.013 7.271 -1.261 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.169 8.219 -1.956 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -15.141 6.488 -2.225 1.00 0.00 H new ATOM 806 N GLY A 55 -12.964 9.213 0.265 1.00 0.00 N ATOM 807 CA GLY A 55 -12.855 10.308 1.212 1.00 0.00 C ATOM 808 C GLY A 55 -11.891 10.003 2.341 1.00 0.00 C ATOM 809 O GLY A 55 -12.063 10.488 3.459 1.00 0.00 O ATOM 0 H GLY A 55 -12.315 9.260 -0.521 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.525 11.205 0.689 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -13.839 10.525 1.627 1.00 0.00 H new ATOM 813 N GLN A 56 -10.875 9.198 2.049 1.00 0.00 N ATOM 814 CA GLN A 56 -9.882 8.828 3.051 1.00 0.00 C ATOM 815 C GLN A 56 -8.538 9.486 2.754 1.00 0.00 C ATOM 816 O GLN A 56 -8.010 9.367 1.649 1.00 0.00 O ATOM 817 CB GLN A 56 -9.719 7.308 3.101 1.00 0.00 C ATOM 818 CG GLN A 56 -8.936 6.819 4.309 1.00 0.00 C ATOM 819 CD GLN A 56 -9.306 5.406 4.712 1.00 0.00 C ATOM 820 OE1 GLN A 56 -10.387 5.165 5.250 1.00 0.00 O ATOM 821 NE2 GLN A 56 -8.409 4.461 4.454 1.00 0.00 N ATOM 0 H GLN A 56 -10.718 8.790 1.128 1.00 0.00 H new ATOM 0 HA GLN A 56 -10.232 9.181 4.021 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -10.706 6.845 3.107 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -9.216 6.975 2.193 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -7.870 6.862 4.087 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -9.114 7.491 5.149 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -7.525 4.705 4.007 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -8.604 3.491 4.703 1.00 0.00 H new ATOM 830 N GLU A 57 -7.992 10.180 3.748 1.00 0.00 N ATOM 831 CA GLU A 57 -6.710 10.857 3.591 1.00 0.00 C ATOM 832 C GLU A 57 -5.592 9.852 3.330 1.00 0.00 C ATOM 833 O GLU A 57 -5.028 9.278 4.263 1.00 0.00 O ATOM 834 CB GLU A 57 -6.389 11.682 4.839 1.00 0.00 C ATOM 835 CG GLU A 57 -5.114 12.500 4.717 1.00 0.00 C ATOM 836 CD GLU A 57 -4.713 13.155 6.024 1.00 0.00 C ATOM 837 OE1 GLU A 57 -4.771 12.475 7.070 1.00 0.00 O ATOM 838 OE2 GLU A 57 -4.342 14.347 6.002 1.00 0.00 O ATOM 0 H GLU A 57 -8.417 10.288 4.669 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.782 11.524 2.732 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -7.223 12.353 5.045 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.300 11.012 5.694 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -4.305 11.855 4.375 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -5.252 13.269 3.957 1.00 0.00 H new ATOM 845 N LEU A 58 -5.277 9.644 2.057 1.00 0.00 N ATOM 846 CA LEU A 58 -4.227 8.708 1.671 1.00 0.00 C ATOM 847 C LEU A 58 -2.858 9.211 2.120 1.00 0.00 C ATOM 848 O LEU A 58 -2.381 10.244 1.651 1.00 0.00 O ATOM 849 CB LEU A 58 -4.234 8.498 0.156 1.00 0.00 C ATOM 850 CG LEU A 58 -5.542 7.981 -0.444 1.00 0.00 C ATOM 851 CD1 LEU A 58 -5.651 8.375 -1.908 1.00 0.00 C ATOM 852 CD2 LEU A 58 -5.639 6.470 -0.288 1.00 0.00 C ATOM 0 H LEU A 58 -5.734 10.111 1.274 1.00 0.00 H new ATOM 0 HA LEU A 58 -4.424 7.756 2.164 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.987 9.445 -0.323 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.439 7.796 -0.097 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.372 8.437 0.096 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.588 7.998 -2.317 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.628 9.461 -1.995 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.815 7.948 -2.463 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.576 6.119 -0.720 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.802 5.997 -0.802 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.608 6.211 0.770 1.00 0.00 H new ATOM 864 N ASP A 59 -2.232 8.472 3.029 1.00 0.00 N ATOM 865 CA ASP A 59 -0.916 8.841 3.539 1.00 0.00 C ATOM 866 C ASP A 59 0.093 7.724 3.297 1.00 0.00 C ATOM 867 O ASP A 59 1.284 7.880 3.567 1.00 0.00 O ATOM 868 CB ASP A 59 -0.995 9.158 5.034 1.00 0.00 C ATOM 869 CG ASP A 59 -1.261 7.925 5.874 1.00 0.00 C ATOM 870 OD1 ASP A 59 -2.385 7.385 5.798 1.00 0.00 O ATOM 871 OD2 ASP A 59 -0.344 7.499 6.607 1.00 0.00 O ATOM 0 H ASP A 59 -2.614 7.614 3.428 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.583 9.730 3.004 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -0.060 9.618 5.355 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -1.785 9.889 5.206 1.00 0.00 H new ATOM 876 N SER A 60 -0.391 6.596 2.787 1.00 0.00 N ATOM 877 CA SER A 60 0.468 5.450 2.513 1.00 0.00 C ATOM 878 C SER A 60 0.325 4.998 1.063 1.00 0.00 C ATOM 879 O SER A 60 -0.747 5.116 0.468 1.00 0.00 O ATOM 880 CB SER A 60 0.128 4.294 3.455 1.00 0.00 C ATOM 881 OG SER A 60 0.331 4.662 4.808 1.00 0.00 O ATOM 0 H SER A 60 -1.374 6.451 2.555 1.00 0.00 H new ATOM 0 HA SER A 60 1.501 5.754 2.680 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.910 3.994 3.308 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.747 3.430 3.213 1.00 0.00 H new ATOM 0 HG SER A 60 0.105 3.907 5.390 1.00 0.00 H new ATOM 887 N TRP A 61 1.411 4.481 0.501 1.00 0.00 N ATOM 888 CA TRP A 61 1.407 4.011 -0.880 1.00 0.00 C ATOM 889 C TRP A 61 1.110 2.517 -0.946 1.00 0.00 C ATOM 890 O TRP A 61 1.699 1.724 -0.210 1.00 0.00 O ATOM 891 CB TRP A 61 2.753 4.306 -1.544 1.00 0.00 C ATOM 892 CG TRP A 61 2.795 3.927 -2.994 1.00 0.00 C ATOM 893 CD1 TRP A 61 1.806 4.108 -3.918 1.00 0.00 C ATOM 894 CD2 TRP A 61 3.882 3.301 -3.684 1.00 0.00 C ATOM 895 NE1 TRP A 61 2.212 3.632 -5.141 1.00 0.00 N ATOM 896 CE2 TRP A 61 3.483 3.133 -5.025 1.00 0.00 C ATOM 897 CE3 TRP A 61 5.154 2.868 -3.302 1.00 0.00 C ATOM 898 CZ2 TRP A 61 4.310 2.549 -5.980 1.00 0.00 C ATOM 899 CZ3 TRP A 61 5.975 2.288 -4.251 1.00 0.00 C ATOM 900 CH2 TRP A 61 5.550 2.134 -5.578 1.00 0.00 C ATOM 0 H TRP A 61 2.306 4.376 0.980 1.00 0.00 H new ATOM 0 HA TRP A 61 0.621 4.542 -1.416 1.00 0.00 H new ATOM 0 HB2 TRP A 61 2.973 5.369 -1.447 1.00 0.00 H new ATOM 0 HB3 TRP A 61 3.538 3.768 -1.012 1.00 0.00 H new ATOM 0 HD1 TRP A 61 0.846 4.559 -3.717 1.00 0.00 H new ATOM 0 HE1 TRP A 61 1.657 3.647 -5.997 1.00 0.00 H new ATOM 0 HE3 TRP A 61 5.490 2.984 -2.282 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 3.984 2.428 -7.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 6.960 1.948 -3.966 1.00 0.00 H new ATOM 0 HH2 TRP A 61 6.215 1.679 -6.297 1.00 0.00 H new ATOM 911 N TYR A 62 0.195 2.138 -1.830 1.00 0.00 N ATOM 912 CA TYR A 62 -0.181 0.738 -1.990 1.00 0.00 C ATOM 913 C TYR A 62 0.261 0.207 -3.350 1.00 0.00 C ATOM 914 O TYR A 62 0.209 0.917 -4.354 1.00 0.00 O ATOM 915 CB TYR A 62 -1.694 0.574 -1.833 1.00 0.00 C ATOM 916 CG TYR A 62 -2.217 1.034 -0.491 1.00 0.00 C ATOM 917 CD1 TYR A 62 -2.269 2.385 -0.170 1.00 0.00 C ATOM 918 CD2 TYR A 62 -2.660 0.118 0.455 1.00 0.00 C ATOM 919 CE1 TYR A 62 -2.746 2.810 1.055 1.00 0.00 C ATOM 920 CE2 TYR A 62 -3.140 0.534 1.682 1.00 0.00 C ATOM 921 CZ TYR A 62 -3.180 1.880 1.978 1.00 0.00 C ATOM 922 OH TYR A 62 -3.657 2.300 3.198 1.00 0.00 O ATOM 0 H TYR A 62 -0.301 2.781 -2.448 1.00 0.00 H new ATOM 0 HA TYR A 62 0.323 0.162 -1.214 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.196 1.136 -2.621 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.954 -0.475 -1.975 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -1.931 3.115 -0.890 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.629 -0.937 0.227 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.779 3.864 1.289 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.482 -0.191 2.405 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.923 1.522 3.731 1.00 0.00 H new ATOM 932 N VAL A 63 0.697 -1.049 -3.374 1.00 0.00 N ATOM 933 CA VAL A 63 1.147 -1.678 -4.610 1.00 0.00 C ATOM 934 C VAL A 63 0.638 -3.111 -4.714 1.00 0.00 C ATOM 935 O VAL A 63 0.863 -3.927 -3.820 1.00 0.00 O ATOM 936 CB VAL A 63 2.684 -1.682 -4.710 1.00 0.00 C ATOM 937 CG1 VAL A 63 3.137 -2.449 -5.943 1.00 0.00 C ATOM 938 CG2 VAL A 63 3.220 -0.258 -4.731 1.00 0.00 C ATOM 0 H VAL A 63 0.748 -1.650 -2.552 1.00 0.00 H new ATOM 0 HA VAL A 63 0.738 -1.090 -5.432 1.00 0.00 H new ATOM 0 HB VAL A 63 3.087 -2.185 -3.831 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.226 -2.441 -5.997 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.784 -3.478 -5.881 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.726 -1.978 -6.836 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.307 -0.280 -4.802 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.811 0.272 -5.591 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.926 0.255 -3.815 1.00 0.00 H new ATOM 948 N ILE A 64 -0.049 -3.411 -5.811 1.00 0.00 N ATOM 949 CA ILE A 64 -0.588 -4.747 -6.033 1.00 0.00 C ATOM 950 C ILE A 64 0.527 -5.755 -6.287 1.00 0.00 C ATOM 951 O ILE A 64 1.134 -5.769 -7.359 1.00 0.00 O ATOM 952 CB ILE A 64 -1.566 -4.769 -7.223 1.00 0.00 C ATOM 953 CG1 ILE A 64 -2.638 -3.691 -7.050 1.00 0.00 C ATOM 954 CG2 ILE A 64 -2.205 -6.143 -7.358 1.00 0.00 C ATOM 955 CD1 ILE A 64 -3.224 -3.206 -8.358 1.00 0.00 C ATOM 0 H ILE A 64 -0.246 -2.747 -6.560 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.125 -5.025 -5.126 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.009 -4.558 -8.136 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -3.440 -4.085 -6.426 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.207 -2.843 -6.518 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.893 -6.143 -8.203 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.429 -6.891 -7.522 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.751 -6.382 -6.445 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -3.977 -2.443 -8.159 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.433 -2.782 -8.976 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.685 -4.043 -8.883 1.00 0.00 H new ATOM 967 N LEU A 65 0.791 -6.599 -5.296 1.00 0.00 N ATOM 968 CA LEU A 65 1.832 -7.614 -5.412 1.00 0.00 C ATOM 969 C LEU A 65 1.295 -8.872 -6.087 1.00 0.00 C ATOM 970 O LEU A 65 1.989 -9.509 -6.878 1.00 0.00 O ATOM 971 CB LEU A 65 2.389 -7.962 -4.031 1.00 0.00 C ATOM 972 CG LEU A 65 3.110 -6.832 -3.294 1.00 0.00 C ATOM 973 CD1 LEU A 65 3.507 -7.276 -1.894 1.00 0.00 C ATOM 974 CD2 LEU A 65 4.333 -6.378 -4.079 1.00 0.00 C ATOM 0 H LEU A 65 0.298 -6.601 -4.403 1.00 0.00 H new ATOM 0 HA LEU A 65 2.633 -7.207 -6.029 1.00 0.00 H new ATOM 0 HB2 LEU A 65 1.566 -8.309 -3.406 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.081 -8.797 -4.140 1.00 0.00 H new ATOM 0 HG LEU A 65 2.426 -5.988 -3.205 1.00 0.00 H new ATOM 0 HD11 LEU A 65 4.019 -6.459 -1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.614 -7.551 -1.333 1.00 0.00 H new ATOM 0 HD13 LEU A 65 4.173 -8.136 -1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.833 -5.574 -3.540 1.00 0.00 H new ATOM 0 HD22 LEU A 65 5.019 -7.216 -4.200 1.00 0.00 H new ATOM 0 HD23 LEU A 65 4.023 -6.019 -5.060 1.00 0.00 H new ATOM 986 N ASN A 66 0.052 -9.221 -5.771 1.00 0.00 N ATOM 987 CA ASN A 66 -0.580 -10.402 -6.349 1.00 0.00 C ATOM 988 C ASN A 66 -2.099 -10.257 -6.358 1.00 0.00 C ATOM 989 O ASN A 66 -2.676 -9.606 -5.488 1.00 0.00 O ATOM 990 CB ASN A 66 -0.181 -11.654 -5.566 1.00 0.00 C ATOM 991 CG ASN A 66 -0.670 -12.929 -6.226 1.00 0.00 C ATOM 992 OD1 ASN A 66 -0.004 -13.482 -7.102 1.00 0.00 O ATOM 993 ND2 ASN A 66 -1.838 -13.402 -5.807 1.00 0.00 N ATOM 0 H ASN A 66 -0.537 -8.704 -5.119 1.00 0.00 H new ATOM 0 HA ASN A 66 -0.236 -10.500 -7.379 1.00 0.00 H new ATOM 0 HB2 ASN A 66 0.904 -11.690 -5.472 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -0.586 -11.592 -4.556 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -2.218 -14.257 -6.214 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -2.356 -12.910 -5.078 1.00 0.00 H new ATOM 1000 N GLY A 67 -2.740 -10.869 -7.349 1.00 0.00 N ATOM 1001 CA GLY A 67 -4.186 -10.797 -7.453 1.00 0.00 C ATOM 1002 C GLY A 67 -4.653 -9.551 -8.180 1.00 0.00 C ATOM 1003 O GLY A 67 -3.847 -8.692 -8.537 1.00 0.00 O ATOM 0 H GLY A 67 -2.284 -11.413 -8.081 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.554 -11.679 -7.977 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.621 -10.815 -6.454 1.00 0.00 H new ATOM 1007 N THR A 68 -5.960 -9.452 -8.401 1.00 0.00 N ATOM 1008 CA THR A 68 -6.533 -8.304 -9.093 1.00 0.00 C ATOM 1009 C THR A 68 -7.402 -7.474 -8.154 1.00 0.00 C ATOM 1010 O THR A 68 -8.072 -8.013 -7.273 1.00 0.00 O ATOM 1011 CB THR A 68 -7.379 -8.743 -10.303 1.00 0.00 C ATOM 1012 OG1 THR A 68 -6.535 -9.307 -11.313 1.00 0.00 O ATOM 1013 CG2 THR A 68 -8.150 -7.565 -10.880 1.00 0.00 C ATOM 0 H THR A 68 -6.642 -10.153 -8.111 1.00 0.00 H new ATOM 0 HA THR A 68 -5.698 -7.697 -9.443 1.00 0.00 H new ATOM 0 HB THR A 68 -8.093 -9.494 -9.965 1.00 0.00 H new ATOM 0 HG1 THR A 68 -7.081 -9.585 -12.078 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.740 -7.899 -11.733 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.813 -7.156 -10.118 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.450 -6.795 -11.203 1.00 0.00 H new ATOM 1021 N VAL A 69 -7.386 -6.159 -8.349 1.00 0.00 N ATOM 1022 CA VAL A 69 -8.174 -5.254 -7.521 1.00 0.00 C ATOM 1023 C VAL A 69 -9.051 -4.348 -8.378 1.00 0.00 C ATOM 1024 O VAL A 69 -8.585 -3.762 -9.354 1.00 0.00 O ATOM 1025 CB VAL A 69 -7.272 -4.383 -6.627 1.00 0.00 C ATOM 1026 CG1 VAL A 69 -6.573 -5.236 -5.580 1.00 0.00 C ATOM 1027 CG2 VAL A 69 -6.259 -3.625 -7.472 1.00 0.00 C ATOM 0 H VAL A 69 -6.836 -5.697 -9.073 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.808 -5.875 -6.888 1.00 0.00 H new ATOM 0 HB VAL A 69 -7.897 -3.656 -6.109 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -5.940 -4.603 -4.958 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -7.318 -5.729 -4.956 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -5.959 -5.988 -6.075 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.630 -3.014 -6.825 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.637 -4.334 -8.018 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.783 -2.982 -8.179 1.00 0.00 H new ATOM 1037 N GLU A 70 -10.322 -4.237 -8.004 1.00 0.00 N ATOM 1038 CA GLU A 70 -11.263 -3.402 -8.739 1.00 0.00 C ATOM 1039 C GLU A 70 -11.564 -2.117 -7.973 1.00 0.00 C ATOM 1040 O GLU A 70 -11.769 -2.139 -6.759 1.00 0.00 O ATOM 1041 CB GLU A 70 -12.562 -4.167 -9.001 1.00 0.00 C ATOM 1042 CG GLU A 70 -13.497 -3.465 -9.971 1.00 0.00 C ATOM 1043 CD GLU A 70 -14.545 -4.397 -10.549 1.00 0.00 C ATOM 1044 OE1 GLU A 70 -15.170 -5.144 -9.768 1.00 0.00 O ATOM 1045 OE2 GLU A 70 -14.740 -4.379 -11.783 1.00 0.00 O ATOM 0 H GLU A 70 -10.723 -4.715 -7.197 1.00 0.00 H new ATOM 0 HA GLU A 70 -10.806 -3.138 -9.693 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.319 -5.154 -9.394 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.081 -4.319 -8.055 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.992 -2.640 -9.459 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.913 -3.032 -10.783 1.00 0.00 H new ATOM 1052 N ILE A 71 -11.587 -0.999 -8.691 1.00 0.00 N ATOM 1053 CA ILE A 71 -11.862 0.296 -8.080 1.00 0.00 C ATOM 1054 C ILE A 71 -13.192 0.861 -8.566 1.00 0.00 C ATOM 1055 O ILE A 71 -13.529 0.757 -9.745 1.00 0.00 O ATOM 1056 CB ILE A 71 -10.744 1.311 -8.383 1.00 0.00 C ATOM 1057 CG1 ILE A 71 -9.386 0.748 -7.959 1.00 0.00 C ATOM 1058 CG2 ILE A 71 -11.021 2.630 -7.677 1.00 0.00 C ATOM 1059 CD1 ILE A 71 -8.213 1.577 -8.434 1.00 0.00 C ATOM 0 H ILE A 71 -11.419 -0.964 -9.696 1.00 0.00 H new ATOM 0 HA ILE A 71 -11.911 0.133 -7.003 1.00 0.00 H new ATOM 0 HB ILE A 71 -10.721 1.494 -9.457 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -9.354 0.678 -6.872 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -9.285 -0.266 -8.347 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -10.222 3.337 -7.901 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -11.972 3.035 -8.023 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -11.068 2.464 -6.601 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -7.283 1.119 -8.097 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -8.219 1.626 -9.523 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -8.290 2.584 -8.025 1.00 0.00 H new ATOM 1071 N SER A 72 -13.944 1.462 -7.649 1.00 0.00 N ATOM 1072 CA SER A 72 -15.239 2.043 -7.983 1.00 0.00 C ATOM 1073 C SER A 72 -15.262 3.536 -7.668 1.00 0.00 C ATOM 1074 O SER A 72 -14.718 3.977 -6.655 1.00 0.00 O ATOM 1075 CB SER A 72 -16.354 1.332 -7.215 1.00 0.00 C ATOM 1076 OG SER A 72 -17.608 1.949 -7.449 1.00 0.00 O ATOM 0 H SER A 72 -13.678 1.559 -6.669 1.00 0.00 H new ATOM 0 HA SER A 72 -15.403 1.912 -9.053 1.00 0.00 H new ATOM 0 HB2 SER A 72 -16.398 0.286 -7.517 1.00 0.00 H new ATOM 0 HB3 SER A 72 -16.131 1.347 -6.148 1.00 0.00 H new ATOM 0 HG SER A 72 -18.304 1.475 -6.948 1.00 0.00 H new ATOM 1082 N HIS A 73 -15.895 4.309 -8.545 1.00 0.00 N ATOM 1083 CA HIS A 73 -15.990 5.753 -8.361 1.00 0.00 C ATOM 1084 C HIS A 73 -17.434 6.175 -8.109 1.00 0.00 C ATOM 1085 O HIS A 73 -18.382 5.527 -8.553 1.00 0.00 O ATOM 1086 CB HIS A 73 -15.441 6.482 -9.589 1.00 0.00 C ATOM 1087 CG HIS A 73 -13.969 6.291 -9.790 1.00 0.00 C ATOM 1088 ND1 HIS A 73 -13.016 6.998 -9.089 1.00 0.00 N ATOM 1089 CD2 HIS A 73 -13.289 5.465 -10.619 1.00 0.00 C ATOM 1090 CE1 HIS A 73 -11.813 6.616 -9.479 1.00 0.00 C ATOM 1091 NE2 HIS A 73 -11.951 5.687 -10.407 1.00 0.00 N ATOM 0 H HIS A 73 -16.349 3.960 -9.389 1.00 0.00 H new ATOM 0 HA HIS A 73 -15.393 6.023 -7.490 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -15.969 6.131 -10.476 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -15.651 7.547 -9.493 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -13.209 7.705 -8.380 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -13.719 4.762 -11.317 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -10.876 6.999 -9.103 1.00 0.00 H new ATOM 1100 N PRO A 74 -17.608 7.286 -7.377 1.00 0.00 N ATOM 1101 CA PRO A 74 -18.933 7.818 -7.049 1.00 0.00 C ATOM 1102 C PRO A 74 -19.646 8.392 -8.268 1.00 0.00 C ATOM 1103 O PRO A 74 -20.874 8.467 -8.303 1.00 0.00 O ATOM 1104 CB PRO A 74 -18.630 8.926 -6.036 1.00 0.00 C ATOM 1105 CG PRO A 74 -17.233 9.346 -6.341 1.00 0.00 C ATOM 1106 CD PRO A 74 -16.523 8.108 -6.815 1.00 0.00 C ATOM 0 HA PRO A 74 -19.600 7.044 -6.669 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -19.326 9.759 -6.140 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -18.720 8.562 -5.012 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -17.217 10.122 -7.106 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -16.748 9.760 -5.457 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.766 8.341 -7.564 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -16.015 7.598 -5.997 1.00 0.00 H new ATOM 1114 N ASP A 75 -18.868 8.796 -9.267 1.00 0.00 N ATOM 1115 CA ASP A 75 -19.426 9.362 -10.490 1.00 0.00 C ATOM 1116 C ASP A 75 -20.064 8.275 -11.349 1.00 0.00 C ATOM 1117 O ASP A 75 -21.098 8.495 -11.979 1.00 0.00 O ATOM 1118 CB ASP A 75 -18.337 10.085 -11.285 1.00 0.00 C ATOM 1119 CG ASP A 75 -17.300 9.132 -11.845 1.00 0.00 C ATOM 1120 OD1 ASP A 75 -17.660 8.304 -12.707 1.00 0.00 O ATOM 1121 OD2 ASP A 75 -16.128 9.213 -11.420 1.00 0.00 O ATOM 0 H ASP A 75 -17.850 8.742 -9.254 1.00 0.00 H new ATOM 0 HA ASP A 75 -20.198 10.079 -10.211 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -18.796 10.639 -12.103 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -17.846 10.815 -10.642 1.00 0.00 H new ATOM 1126 N GLY A 76 -19.440 7.101 -11.371 1.00 0.00 N ATOM 1127 CA GLY A 76 -19.961 5.999 -12.158 1.00 0.00 C ATOM 1128 C GLY A 76 -18.890 5.327 -12.994 1.00 0.00 C ATOM 1129 O GLY A 76 -19.180 4.758 -14.047 1.00 0.00 O ATOM 0 H GLY A 76 -18.583 6.894 -10.858 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -20.413 5.263 -11.493 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -20.752 6.366 -12.812 1.00 0.00 H new ATOM 1133 N LYS A 77 -17.648 5.393 -12.527 1.00 0.00 N ATOM 1134 CA LYS A 77 -16.529 4.787 -13.238 1.00 0.00 C ATOM 1135 C LYS A 77 -15.880 3.691 -12.399 1.00 0.00 C ATOM 1136 O LYS A 77 -15.799 3.799 -11.175 1.00 0.00 O ATOM 1137 CB LYS A 77 -15.490 5.851 -13.599 1.00 0.00 C ATOM 1138 CG LYS A 77 -14.487 5.393 -14.643 1.00 0.00 C ATOM 1139 CD LYS A 77 -13.335 6.375 -14.778 1.00 0.00 C ATOM 1140 CE LYS A 77 -12.490 6.076 -16.007 1.00 0.00 C ATOM 1141 NZ LYS A 77 -11.881 4.719 -15.945 1.00 0.00 N ATOM 0 H LYS A 77 -17.391 5.861 -11.658 1.00 0.00 H new ATOM 0 HA LYS A 77 -16.914 4.339 -14.154 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -16.004 6.739 -13.967 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -14.954 6.144 -12.696 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -14.099 4.411 -14.371 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -14.987 5.283 -15.605 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -13.726 7.390 -14.842 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -12.710 6.330 -13.886 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -13.108 6.156 -16.901 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -11.702 6.824 -16.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -10.863 4.786 -16.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -12.022 4.318 -14.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -12.333 4.103 -16.651 1.00 0.00 H new ATOM 1155 N VAL A 78 -15.417 2.638 -13.064 1.00 0.00 N ATOM 1156 CA VAL A 78 -14.772 1.524 -12.379 1.00 0.00 C ATOM 1157 C VAL A 78 -13.473 1.130 -13.072 1.00 0.00 C ATOM 1158 O VAL A 78 -13.486 0.605 -14.185 1.00 0.00 O ATOM 1159 CB VAL A 78 -15.698 0.294 -12.312 1.00 0.00 C ATOM 1160 CG1 VAL A 78 -15.057 -0.813 -11.489 1.00 0.00 C ATOM 1161 CG2 VAL A 78 -17.053 0.679 -11.739 1.00 0.00 C ATOM 0 H VAL A 78 -15.476 2.533 -14.077 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.552 1.861 -11.366 1.00 0.00 H new ATOM 0 HB VAL A 78 -15.850 -0.081 -13.324 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -15.725 -1.673 -11.453 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -14.112 -1.106 -11.947 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -14.873 -0.454 -10.476 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -17.694 -0.201 -11.699 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -16.922 1.079 -10.734 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -17.515 1.436 -12.373 1.00 0.00 H new ATOM 1171 N GLU A 79 -12.351 1.388 -12.406 1.00 0.00 N ATOM 1172 CA GLU A 79 -11.042 1.061 -12.960 1.00 0.00 C ATOM 1173 C GLU A 79 -10.701 -0.407 -12.718 1.00 0.00 C ATOM 1174 O GLU A 79 -11.258 -1.046 -11.827 1.00 0.00 O ATOM 1175 CB GLU A 79 -9.965 1.955 -12.342 1.00 0.00 C ATOM 1176 CG GLU A 79 -9.743 3.253 -13.099 1.00 0.00 C ATOM 1177 CD GLU A 79 -8.857 3.075 -14.316 1.00 0.00 C ATOM 1178 OE1 GLU A 79 -9.355 2.568 -15.343 1.00 0.00 O ATOM 1179 OE2 GLU A 79 -7.665 3.441 -14.241 1.00 0.00 O ATOM 0 H GLU A 79 -12.322 1.822 -11.483 1.00 0.00 H new ATOM 0 HA GLU A 79 -11.076 1.236 -14.035 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.243 2.187 -11.314 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -9.026 1.403 -12.301 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -10.706 3.656 -13.412 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -9.292 3.986 -12.430 1.00 0.00 H new ATOM 1186 N ASN A 80 -9.782 -0.934 -13.520 1.00 0.00 N ATOM 1187 CA ASN A 80 -9.367 -2.327 -13.395 1.00 0.00 C ATOM 1188 C ASN A 80 -7.846 -2.445 -13.422 1.00 0.00 C ATOM 1189 O ASN A 80 -7.217 -2.271 -14.467 1.00 0.00 O ATOM 1190 CB ASN A 80 -9.975 -3.165 -14.521 1.00 0.00 C ATOM 1191 CG ASN A 80 -10.162 -2.369 -15.798 1.00 0.00 C ATOM 1192 OD1 ASN A 80 -9.208 -2.126 -16.538 1.00 0.00 O ATOM 1193 ND2 ASN A 80 -11.397 -1.958 -16.063 1.00 0.00 N ATOM 0 H ASN A 80 -9.310 -0.418 -14.263 1.00 0.00 H new ATOM 0 HA ASN A 80 -9.726 -2.703 -12.437 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -9.331 -4.021 -14.721 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -10.938 -3.559 -14.197 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -11.585 -1.418 -16.908 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -12.158 -2.182 -15.422 1.00 0.00 H new ATOM 1200 N LEU A 81 -7.261 -2.743 -12.268 1.00 0.00 N ATOM 1201 CA LEU A 81 -5.813 -2.886 -12.158 1.00 0.00 C ATOM 1202 C LEU A 81 -5.420 -4.353 -12.015 1.00 0.00 C ATOM 1203 O LEU A 81 -6.202 -5.172 -11.532 1.00 0.00 O ATOM 1204 CB LEU A 81 -5.291 -2.088 -10.962 1.00 0.00 C ATOM 1205 CG LEU A 81 -5.709 -0.618 -10.903 1.00 0.00 C ATOM 1206 CD1 LEU A 81 -5.542 -0.072 -9.493 1.00 0.00 C ATOM 1207 CD2 LEU A 81 -4.901 0.206 -11.895 1.00 0.00 C ATOM 0 H LEU A 81 -7.767 -2.890 -11.395 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.364 -2.496 -13.071 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.628 -2.578 -10.049 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -4.202 -2.136 -10.966 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.762 -0.548 -11.175 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.844 0.975 -9.470 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.164 -0.644 -8.805 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.498 -0.155 -9.192 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.212 1.249 -11.839 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.841 0.130 -11.653 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.071 -0.170 -12.904 1.00 0.00 H new ATOM 1219 N PHE A 82 -4.202 -4.678 -12.436 1.00 0.00 N ATOM 1220 CA PHE A 82 -3.705 -6.046 -12.354 1.00 0.00 C ATOM 1221 C PHE A 82 -2.300 -6.079 -11.759 1.00 0.00 C ATOM 1222 O PHE A 82 -1.617 -5.057 -11.696 1.00 0.00 O ATOM 1223 CB PHE A 82 -3.698 -6.693 -13.740 1.00 0.00 C ATOM 1224 CG PHE A 82 -5.016 -6.595 -14.454 1.00 0.00 C ATOM 1225 CD1 PHE A 82 -6.156 -7.168 -13.913 1.00 0.00 C ATOM 1226 CD2 PHE A 82 -5.116 -5.929 -15.665 1.00 0.00 C ATOM 1227 CE1 PHE A 82 -7.370 -7.079 -14.568 1.00 0.00 C ATOM 1228 CE2 PHE A 82 -6.327 -5.837 -16.324 1.00 0.00 C ATOM 1229 CZ PHE A 82 -7.456 -6.412 -15.774 1.00 0.00 C ATOM 0 H PHE A 82 -3.541 -4.013 -12.837 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.372 -6.609 -11.701 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.928 -6.220 -14.349 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -3.425 -7.744 -13.640 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.095 -7.690 -12.969 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -4.237 -5.476 -16.099 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -8.251 -7.531 -14.137 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.391 -5.316 -17.268 1.00 0.00 H new ATOM 0 HZ PHE A 82 -8.404 -6.340 -16.286 1.00 0.00 H new ATOM 1239 N MET A 83 -1.876 -7.261 -11.322 1.00 0.00 N ATOM 1240 CA MET A 83 -0.553 -7.427 -10.732 1.00 0.00 C ATOM 1241 C MET A 83 0.465 -6.521 -11.416 1.00 0.00 C ATOM 1242 O MET A 83 0.686 -6.618 -12.622 1.00 0.00 O ATOM 1243 CB MET A 83 -0.105 -8.887 -10.836 1.00 0.00 C ATOM 1244 CG MET A 83 1.345 -9.107 -10.438 1.00 0.00 C ATOM 1245 SD MET A 83 1.905 -10.790 -10.758 1.00 0.00 S ATOM 1246 CE MET A 83 3.399 -10.844 -9.771 1.00 0.00 C ATOM 0 H MET A 83 -2.429 -8.117 -11.365 1.00 0.00 H new ATOM 0 HA MET A 83 -0.613 -7.146 -9.680 1.00 0.00 H new ATOM 0 HB2 MET A 83 -0.745 -9.501 -10.202 1.00 0.00 H new ATOM 0 HB3 MET A 83 -0.248 -9.230 -11.861 1.00 0.00 H new ATOM 0 HG2 MET A 83 1.978 -8.408 -10.984 1.00 0.00 H new ATOM 0 HG3 MET A 83 1.465 -8.884 -9.378 1.00 0.00 H new ATOM 0 HE1 MET A 83 3.881 -11.814 -9.894 1.00 0.00 H new ATOM 0 HE2 MET A 83 4.079 -10.057 -10.097 1.00 0.00 H new ATOM 0 HE3 MET A 83 3.147 -10.694 -8.721 1.00 0.00 H new ATOM 1256 N GLY A 84 1.082 -5.638 -10.636 1.00 0.00 N ATOM 1257 CA GLY A 84 2.069 -4.726 -11.185 1.00 0.00 C ATOM 1258 C GLY A 84 1.668 -3.273 -11.026 1.00 0.00 C ATOM 1259 O GLY A 84 2.514 -2.412 -10.787 1.00 0.00 O ATOM 0 H GLY A 84 0.916 -5.538 -9.635 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.026 -4.892 -10.691 1.00 0.00 H new ATOM 0 HA3 GLY A 84 2.214 -4.946 -12.243 1.00 0.00 H new ATOM 1263 N ASN A 85 0.375 -3.000 -11.160 1.00 0.00 N ATOM 1264 CA ASN A 85 -0.136 -1.640 -11.031 1.00 0.00 C ATOM 1265 C ASN A 85 0.113 -1.095 -9.628 1.00 0.00 C ATOM 1266 O ASN A 85 0.421 -1.849 -8.704 1.00 0.00 O ATOM 1267 CB ASN A 85 -1.633 -1.603 -11.346 1.00 0.00 C ATOM 1268 CG ASN A 85 -1.908 -1.387 -12.822 1.00 0.00 C ATOM 1269 OD1 ASN A 85 -2.372 -2.290 -13.517 1.00 0.00 O ATOM 1270 ND2 ASN A 85 -1.622 -0.184 -13.307 1.00 0.00 N ATOM 0 H ASN A 85 -0.338 -3.702 -11.358 1.00 0.00 H new ATOM 0 HA ASN A 85 0.395 -1.011 -11.745 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.092 -2.539 -11.027 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -2.103 -0.805 -10.771 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.786 0.021 -14.293 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -1.238 0.535 -12.694 1.00 0.00 H new ATOM 1277 N SER A 86 -0.024 0.218 -9.475 1.00 0.00 N ATOM 1278 CA SER A 86 0.188 0.864 -8.185 1.00 0.00 C ATOM 1279 C SER A 86 -0.950 1.829 -7.866 1.00 0.00 C ATOM 1280 O SER A 86 -1.601 2.358 -8.767 1.00 0.00 O ATOM 1281 CB SER A 86 1.523 1.613 -8.180 1.00 0.00 C ATOM 1282 OG SER A 86 1.680 2.383 -9.359 1.00 0.00 O ATOM 0 H SER A 86 -0.281 0.856 -10.229 1.00 0.00 H new ATOM 0 HA SER A 86 0.210 0.090 -7.418 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.575 2.264 -7.307 1.00 0.00 H new ATOM 0 HB3 SER A 86 2.343 0.900 -8.096 1.00 0.00 H new ATOM 0 HG SER A 86 2.539 2.853 -9.331 1.00 0.00 H new ATOM 1288 N PHE A 87 -1.184 2.052 -6.578 1.00 0.00 N ATOM 1289 CA PHE A 87 -2.244 2.952 -6.138 1.00 0.00 C ATOM 1290 C PHE A 87 -2.027 3.382 -4.690 1.00 0.00 C ATOM 1291 O PHE A 87 -1.344 2.702 -3.925 1.00 0.00 O ATOM 1292 CB PHE A 87 -3.609 2.275 -6.281 1.00 0.00 C ATOM 1293 CG PHE A 87 -3.824 1.149 -5.311 1.00 0.00 C ATOM 1294 CD1 PHE A 87 -4.217 1.406 -4.008 1.00 0.00 C ATOM 1295 CD2 PHE A 87 -3.635 -0.167 -5.703 1.00 0.00 C ATOM 1296 CE1 PHE A 87 -4.415 0.371 -3.113 1.00 0.00 C ATOM 1297 CE2 PHE A 87 -3.832 -1.205 -4.813 1.00 0.00 C ATOM 1298 CZ PHE A 87 -4.224 -0.936 -3.516 1.00 0.00 C ATOM 0 H PHE A 87 -0.654 1.622 -5.820 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.218 3.840 -6.770 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.392 3.020 -6.140 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.712 1.893 -7.297 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -4.370 2.426 -3.688 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.330 -0.383 -6.716 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.719 0.585 -2.099 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.680 -2.226 -5.131 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.381 -1.746 -2.819 1.00 0.00 H new ATOM 1308 N GLY A 88 -2.613 4.516 -4.321 1.00 0.00 N ATOM 1309 CA GLY A 88 -2.472 5.018 -2.967 1.00 0.00 C ATOM 1310 C GLY A 88 -2.101 6.488 -2.929 1.00 0.00 C ATOM 1311 O GLY A 88 -2.971 7.356 -2.998 1.00 0.00 O ATOM 0 H GLY A 88 -3.183 5.097 -4.936 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.408 4.869 -2.428 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -1.708 4.440 -2.446 1.00 0.00 H new ATOM 1315 N ILE A 89 -0.806 6.766 -2.818 1.00 0.00 N ATOM 1316 CA ILE A 89 -0.322 8.140 -2.771 1.00 0.00 C ATOM 1317 C ILE A 89 0.878 8.333 -3.691 1.00 0.00 C ATOM 1318 O ILE A 89 1.456 7.365 -4.188 1.00 0.00 O ATOM 1319 CB ILE A 89 0.072 8.549 -1.339 1.00 0.00 C ATOM 1320 CG1 ILE A 89 1.238 7.692 -0.843 1.00 0.00 C ATOM 1321 CG2 ILE A 89 -1.122 8.422 -0.404 1.00 0.00 C ATOM 1322 CD1 ILE A 89 2.093 8.379 0.198 1.00 0.00 C ATOM 0 H ILE A 89 -0.074 6.058 -2.759 1.00 0.00 H new ATOM 0 HA ILE A 89 -1.141 8.774 -3.110 1.00 0.00 H new ATOM 0 HB ILE A 89 0.391 9.591 -1.349 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.845 6.765 -0.425 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.864 7.418 -1.692 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.828 8.714 0.604 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.926 9.072 -0.750 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.469 7.389 -0.395 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.900 7.713 0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 89 2.516 9.291 -0.223 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.481 8.629 1.065 1.00 0.00 H new ATOM 1334 N THR A 90 1.251 9.589 -3.914 1.00 0.00 N ATOM 1335 CA THR A 90 2.383 9.910 -4.774 1.00 0.00 C ATOM 1336 C THR A 90 3.661 10.077 -3.961 1.00 0.00 C ATOM 1337 O THR A 90 3.630 10.317 -2.753 1.00 0.00 O ATOM 1338 CB THR A 90 2.129 11.197 -5.581 1.00 0.00 C ATOM 1339 OG1 THR A 90 1.315 12.098 -4.822 1.00 0.00 O ATOM 1340 CG2 THR A 90 1.447 10.880 -6.903 1.00 0.00 C ATOM 0 H THR A 90 0.785 10.402 -3.510 1.00 0.00 H new ATOM 0 HA THR A 90 2.502 9.075 -5.465 1.00 0.00 H new ATOM 0 HB THR A 90 3.091 11.665 -5.790 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.159 12.914 -5.341 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.278 11.804 -7.456 1.00 0.00 H new ATOM 0 HG22 THR A 90 2.082 10.217 -7.490 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.492 10.391 -6.712 1.00 0.00 H new ATOM 1348 N PRO A 91 4.814 9.950 -4.635 1.00 0.00 N ATOM 1349 CA PRO A 91 6.125 10.085 -3.993 1.00 0.00 C ATOM 1350 C PRO A 91 6.418 11.520 -3.570 1.00 0.00 C ATOM 1351 O PRO A 91 7.499 11.821 -3.062 1.00 0.00 O ATOM 1352 CB PRO A 91 7.101 9.639 -5.085 1.00 0.00 C ATOM 1353 CG PRO A 91 6.382 9.898 -6.364 1.00 0.00 C ATOM 1354 CD PRO A 91 4.925 9.664 -6.075 1.00 0.00 C ATOM 0 HA PRO A 91 6.193 9.500 -3.076 1.00 0.00 H new ATOM 0 HB2 PRO A 91 8.034 10.200 -5.035 1.00 0.00 H new ATOM 0 HB3 PRO A 91 7.357 8.585 -4.981 1.00 0.00 H new ATOM 0 HG2 PRO A 91 6.553 10.918 -6.708 1.00 0.00 H new ATOM 0 HG3 PRO A 91 6.735 9.233 -7.152 1.00 0.00 H new ATOM 0 HD2 PRO A 91 4.287 10.322 -6.666 1.00 0.00 H new ATOM 0 HD3 PRO A 91 4.629 8.641 -6.306 1.00 0.00 H new ATOM 1362 N THR A 92 5.448 12.404 -3.781 1.00 0.00 N ATOM 1363 CA THR A 92 5.602 13.808 -3.422 1.00 0.00 C ATOM 1364 C THR A 92 4.911 14.116 -2.099 1.00 0.00 C ATOM 1365 O THR A 92 3.788 13.673 -1.855 1.00 0.00 O ATOM 1366 CB THR A 92 5.032 14.734 -4.513 1.00 0.00 C ATOM 1367 OG1 THR A 92 3.617 14.546 -4.624 1.00 0.00 O ATOM 1368 CG2 THR A 92 5.692 14.457 -5.856 1.00 0.00 C ATOM 0 H THR A 92 4.547 12.172 -4.199 1.00 0.00 H new ATOM 0 HA THR A 92 6.672 13.992 -3.322 1.00 0.00 H new ATOM 0 HB THR A 92 5.240 15.766 -4.229 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.262 15.139 -5.318 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.274 15.123 -6.611 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.766 14.628 -5.776 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.510 13.422 -6.144 1.00 0.00 H new ATOM 1376 N LEU A 93 5.587 14.879 -1.247 1.00 0.00 N ATOM 1377 CA LEU A 93 5.037 15.248 0.053 1.00 0.00 C ATOM 1378 C LEU A 93 3.553 15.584 -0.059 1.00 0.00 C ATOM 1379 O LEU A 93 2.781 15.347 0.870 1.00 0.00 O ATOM 1380 CB LEU A 93 5.800 16.441 0.632 1.00 0.00 C ATOM 1381 CG LEU A 93 7.254 16.180 1.027 1.00 0.00 C ATOM 1382 CD1 LEU A 93 7.925 17.469 1.474 1.00 0.00 C ATOM 1383 CD2 LEU A 93 7.329 15.129 2.125 1.00 0.00 C ATOM 0 H LEU A 93 6.517 15.254 -1.433 1.00 0.00 H new ATOM 0 HA LEU A 93 5.148 14.395 0.722 1.00 0.00 H new ATOM 0 HB2 LEU A 93 5.783 17.248 -0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.264 16.797 1.512 1.00 0.00 H new ATOM 0 HG LEU A 93 7.785 15.802 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 93 8.959 17.264 1.751 1.00 0.00 H new ATOM 0 HD12 LEU A 93 7.905 18.192 0.658 1.00 0.00 H new ATOM 0 HD13 LEU A 93 7.393 17.877 2.333 1.00 0.00 H new ATOM 0 HD21 LEU A 93 8.371 14.957 2.393 1.00 0.00 H new ATOM 0 HD22 LEU A 93 6.782 15.478 3.001 1.00 0.00 H new ATOM 0 HD23 LEU A 93 6.887 14.198 1.769 1.00 0.00 H new ATOM 1395 N ASP A 94 3.162 16.135 -1.202 1.00 0.00 N ATOM 1396 CA ASP A 94 1.770 16.501 -1.438 1.00 0.00 C ATOM 1397 C ASP A 94 0.841 15.332 -1.129 1.00 0.00 C ATOM 1398 O ASP A 94 1.002 14.237 -1.670 1.00 0.00 O ATOM 1399 CB ASP A 94 1.578 16.954 -2.886 1.00 0.00 C ATOM 1400 CG ASP A 94 2.178 18.320 -3.151 1.00 0.00 C ATOM 1401 OD1 ASP A 94 1.757 19.292 -2.489 1.00 0.00 O ATOM 1402 OD2 ASP A 94 3.071 18.417 -4.019 1.00 0.00 O ATOM 0 H ASP A 94 3.789 16.338 -1.980 1.00 0.00 H new ATOM 0 HA ASP A 94 1.519 17.326 -0.772 1.00 0.00 H new ATOM 0 HB2 ASP A 94 2.034 16.224 -3.555 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.513 16.977 -3.118 1.00 0.00 H new ATOM 1407 N LYS A 95 -0.131 15.570 -0.256 1.00 0.00 N ATOM 1408 CA LYS A 95 -1.087 14.537 0.126 1.00 0.00 C ATOM 1409 C LYS A 95 -2.225 14.448 -0.886 1.00 0.00 C ATOM 1410 O LYS A 95 -2.324 15.272 -1.795 1.00 0.00 O ATOM 1411 CB LYS A 95 -1.651 14.825 1.519 1.00 0.00 C ATOM 1412 CG LYS A 95 -0.697 14.470 2.647 1.00 0.00 C ATOM 1413 CD LYS A 95 0.204 15.640 3.003 1.00 0.00 C ATOM 1414 CE LYS A 95 -0.487 16.608 3.951 1.00 0.00 C ATOM 1415 NZ LYS A 95 0.016 17.999 3.787 1.00 0.00 N ATOM 0 H LYS A 95 -0.278 16.470 0.201 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.563 13.581 0.143 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -1.904 15.883 1.588 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.578 14.267 1.649 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -1.267 14.168 3.526 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -0.087 13.616 2.354 1.00 0.00 H new ATOM 0 HD2 LYS A 95 1.119 15.269 3.464 1.00 0.00 H new ATOM 0 HD3 LYS A 95 0.496 16.166 2.094 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -1.562 16.587 3.771 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -0.329 16.284 4.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -0.480 18.628 4.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 1.037 18.024 3.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -0.157 18.318 2.813 1.00 0.00 H new ATOM 1429 N GLN A 96 -3.081 13.445 -0.721 1.00 0.00 N ATOM 1430 CA GLN A 96 -4.212 13.250 -1.620 1.00 0.00 C ATOM 1431 C GLN A 96 -5.358 12.538 -0.908 1.00 0.00 C ATOM 1432 O GLN A 96 -5.164 11.925 0.142 1.00 0.00 O ATOM 1433 CB GLN A 96 -3.782 12.447 -2.848 1.00 0.00 C ATOM 1434 CG GLN A 96 -2.645 11.476 -2.573 1.00 0.00 C ATOM 1435 CD GLN A 96 -1.282 12.132 -2.671 1.00 0.00 C ATOM 1436 OE1 GLN A 96 -1.029 12.933 -3.571 1.00 0.00 O ATOM 1437 NE2 GLN A 96 -0.394 11.794 -1.743 1.00 0.00 N ATOM 0 H GLN A 96 -3.013 12.755 0.027 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.562 14.231 -1.940 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -4.640 11.891 -3.227 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -3.477 13.137 -3.634 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -2.769 11.050 -1.577 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -2.698 10.650 -3.282 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -0.646 11.126 -1.015 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.540 12.203 -1.758 1.00 0.00 H new ATOM 1446 N TYR A 97 -6.551 12.624 -1.485 1.00 0.00 N ATOM 1447 CA TYR A 97 -7.729 11.990 -0.904 1.00 0.00 C ATOM 1448 C TYR A 97 -8.344 10.989 -1.877 1.00 0.00 C ATOM 1449 O TYR A 97 -8.508 11.278 -3.062 1.00 0.00 O ATOM 1450 CB TYR A 97 -8.765 13.048 -0.520 1.00 0.00 C ATOM 1451 CG TYR A 97 -8.167 14.274 0.132 1.00 0.00 C ATOM 1452 CD1 TYR A 97 -7.444 14.173 1.314 1.00 0.00 C ATOM 1453 CD2 TYR A 97 -8.323 15.532 -0.436 1.00 0.00 C ATOM 1454 CE1 TYR A 97 -6.896 15.291 1.914 1.00 0.00 C ATOM 1455 CE2 TYR A 97 -7.777 16.655 0.156 1.00 0.00 C ATOM 1456 CZ TYR A 97 -7.065 16.529 1.330 1.00 0.00 C ATOM 1457 OH TYR A 97 -6.520 17.645 1.924 1.00 0.00 O ATOM 0 H TYR A 97 -6.728 13.127 -2.355 1.00 0.00 H new ATOM 0 HA TYR A 97 -7.418 11.453 -0.008 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -9.310 13.352 -1.414 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -9.491 12.603 0.160 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -7.308 13.204 1.772 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -8.880 15.634 -1.355 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -6.339 15.196 2.834 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -7.907 17.626 -0.298 1.00 0.00 H new ATOM 0 HH TYR A 97 -6.729 18.437 1.386 1.00 0.00 H new ATOM 1467 N MET A 98 -8.683 9.810 -1.366 1.00 0.00 N ATOM 1468 CA MET A 98 -9.283 8.765 -2.188 1.00 0.00 C ATOM 1469 C MET A 98 -10.600 9.239 -2.794 1.00 0.00 C ATOM 1470 O MET A 98 -11.472 9.747 -2.089 1.00 0.00 O ATOM 1471 CB MET A 98 -9.516 7.503 -1.356 1.00 0.00 C ATOM 1472 CG MET A 98 -9.593 6.232 -2.187 1.00 0.00 C ATOM 1473 SD MET A 98 -8.119 5.971 -3.193 1.00 0.00 S ATOM 1474 CE MET A 98 -8.705 4.717 -4.331 1.00 0.00 C ATOM 0 H MET A 98 -8.553 9.554 -0.387 1.00 0.00 H new ATOM 0 HA MET A 98 -8.593 8.534 -2.999 1.00 0.00 H new ATOM 0 HB2 MET A 98 -8.710 7.403 -0.629 1.00 0.00 H new ATOM 0 HB3 MET A 98 -10.442 7.615 -0.792 1.00 0.00 H new ATOM 0 HG2 MET A 98 -9.733 5.377 -1.525 1.00 0.00 H new ATOM 0 HG3 MET A 98 -10.468 6.279 -2.836 1.00 0.00 H new ATOM 0 HE1 MET A 98 -7.985 3.900 -4.374 1.00 0.00 H new ATOM 0 HE2 MET A 98 -9.667 4.336 -3.988 1.00 0.00 H new ATOM 0 HE3 MET A 98 -8.820 5.152 -5.324 1.00 0.00 H new ATOM 1484 N HIS A 99 -10.737 9.070 -4.106 1.00 0.00 N ATOM 1485 CA HIS A 99 -11.949 9.481 -4.806 1.00 0.00 C ATOM 1486 C HIS A 99 -12.737 8.266 -5.287 1.00 0.00 C ATOM 1487 O HIS A 99 -13.291 8.268 -6.385 1.00 0.00 O ATOM 1488 CB HIS A 99 -11.597 10.377 -5.994 1.00 0.00 C ATOM 1489 CG HIS A 99 -11.012 11.697 -5.595 1.00 0.00 C ATOM 1490 ND1 HIS A 99 -11.689 12.619 -4.825 1.00 0.00 N ATOM 1491 CD2 HIS A 99 -9.804 12.247 -5.862 1.00 0.00 C ATOM 1492 CE1 HIS A 99 -10.924 13.680 -4.638 1.00 0.00 C ATOM 1493 NE2 HIS A 99 -9.774 13.479 -5.257 1.00 0.00 N ATOM 0 H HIS A 99 -10.025 8.652 -4.705 1.00 0.00 H new ATOM 0 HA HIS A 99 -12.570 10.042 -4.108 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -10.888 9.854 -6.636 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -12.495 10.551 -6.586 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -9.011 11.800 -6.443 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -11.193 14.562 -4.075 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -8.991 14.133 -5.281 1.00 0.00 H new ATOM 1502 N GLY A 100 -12.780 7.228 -4.457 1.00 0.00 N ATOM 1503 CA GLY A 100 -13.501 6.021 -4.815 1.00 0.00 C ATOM 1504 C GLY A 100 -13.296 4.903 -3.812 1.00 0.00 C ATOM 1505 O GLY A 100 -12.613 5.083 -2.803 1.00 0.00 O ATOM 0 H GLY A 100 -12.328 7.202 -3.543 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -14.565 6.246 -4.891 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -13.175 5.686 -5.800 1.00 0.00 H new ATOM 1509 N ILE A 101 -13.890 3.747 -4.087 1.00 0.00 N ATOM 1510 CA ILE A 101 -13.769 2.596 -3.200 1.00 0.00 C ATOM 1511 C ILE A 101 -13.058 1.439 -3.894 1.00 0.00 C ATOM 1512 O ILE A 101 -13.463 1.005 -4.972 1.00 0.00 O ATOM 1513 CB ILE A 101 -15.147 2.117 -2.708 1.00 0.00 C ATOM 1514 CG1 ILE A 101 -15.865 3.241 -1.958 1.00 0.00 C ATOM 1515 CG2 ILE A 101 -14.996 0.892 -1.819 1.00 0.00 C ATOM 1516 CD1 ILE A 101 -17.331 2.962 -1.710 1.00 0.00 C ATOM 0 H ILE A 101 -14.460 3.582 -4.917 1.00 0.00 H new ATOM 0 HA ILE A 101 -13.179 2.919 -2.342 1.00 0.00 H new ATOM 0 HB ILE A 101 -15.749 1.841 -3.574 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -15.368 3.404 -1.002 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -15.771 4.165 -2.528 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -15.979 0.566 -1.479 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -14.522 0.089 -2.383 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -14.379 1.142 -0.956 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -17.775 3.801 -1.174 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -17.842 2.828 -2.663 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -17.433 2.056 -1.113 1.00 0.00 H new ATOM 1528 N VAL A 102 -11.997 0.942 -3.267 1.00 0.00 N ATOM 1529 CA VAL A 102 -11.231 -0.167 -3.822 1.00 0.00 C ATOM 1530 C VAL A 102 -11.650 -1.492 -3.196 1.00 0.00 C ATOM 1531 O VAL A 102 -11.921 -1.566 -1.997 1.00 0.00 O ATOM 1532 CB VAL A 102 -9.719 0.033 -3.609 1.00 0.00 C ATOM 1533 CG1 VAL A 102 -8.926 -0.978 -4.425 1.00 0.00 C ATOM 1534 CG2 VAL A 102 -9.314 1.454 -3.968 1.00 0.00 C ATOM 0 H VAL A 102 -11.648 1.290 -2.374 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.440 -0.192 -4.892 1.00 0.00 H new ATOM 0 HB VAL A 102 -9.494 -0.130 -2.555 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.860 -0.821 -4.262 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -9.196 -1.988 -4.115 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.154 -0.850 -5.483 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -8.242 1.577 -3.811 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -9.553 1.647 -5.014 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -9.856 2.158 -3.336 1.00 0.00 H new ATOM 1544 N ARG A 103 -11.702 -2.537 -4.015 1.00 0.00 N ATOM 1545 CA ARG A 103 -12.089 -3.861 -3.542 1.00 0.00 C ATOM 1546 C ARG A 103 -11.424 -4.953 -4.375 1.00 0.00 C ATOM 1547 O ARG A 103 -11.457 -4.918 -5.605 1.00 0.00 O ATOM 1548 CB ARG A 103 -13.610 -4.020 -3.595 1.00 0.00 C ATOM 1549 CG ARG A 103 -14.319 -3.518 -2.348 1.00 0.00 C ATOM 1550 CD ARG A 103 -15.639 -4.241 -2.128 1.00 0.00 C ATOM 1551 NE ARG A 103 -16.748 -3.573 -2.804 1.00 0.00 N ATOM 1552 CZ ARG A 103 -18.015 -3.954 -2.690 1.00 0.00 C ATOM 1553 NH1 ARG A 103 -18.332 -4.993 -1.929 1.00 0.00 N ATOM 1554 NH2 ARG A 103 -18.968 -3.295 -3.336 1.00 0.00 N ATOM 0 H ARG A 103 -11.481 -2.493 -5.010 1.00 0.00 H new ATOM 0 HA ARG A 103 -11.755 -3.962 -2.509 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -13.993 -3.482 -4.462 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.852 -5.073 -3.741 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -13.676 -3.661 -1.480 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -14.500 -2.447 -2.437 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -15.556 -5.265 -2.492 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -15.847 -4.298 -1.060 1.00 0.00 H new ATOM 0 HE ARG A 103 -16.538 -2.770 -3.396 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -17.602 -5.501 -1.430 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -19.306 -5.284 -1.843 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -18.728 -2.495 -3.921 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -19.941 -3.589 -3.248 1.00 0.00 H new ATOM 1568 N THR A 104 -10.817 -5.921 -3.695 1.00 0.00 N ATOM 1569 CA THR A 104 -10.142 -7.022 -4.371 1.00 0.00 C ATOM 1570 C THR A 104 -11.113 -7.811 -5.242 1.00 0.00 C ATOM 1571 O THR A 104 -12.320 -7.814 -4.998 1.00 0.00 O ATOM 1572 CB THR A 104 -9.481 -7.980 -3.362 1.00 0.00 C ATOM 1573 OG1 THR A 104 -10.465 -8.497 -2.460 1.00 0.00 O ATOM 1574 CG2 THR A 104 -8.389 -7.269 -2.576 1.00 0.00 C ATOM 0 H THR A 104 -10.779 -5.965 -2.677 1.00 0.00 H new ATOM 0 HA THR A 104 -9.370 -6.580 -5.001 1.00 0.00 H new ATOM 0 HB THR A 104 -9.030 -8.802 -3.917 1.00 0.00 H new ATOM 0 HG1 THR A 104 -10.020 -8.976 -1.730 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.937 -7.965 -1.870 1.00 0.00 H new ATOM 0 HG22 THR A 104 -7.626 -6.902 -3.263 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.821 -6.429 -2.031 1.00 0.00 H new ATOM 1582 N LYS A 105 -10.579 -8.479 -6.259 1.00 0.00 N ATOM 1583 CA LYS A 105 -11.398 -9.274 -7.166 1.00 0.00 C ATOM 1584 C LYS A 105 -11.242 -10.764 -6.877 1.00 0.00 C ATOM 1585 O LYS A 105 -12.143 -11.557 -7.148 1.00 0.00 O ATOM 1586 CB LYS A 105 -11.015 -8.983 -8.619 1.00 0.00 C ATOM 1587 CG LYS A 105 -11.752 -7.797 -9.217 1.00 0.00 C ATOM 1588 CD LYS A 105 -13.198 -8.141 -9.532 1.00 0.00 C ATOM 1589 CE LYS A 105 -13.321 -8.866 -10.863 1.00 0.00 C ATOM 1590 NZ LYS A 105 -14.711 -9.339 -11.111 1.00 0.00 N ATOM 0 H LYS A 105 -9.582 -8.485 -6.476 1.00 0.00 H new ATOM 0 HA LYS A 105 -12.441 -8.999 -7.009 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -9.942 -8.798 -8.673 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -11.217 -9.868 -9.223 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -11.720 -6.959 -8.521 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -11.247 -7.475 -10.128 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.606 -8.766 -8.737 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -13.793 -7.228 -9.557 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.015 -8.199 -11.669 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -12.640 -9.717 -10.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -14.753 -9.828 -12.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -14.994 -9.995 -10.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -15.358 -8.525 -11.123 1.00 0.00 H new ATOM 1604 N VAL A 106 -10.092 -11.137 -6.323 1.00 0.00 N ATOM 1605 CA VAL A 106 -9.819 -12.531 -5.994 1.00 0.00 C ATOM 1606 C VAL A 106 -9.236 -12.660 -4.591 1.00 0.00 C ATOM 1607 O VAL A 106 -8.897 -11.663 -3.954 1.00 0.00 O ATOM 1608 CB VAL A 106 -8.845 -13.165 -7.003 1.00 0.00 C ATOM 1609 CG1 VAL A 106 -9.343 -12.963 -8.426 1.00 0.00 C ATOM 1610 CG2 VAL A 106 -7.448 -12.587 -6.831 1.00 0.00 C ATOM 0 H VAL A 106 -9.335 -10.493 -6.093 1.00 0.00 H new ATOM 0 HA VAL A 106 -10.771 -13.059 -6.039 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.796 -14.237 -6.810 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -8.641 -13.418 -9.125 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -10.322 -13.430 -8.539 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.423 -11.896 -8.635 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -6.773 -13.047 -7.553 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -7.477 -11.510 -6.996 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -7.092 -12.790 -5.821 1.00 0.00 H new ATOM 1620 N ASP A 107 -9.122 -13.895 -4.116 1.00 0.00 N ATOM 1621 CA ASP A 107 -8.578 -14.156 -2.788 1.00 0.00 C ATOM 1622 C ASP A 107 -7.055 -14.234 -2.831 1.00 0.00 C ATOM 1623 O ASP A 107 -6.450 -14.168 -3.901 1.00 0.00 O ATOM 1624 CB ASP A 107 -9.152 -15.457 -2.225 1.00 0.00 C ATOM 1625 CG ASP A 107 -10.644 -15.582 -2.462 1.00 0.00 C ATOM 1626 OD1 ASP A 107 -11.077 -15.409 -3.620 1.00 0.00 O ATOM 1627 OD2 ASP A 107 -11.379 -15.851 -1.488 1.00 0.00 O ATOM 0 H ASP A 107 -9.399 -14.731 -4.630 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.864 -13.330 -2.136 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -8.642 -16.304 -2.684 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -8.952 -15.506 -1.155 1.00 0.00 H new ATOM 1632 N ASP A 108 -6.442 -14.374 -1.661 1.00 0.00 N ATOM 1633 CA ASP A 108 -4.989 -14.461 -1.564 1.00 0.00 C ATOM 1634 C ASP A 108 -4.327 -13.271 -2.251 1.00 0.00 C ATOM 1635 O ASP A 108 -3.341 -13.428 -2.972 1.00 0.00 O ATOM 1636 CB ASP A 108 -4.492 -15.767 -2.186 1.00 0.00 C ATOM 1637 CG ASP A 108 -4.981 -16.989 -1.434 1.00 0.00 C ATOM 1638 OD1 ASP A 108 -6.098 -17.463 -1.732 1.00 0.00 O ATOM 1639 OD2 ASP A 108 -4.247 -17.472 -0.547 1.00 0.00 O ATOM 0 H ASP A 108 -6.928 -14.430 -0.766 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.718 -14.445 -0.508 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.827 -15.823 -3.222 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -3.402 -15.766 -2.203 1.00 0.00 H new ATOM 1644 N CYS A 109 -4.875 -12.083 -2.025 1.00 0.00 N ATOM 1645 CA CYS A 109 -4.339 -10.866 -2.624 1.00 0.00 C ATOM 1646 C CYS A 109 -3.256 -10.256 -1.740 1.00 0.00 C ATOM 1647 O CYS A 109 -3.489 -9.972 -0.565 1.00 0.00 O ATOM 1648 CB CYS A 109 -5.458 -9.850 -2.856 1.00 0.00 C ATOM 1649 SG CYS A 109 -6.355 -10.081 -4.409 1.00 0.00 S ATOM 0 H CYS A 109 -5.691 -11.936 -1.431 1.00 0.00 H new ATOM 0 HA CYS A 109 -3.894 -11.129 -3.583 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -6.165 -9.909 -2.028 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -5.032 -8.847 -2.841 1.00 0.00 H new ATOM 0 HG CYS A 109 -7.439 -10.764 -4.187 1.00 0.00 H new ATOM 1655 N GLN A 110 -2.073 -10.058 -2.312 1.00 0.00 N ATOM 1656 CA GLN A 110 -0.954 -9.484 -1.574 1.00 0.00 C ATOM 1657 C GLN A 110 -0.820 -7.992 -1.863 1.00 0.00 C ATOM 1658 O GLN A 110 -1.159 -7.527 -2.952 1.00 0.00 O ATOM 1659 CB GLN A 110 0.346 -10.204 -1.935 1.00 0.00 C ATOM 1660 CG GLN A 110 0.566 -11.490 -1.154 1.00 0.00 C ATOM 1661 CD GLN A 110 1.619 -12.382 -1.782 1.00 0.00 C ATOM 1662 OE1 GLN A 110 1.898 -12.285 -2.978 1.00 0.00 O ATOM 1663 NE2 GLN A 110 2.210 -13.257 -0.978 1.00 0.00 N ATOM 0 H GLN A 110 -1.865 -10.286 -3.284 1.00 0.00 H new ATOM 0 HA GLN A 110 -1.149 -9.614 -0.509 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.341 -10.432 -3.001 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.185 -9.532 -1.757 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.864 -11.245 -0.135 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -0.375 -12.036 -1.088 1.00 0.00 H new ATOM 0 HE21 GLN A 110 1.948 -13.303 0.007 1.00 0.00 H new ATOM 0 HE22 GLN A 110 2.927 -13.884 -1.345 1.00 0.00 H new ATOM 1672 N PHE A 111 -0.324 -7.247 -0.881 1.00 0.00 N ATOM 1673 CA PHE A 111 -0.146 -5.807 -1.030 1.00 0.00 C ATOM 1674 C PHE A 111 0.971 -5.301 -0.122 1.00 0.00 C ATOM 1675 O PHE A 111 1.518 -6.051 0.686 1.00 0.00 O ATOM 1676 CB PHE A 111 -1.450 -5.075 -0.709 1.00 0.00 C ATOM 1677 CG PHE A 111 -2.612 -5.522 -1.550 1.00 0.00 C ATOM 1678 CD1 PHE A 111 -2.679 -5.189 -2.893 1.00 0.00 C ATOM 1679 CD2 PHE A 111 -3.635 -6.275 -0.998 1.00 0.00 C ATOM 1680 CE1 PHE A 111 -3.747 -5.598 -3.669 1.00 0.00 C ATOM 1681 CE2 PHE A 111 -4.705 -6.688 -1.769 1.00 0.00 C ATOM 1682 CZ PHE A 111 -4.760 -6.350 -3.107 1.00 0.00 C ATOM 0 H PHE A 111 -0.038 -7.616 0.026 1.00 0.00 H new ATOM 0 HA PHE A 111 0.131 -5.605 -2.065 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -1.693 -5.227 0.343 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.300 -4.005 -0.850 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -1.888 -4.604 -3.338 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -3.596 -6.543 0.048 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -3.789 -5.330 -4.714 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -5.497 -7.274 -1.326 1.00 0.00 H new ATOM 0 HZ PHE A 111 -5.594 -6.673 -3.713 1.00 0.00 H new ATOM 1692 N VAL A 112 1.306 -4.022 -0.262 1.00 0.00 N ATOM 1693 CA VAL A 112 2.357 -3.414 0.544 1.00 0.00 C ATOM 1694 C VAL A 112 2.038 -1.956 0.855 1.00 0.00 C ATOM 1695 O VAL A 112 1.576 -1.213 -0.012 1.00 0.00 O ATOM 1696 CB VAL A 112 3.723 -3.489 -0.164 1.00 0.00 C ATOM 1697 CG1 VAL A 112 3.643 -2.858 -1.546 1.00 0.00 C ATOM 1698 CG2 VAL A 112 4.797 -2.816 0.677 1.00 0.00 C ATOM 0 H VAL A 112 0.864 -3.387 -0.927 1.00 0.00 H new ATOM 0 HA VAL A 112 2.407 -3.979 1.475 1.00 0.00 H new ATOM 0 HB VAL A 112 3.993 -4.538 -0.285 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.617 -2.920 -2.031 1.00 0.00 H new ATOM 0 HG12 VAL A 112 2.904 -3.389 -2.146 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.350 -1.812 -1.452 1.00 0.00 H new ATOM 0 HG21 VAL A 112 5.755 -2.879 0.161 1.00 0.00 H new ATOM 0 HG22 VAL A 112 4.536 -1.769 0.831 1.00 0.00 H new ATOM 0 HG23 VAL A 112 4.871 -3.317 1.642 1.00 0.00 H new ATOM 1708 N CYS A 113 2.287 -1.553 2.096 1.00 0.00 N ATOM 1709 CA CYS A 113 2.026 -0.183 2.522 1.00 0.00 C ATOM 1710 C CYS A 113 3.325 0.536 2.870 1.00 0.00 C ATOM 1711 O CYS A 113 4.112 0.056 3.688 1.00 0.00 O ATOM 1712 CB CYS A 113 1.084 -0.172 3.727 1.00 0.00 C ATOM 1713 SG CYS A 113 -0.670 -0.104 3.293 1.00 0.00 S ATOM 0 H CYS A 113 2.669 -2.156 2.825 1.00 0.00 H new ATOM 0 HA CYS A 113 1.551 0.344 1.694 1.00 0.00 H new ATOM 0 HB2 CYS A 113 1.265 -1.066 4.324 1.00 0.00 H new ATOM 0 HB3 CYS A 113 1.325 0.685 4.355 1.00 0.00 H new ATOM 0 HG CYS A 113 -0.802 0.387 2.097 1.00 0.00 H new ATOM 1719 N ILE A 114 3.545 1.687 2.244 1.00 0.00 N ATOM 1720 CA ILE A 114 4.750 2.470 2.487 1.00 0.00 C ATOM 1721 C ILE A 114 4.403 3.899 2.892 1.00 0.00 C ATOM 1722 O ILE A 114 3.632 4.577 2.214 1.00 0.00 O ATOM 1723 CB ILE A 114 5.659 2.506 1.245 1.00 0.00 C ATOM 1724 CG1 ILE A 114 6.208 1.110 0.947 1.00 0.00 C ATOM 1725 CG2 ILE A 114 6.796 3.496 1.449 1.00 0.00 C ATOM 1726 CD1 ILE A 114 6.740 0.957 -0.461 1.00 0.00 C ATOM 0 H ILE A 114 2.905 2.098 1.565 1.00 0.00 H new ATOM 0 HA ILE A 114 5.284 1.983 3.303 1.00 0.00 H new ATOM 0 HB ILE A 114 5.068 2.833 0.390 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.006 0.884 1.655 1.00 0.00 H new ATOM 0 HG13 ILE A 114 5.419 0.376 1.110 1.00 0.00 H new ATOM 0 HG21 ILE A 114 7.430 3.510 0.562 1.00 0.00 H new ATOM 0 HG22 ILE A 114 6.386 4.492 1.617 1.00 0.00 H new ATOM 0 HG23 ILE A 114 7.388 3.197 2.314 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.113 -0.058 -0.601 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.940 1.151 -1.175 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.551 1.667 -0.623 1.00 0.00 H new ATOM 1738 N ALA A 115 4.981 4.351 4.000 1.00 0.00 N ATOM 1739 CA ALA A 115 4.736 5.701 4.493 1.00 0.00 C ATOM 1740 C ALA A 115 5.134 6.745 3.455 1.00 0.00 C ATOM 1741 O ALA A 115 6.078 6.545 2.691 1.00 0.00 O ATOM 1742 CB ALA A 115 5.492 5.933 5.793 1.00 0.00 C ATOM 0 H ALA A 115 5.622 3.802 4.573 1.00 0.00 H new ATOM 0 HA ALA A 115 3.668 5.804 4.683 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.300 6.945 6.150 1.00 0.00 H new ATOM 0 HB2 ALA A 115 5.158 5.215 6.542 1.00 0.00 H new ATOM 0 HB3 ALA A 115 6.561 5.806 5.620 1.00 0.00 H new ATOM 1748 N GLN A 116 4.407 7.857 3.432 1.00 0.00 N ATOM 1749 CA GLN A 116 4.684 8.931 2.486 1.00 0.00 C ATOM 1750 C GLN A 116 6.093 9.480 2.682 1.00 0.00 C ATOM 1751 O GLN A 116 6.908 9.465 1.760 1.00 0.00 O ATOM 1752 CB GLN A 116 3.659 10.056 2.645 1.00 0.00 C ATOM 1753 CG GLN A 116 3.822 11.175 1.629 1.00 0.00 C ATOM 1754 CD GLN A 116 2.533 11.936 1.387 1.00 0.00 C ATOM 1755 OE1 GLN A 116 1.580 11.825 2.158 1.00 0.00 O ATOM 1756 NE2 GLN A 116 2.498 12.714 0.312 1.00 0.00 N ATOM 0 H GLN A 116 3.622 8.038 4.058 1.00 0.00 H new ATOM 0 HA GLN A 116 4.611 8.521 1.479 1.00 0.00 H new ATOM 0 HB2 GLN A 116 2.656 9.638 2.555 1.00 0.00 H new ATOM 0 HB3 GLN A 116 3.742 10.473 3.649 1.00 0.00 H new ATOM 0 HG2 GLN A 116 4.588 11.868 1.977 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.175 10.756 0.686 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.312 12.776 -0.300 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.657 13.250 0.098 1.00 0.00 H new ATOM 1765 N GLN A 117 6.372 9.963 3.889 1.00 0.00 N ATOM 1766 CA GLN A 117 7.684 10.517 4.204 1.00 0.00 C ATOM 1767 C GLN A 117 8.795 9.661 3.605 1.00 0.00 C ATOM 1768 O GLN A 117 9.580 10.133 2.783 1.00 0.00 O ATOM 1769 CB GLN A 117 7.865 10.622 5.720 1.00 0.00 C ATOM 1770 CG GLN A 117 7.385 11.942 6.300 1.00 0.00 C ATOM 1771 CD GLN A 117 6.091 12.420 5.670 1.00 0.00 C ATOM 1772 OE1 GLN A 117 5.020 11.871 5.930 1.00 0.00 O ATOM 1773 NE2 GLN A 117 6.184 13.450 4.837 1.00 0.00 N ATOM 0 H GLN A 117 5.708 9.982 4.663 1.00 0.00 H new ATOM 0 HA GLN A 117 7.744 11.514 3.768 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.324 9.806 6.199 1.00 0.00 H new ATOM 0 HB3 GLN A 117 8.920 10.491 5.962 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.242 11.832 7.375 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.156 12.699 6.157 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.092 13.875 4.650 1.00 0.00 H new ATOM 0 HE22 GLN A 117 5.347 13.817 4.384 1.00 0.00 H new ATOM 1782 N ASP A 118 8.855 8.402 4.023 1.00 0.00 N ATOM 1783 CA ASP A 118 9.870 7.479 3.527 1.00 0.00 C ATOM 1784 C ASP A 118 9.743 7.292 2.018 1.00 0.00 C ATOM 1785 O ASP A 118 10.716 6.960 1.340 1.00 0.00 O ATOM 1786 CB ASP A 118 9.750 6.128 4.233 1.00 0.00 C ATOM 1787 CG ASP A 118 10.250 6.176 5.664 1.00 0.00 C ATOM 1788 OD1 ASP A 118 9.704 6.971 6.456 1.00 0.00 O ATOM 1789 OD2 ASP A 118 11.188 5.418 5.990 1.00 0.00 O ATOM 0 H ASP A 118 8.213 7.997 4.704 1.00 0.00 H new ATOM 0 HA ASP A 118 10.850 7.906 3.741 1.00 0.00 H new ATOM 0 HB2 ASP A 118 8.708 5.809 4.226 1.00 0.00 H new ATOM 0 HB3 ASP A 118 10.316 5.380 3.678 1.00 0.00 H new ATOM 1794 N TYR A 119 8.539 7.506 1.500 1.00 0.00 N ATOM 1795 CA TYR A 119 8.285 7.358 0.072 1.00 0.00 C ATOM 1796 C TYR A 119 8.811 8.561 -0.704 1.00 0.00 C ATOM 1797 O TYR A 119 9.016 8.491 -1.915 1.00 0.00 O ATOM 1798 CB TYR A 119 6.786 7.187 -0.185 1.00 0.00 C ATOM 1799 CG TYR A 119 6.457 6.797 -1.608 1.00 0.00 C ATOM 1800 CD1 TYR A 119 7.218 5.852 -2.284 1.00 0.00 C ATOM 1801 CD2 TYR A 119 5.385 7.374 -2.277 1.00 0.00 C ATOM 1802 CE1 TYR A 119 6.922 5.492 -3.585 1.00 0.00 C ATOM 1803 CE2 TYR A 119 5.080 7.020 -3.577 1.00 0.00 C ATOM 1804 CZ TYR A 119 5.851 6.079 -4.227 1.00 0.00 C ATOM 1805 OH TYR A 119 5.551 5.725 -5.522 1.00 0.00 O ATOM 0 H TYR A 119 7.724 7.782 2.047 1.00 0.00 H new ATOM 0 HA TYR A 119 8.811 6.468 -0.274 1.00 0.00 H new ATOM 0 HB2 TYR A 119 6.394 6.427 0.491 1.00 0.00 H new ATOM 0 HB3 TYR A 119 6.276 8.120 0.054 1.00 0.00 H new ATOM 0 HD1 TYR A 119 8.056 5.390 -1.784 1.00 0.00 H new ATOM 0 HD2 TYR A 119 4.780 8.112 -1.772 1.00 0.00 H new ATOM 0 HE1 TYR A 119 7.525 4.756 -4.096 1.00 0.00 H new ATOM 0 HE2 TYR A 119 4.242 7.478 -4.082 1.00 0.00 H new ATOM 0 HH TYR A 119 5.018 4.903 -5.521 1.00 0.00 H new ATOM 1815 N TRP A 120 9.029 9.663 0.005 1.00 0.00 N ATOM 1816 CA TRP A 120 9.533 10.883 -0.616 1.00 0.00 C ATOM 1817 C TRP A 120 10.972 11.156 -0.192 1.00 0.00 C ATOM 1818 O TRP A 120 11.566 12.158 -0.589 1.00 0.00 O ATOM 1819 CB TRP A 120 8.645 12.073 -0.245 1.00 0.00 C ATOM 1820 CG TRP A 120 9.274 13.400 -0.546 1.00 0.00 C ATOM 1821 CD1 TRP A 120 9.292 14.044 -1.750 1.00 0.00 C ATOM 1822 CD2 TRP A 120 9.978 14.242 0.373 1.00 0.00 C ATOM 1823 NE1 TRP A 120 9.965 15.237 -1.634 1.00 0.00 N ATOM 1824 CE2 TRP A 120 10.394 15.382 -0.342 1.00 0.00 C ATOM 1825 CE3 TRP A 120 10.295 14.146 1.731 1.00 0.00 C ATOM 1826 CZ2 TRP A 120 11.111 16.415 0.257 1.00 0.00 C ATOM 1827 CZ3 TRP A 120 11.006 15.172 2.323 1.00 0.00 C ATOM 1828 CH2 TRP A 120 11.408 16.294 1.587 1.00 0.00 C ATOM 0 H TRP A 120 8.865 9.737 1.009 1.00 0.00 H new ATOM 0 HA TRP A 120 9.512 10.746 -1.697 1.00 0.00 H new ATOM 0 HB2 TRP A 120 7.701 11.995 -0.785 1.00 0.00 H new ATOM 0 HB3 TRP A 120 8.409 12.024 0.818 1.00 0.00 H new ATOM 0 HD1 TRP A 120 8.844 13.671 -2.659 1.00 0.00 H new ATOM 0 HE1 TRP A 120 10.120 15.906 -2.388 1.00 0.00 H new ATOM 0 HE3 TRP A 120 9.990 13.285 2.307 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 11.422 17.281 -0.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 11.256 15.108 3.372 1.00 0.00 H new ATOM 0 HH2 TRP A 120 11.963 17.079 2.079 1.00 0.00 H new ATOM 1839 N ARG A 121 11.526 10.257 0.615 1.00 0.00 N ATOM 1840 CA ARG A 121 12.896 10.402 1.093 1.00 0.00 C ATOM 1841 C ARG A 121 13.835 9.460 0.345 1.00 0.00 C ATOM 1842 O ARG A 121 15.057 9.575 0.449 1.00 0.00 O ATOM 1843 CB ARG A 121 12.967 10.123 2.596 1.00 0.00 C ATOM 1844 CG ARG A 121 12.704 11.349 3.456 1.00 0.00 C ATOM 1845 CD ARG A 121 12.529 10.975 4.919 1.00 0.00 C ATOM 1846 NE ARG A 121 13.797 10.610 5.546 1.00 0.00 N ATOM 1847 CZ ARG A 121 13.886 9.879 6.652 1.00 0.00 C ATOM 1848 NH1 ARG A 121 12.788 9.438 7.250 1.00 0.00 N ATOM 1849 NH2 ARG A 121 15.076 9.589 7.162 1.00 0.00 N ATOM 0 H ARG A 121 11.048 9.421 0.951 1.00 0.00 H new ATOM 0 HA ARG A 121 13.213 11.428 0.906 1.00 0.00 H new ATOM 0 HB2 ARG A 121 12.241 9.350 2.848 1.00 0.00 H new ATOM 0 HB3 ARG A 121 13.953 9.725 2.837 1.00 0.00 H new ATOM 0 HG2 ARG A 121 13.532 12.050 3.355 1.00 0.00 H new ATOM 0 HG3 ARG A 121 11.809 11.859 3.100 1.00 0.00 H new ATOM 0 HD2 ARG A 121 12.087 11.813 5.457 1.00 0.00 H new ATOM 0 HD3 ARG A 121 11.832 10.141 4.999 1.00 0.00 H new ATOM 0 HE ARG A 121 14.661 10.934 5.111 1.00 0.00 H new ATOM 0 HH11 ARG A 121 11.871 9.660 6.861 1.00 0.00 H new ATOM 0 HH12 ARG A 121 12.860 8.877 8.099 1.00 0.00 H new ATOM 0 HH21 ARG A 121 15.923 9.927 6.705 1.00 0.00 H new ATOM 0 HH22 ARG A 121 15.144 9.028 8.011 1.00 0.00 H new ATOM 1863 N ILE A 122 13.257 8.530 -0.407 1.00 0.00 N ATOM 1864 CA ILE A 122 14.042 7.570 -1.172 1.00 0.00 C ATOM 1865 C ILE A 122 14.070 7.937 -2.651 1.00 0.00 C ATOM 1866 O ILE A 122 15.126 8.239 -3.208 1.00 0.00 O ATOM 1867 CB ILE A 122 13.488 6.141 -1.019 1.00 0.00 C ATOM 1868 CG1 ILE A 122 13.435 5.746 0.458 1.00 0.00 C ATOM 1869 CG2 ILE A 122 14.338 5.156 -1.807 1.00 0.00 C ATOM 1870 CD1 ILE A 122 12.750 4.420 0.705 1.00 0.00 C ATOM 0 H ILE A 122 12.247 8.421 -0.503 1.00 0.00 H new ATOM 0 HA ILE A 122 15.056 7.602 -0.773 1.00 0.00 H new ATOM 0 HB ILE A 122 12.474 6.116 -1.418 1.00 0.00 H new ATOM 0 HG12 ILE A 122 14.451 5.699 0.850 1.00 0.00 H new ATOM 0 HG13 ILE A 122 12.914 6.524 1.015 1.00 0.00 H new ATOM 0 HG21 ILE A 122 13.934 4.151 -1.689 1.00 0.00 H new ATOM 0 HG22 ILE A 122 14.328 5.429 -2.862 1.00 0.00 H new ATOM 0 HG23 ILE A 122 15.362 5.181 -1.436 1.00 0.00 H new ATOM 0 HD11 ILE A 122 12.749 4.204 1.773 1.00 0.00 H new ATOM 0 HD12 ILE A 122 11.723 4.468 0.344 1.00 0.00 H new ATOM 0 HD13 ILE A 122 13.284 3.631 0.176 1.00 0.00 H new ATOM 1882 N LEU A 123 12.902 7.910 -3.284 1.00 0.00 N ATOM 1883 CA LEU A 123 12.791 8.242 -4.700 1.00 0.00 C ATOM 1884 C LEU A 123 13.377 9.622 -4.983 1.00 0.00 C ATOM 1885 O LEU A 123 14.115 9.806 -5.950 1.00 0.00 O ATOM 1886 CB LEU A 123 11.327 8.197 -5.142 1.00 0.00 C ATOM 1887 CG LEU A 123 10.769 6.813 -5.474 1.00 0.00 C ATOM 1888 CD1 LEU A 123 10.176 6.164 -4.233 1.00 0.00 C ATOM 1889 CD2 LEU A 123 9.725 6.910 -6.577 1.00 0.00 C ATOM 0 H LEU A 123 12.019 7.662 -2.839 1.00 0.00 H new ATOM 0 HA LEU A 123 13.358 7.503 -5.266 1.00 0.00 H new ATOM 0 HB2 LEU A 123 10.716 8.633 -4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 123 11.214 8.833 -6.020 1.00 0.00 H new ATOM 0 HG LEU A 123 11.588 6.188 -5.829 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.784 5.180 -4.489 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.949 6.060 -3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.369 6.787 -3.847 1.00 0.00 H new ATOM 0 HD21 LEU A 123 9.338 5.916 -6.801 1.00 0.00 H new ATOM 0 HD22 LEU A 123 8.907 7.552 -6.249 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.180 7.332 -7.473 1.00 0.00 H new ATOM 1901 N ASN A 124 13.045 10.586 -4.132 1.00 0.00 N ATOM 1902 CA ASN A 124 13.540 11.949 -4.290 1.00 0.00 C ATOM 1903 C ASN A 124 14.954 12.082 -3.733 1.00 0.00 C ATOM 1904 O ASN A 124 15.557 11.100 -3.300 1.00 0.00 O ATOM 1905 CB ASN A 124 12.607 12.937 -3.586 1.00 0.00 C ATOM 1906 CG ASN A 124 11.223 12.966 -4.204 1.00 0.00 C ATOM 1907 OD1 ASN A 124 10.359 12.058 -3.764 1.00 0.00 O flip ATOM 1908 ND2 ASN A 124 10.933 13.795 -5.067 1.00 0.00 N flip ATOM 0 H ASN A 124 12.435 10.449 -3.326 1.00 0.00 H new ATOM 0 HA ASN A 124 13.565 12.179 -5.355 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.526 12.668 -2.533 1.00 0.00 H new ATOM 0 HB3 ASN A 124 13.042 13.936 -3.628 1.00 0.00 H new ATOM 0 HD21 ASN A 124 11.628 14.475 -5.375 1.00 0.00 H new ATOM 0 HD22 ASN A 124 9.997 13.802 -5.473 1.00 0.00 H new ATOM 1915 N HIS A 125 15.477 13.304 -3.747 1.00 0.00 N ATOM 1916 CA HIS A 125 16.820 13.567 -3.242 1.00 0.00 C ATOM 1917 C HIS A 125 16.767 14.398 -1.964 1.00 0.00 C ATOM 1918 O HIS A 125 17.213 15.545 -1.938 1.00 0.00 O ATOM 1919 CB HIS A 125 17.653 14.290 -4.301 1.00 0.00 C ATOM 1920 CG HIS A 125 17.647 13.610 -5.635 1.00 0.00 C ATOM 1921 ND1 HIS A 125 16.798 13.971 -6.660 1.00 0.00 N ATOM 1922 CD2 HIS A 125 18.395 12.587 -6.111 1.00 0.00 C ATOM 1923 CE1 HIS A 125 17.022 13.198 -7.707 1.00 0.00 C ATOM 1924 NE2 HIS A 125 17.987 12.350 -7.401 1.00 0.00 N ATOM 0 H HIS A 125 14.991 14.128 -4.102 1.00 0.00 H new ATOM 0 HA HIS A 125 17.289 12.610 -3.012 1.00 0.00 H new ATOM 0 HB2 HIS A 125 17.274 15.305 -4.418 1.00 0.00 H new ATOM 0 HB3 HIS A 125 18.681 14.372 -3.949 1.00 0.00 H new ATOM 0 HD2 HIS A 125 19.169 12.056 -5.576 1.00 0.00 H new ATOM 0 HE1 HIS A 125 16.504 13.250 -8.653 1.00 0.00 H new ATOM 0 HE2 HIS A 125 18.367 11.635 -8.022 1.00 0.00 H new ATOM 1933 N VAL A 126 16.218 13.811 -0.905 1.00 0.00 N ATOM 1934 CA VAL A 126 16.107 14.498 0.377 1.00 0.00 C ATOM 1935 C VAL A 126 17.406 14.396 1.169 1.00 0.00 C ATOM 1936 O VAL A 126 18.210 13.491 0.947 1.00 0.00 O ATOM 1937 CB VAL A 126 14.956 13.922 1.223 1.00 0.00 C ATOM 1938 CG1 VAL A 126 14.946 14.550 2.609 1.00 0.00 C ATOM 1939 CG2 VAL A 126 13.622 14.135 0.523 1.00 0.00 C ATOM 0 H VAL A 126 15.843 12.862 -0.909 1.00 0.00 H new ATOM 0 HA VAL A 126 15.899 15.546 0.159 1.00 0.00 H new ATOM 0 HB VAL A 126 15.113 12.849 1.337 1.00 0.00 H new ATOM 0 HG11 VAL A 126 14.126 14.131 3.192 1.00 0.00 H new ATOM 0 HG12 VAL A 126 15.891 14.341 3.110 1.00 0.00 H new ATOM 0 HG13 VAL A 126 14.813 15.628 2.519 1.00 0.00 H new ATOM 0 HG21 VAL A 126 12.820 13.722 1.135 1.00 0.00 H new ATOM 0 HG22 VAL A 126 13.454 15.202 0.377 1.00 0.00 H new ATOM 0 HG23 VAL A 126 13.635 13.634 -0.445 1.00 0.00 H new ATOM 1949 N GLU A 127 17.603 15.330 2.094 1.00 0.00 N ATOM 1950 CA GLU A 127 18.805 15.345 2.919 1.00 0.00 C ATOM 1951 C GLU A 127 19.248 13.926 3.261 1.00 0.00 C ATOM 1952 O GLU A 127 20.372 13.523 2.959 1.00 0.00 O ATOM 1953 CB GLU A 127 18.559 16.138 4.204 1.00 0.00 C ATOM 1954 CG GLU A 127 18.455 17.638 3.983 1.00 0.00 C ATOM 1955 CD GLU A 127 18.656 18.431 5.260 1.00 0.00 C ATOM 1956 OE1 GLU A 127 19.706 18.253 5.911 1.00 0.00 O ATOM 1957 OE2 GLU A 127 17.761 19.230 5.609 1.00 0.00 O ATOM 0 H GLU A 127 16.946 16.085 2.291 1.00 0.00 H new ATOM 0 HA GLU A 127 19.599 15.828 2.349 1.00 0.00 H new ATOM 0 HB2 GLU A 127 17.639 15.783 4.670 1.00 0.00 H new ATOM 0 HB3 GLU A 127 19.369 15.938 4.905 1.00 0.00 H new ATOM 0 HG2 GLU A 127 19.199 17.946 3.248 1.00 0.00 H new ATOM 0 HG3 GLU A 127 17.477 17.873 3.564 1.00 0.00 H new ATOM 1964 N LYS A 128 18.357 13.171 3.895 1.00 0.00 N ATOM 1965 CA LYS A 128 18.653 11.796 4.279 1.00 0.00 C ATOM 1966 C LYS A 128 18.477 10.850 3.095 1.00 0.00 C ATOM 1967 O LYS A 128 17.360 10.620 2.633 1.00 0.00 O ATOM 1968 CB LYS A 128 17.746 11.360 5.432 1.00 0.00 C ATOM 1969 CG LYS A 128 18.277 11.744 6.802 1.00 0.00 C ATOM 1970 CD LYS A 128 19.386 10.808 7.253 1.00 0.00 C ATOM 1971 CE LYS A 128 20.271 11.458 8.305 1.00 0.00 C ATOM 1972 NZ LYS A 128 21.523 10.684 8.532 1.00 0.00 N ATOM 0 H LYS A 128 17.423 13.489 4.154 1.00 0.00 H new ATOM 0 HA LYS A 128 19.692 11.752 4.605 1.00 0.00 H new ATOM 0 HB2 LYS A 128 16.760 11.805 5.296 1.00 0.00 H new ATOM 0 HB3 LYS A 128 17.616 10.279 5.392 1.00 0.00 H new ATOM 0 HG2 LYS A 128 18.652 12.767 6.774 1.00 0.00 H new ATOM 0 HG3 LYS A 128 17.464 11.722 7.528 1.00 0.00 H new ATOM 0 HD2 LYS A 128 18.950 9.894 7.657 1.00 0.00 H new ATOM 0 HD3 LYS A 128 19.992 10.520 6.394 1.00 0.00 H new ATOM 0 HE2 LYS A 128 20.522 12.471 7.992 1.00 0.00 H new ATOM 0 HE3 LYS A 128 19.720 11.541 9.242 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 22.099 11.160 9.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 21.284 9.725 8.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 22.061 10.626 7.644 1.00 0.00 H new ATOM 1986 N SER A 129 19.588 10.304 2.610 1.00 0.00 N ATOM 1987 CA SER A 129 19.556 9.386 1.478 1.00 0.00 C ATOM 1988 C SER A 129 18.688 8.170 1.789 1.00 0.00 C ATOM 1989 O SER A 129 17.737 7.872 1.069 1.00 0.00 O ATOM 1990 CB SER A 129 20.974 8.936 1.119 1.00 0.00 C ATOM 1991 OG SER A 129 21.814 10.049 0.867 1.00 0.00 O ATOM 0 H SER A 129 20.521 10.482 2.983 1.00 0.00 H new ATOM 0 HA SER A 129 19.123 9.912 0.627 1.00 0.00 H new ATOM 0 HB2 SER A 129 21.387 8.342 1.934 1.00 0.00 H new ATOM 0 HB3 SER A 129 20.943 8.293 0.239 1.00 0.00 H new ATOM 0 HG SER A 129 22.715 9.735 0.642 1.00 0.00 H new ATOM 1997 N GLY A 130 19.025 7.471 2.869 1.00 0.00 N ATOM 1998 CA GLY A 130 18.267 6.296 3.258 1.00 0.00 C ATOM 1999 C GLY A 130 17.604 6.455 4.611 1.00 0.00 C ATOM 2000 O GLY A 130 17.892 7.388 5.362 1.00 0.00 O ATOM 0 H GLY A 130 19.809 7.697 3.481 1.00 0.00 H new ATOM 0 HA2 GLY A 130 17.505 6.093 2.505 1.00 0.00 H new ATOM 0 HA3 GLY A 130 18.930 5.431 3.281 1.00 0.00 H new ATOM 2004 N PRO A 131 16.690 5.530 4.940 1.00 0.00 N ATOM 2005 CA PRO A 131 15.963 5.551 6.213 1.00 0.00 C ATOM 2006 C PRO A 131 16.863 5.225 7.399 1.00 0.00 C ATOM 2007 O PRO A 131 17.766 4.395 7.296 1.00 0.00 O ATOM 2008 CB PRO A 131 14.900 4.465 6.033 1.00 0.00 C ATOM 2009 CG PRO A 131 15.476 3.536 5.019 1.00 0.00 C ATOM 2010 CD PRO A 131 16.296 4.391 4.093 1.00 0.00 C ATOM 0 HA PRO A 131 15.551 6.536 6.431 1.00 0.00 H new ATOM 0 HB2 PRO A 131 14.697 3.950 6.972 1.00 0.00 H new ATOM 0 HB3 PRO A 131 13.955 4.888 5.691 1.00 0.00 H new ATOM 0 HG2 PRO A 131 16.093 2.773 5.494 1.00 0.00 H new ATOM 0 HG3 PRO A 131 14.688 3.015 4.474 1.00 0.00 H new ATOM 0 HD2 PRO A 131 17.165 3.853 3.713 1.00 0.00 H new ATOM 0 HD3 PRO A 131 15.718 4.715 3.227 1.00 0.00 H new ATOM 2018 N SER A 132 16.611 5.883 8.526 1.00 0.00 N ATOM 2019 CA SER A 132 17.401 5.665 9.732 1.00 0.00 C ATOM 2020 C SER A 132 16.836 4.507 10.550 1.00 0.00 C ATOM 2021 O SER A 132 15.816 4.648 11.223 1.00 0.00 O ATOM 2022 CB SER A 132 17.435 6.936 10.583 1.00 0.00 C ATOM 2023 OG SER A 132 18.248 7.929 9.983 1.00 0.00 O ATOM 0 H SER A 132 15.866 6.572 8.629 1.00 0.00 H new ATOM 0 HA SER A 132 18.417 5.412 9.429 1.00 0.00 H new ATOM 0 HB2 SER A 132 16.423 7.319 10.711 1.00 0.00 H new ATOM 0 HB3 SER A 132 17.815 6.702 11.577 1.00 0.00 H new ATOM 0 HG SER A 132 18.252 8.732 10.545 1.00 0.00 H new ATOM 2029 N SER A 133 17.508 3.362 10.485 1.00 0.00 N ATOM 2030 CA SER A 133 17.071 2.178 11.216 1.00 0.00 C ATOM 2031 C SER A 133 18.191 1.645 12.106 1.00 0.00 C ATOM 2032 O SER A 133 18.993 0.815 11.683 1.00 0.00 O ATOM 2033 CB SER A 133 16.618 1.089 10.241 1.00 0.00 C ATOM 2034 OG SER A 133 17.664 0.733 9.353 1.00 0.00 O ATOM 0 H SER A 133 18.356 3.229 9.934 1.00 0.00 H new ATOM 0 HA SER A 133 16.230 2.462 11.849 1.00 0.00 H new ATOM 0 HB2 SER A 133 16.294 0.210 10.798 1.00 0.00 H new ATOM 0 HB3 SER A 133 15.757 1.441 9.672 1.00 0.00 H new ATOM 0 HG SER A 133 18.497 0.622 9.857 1.00 0.00 H new ATOM 2040 N GLY A 134 18.237 2.132 13.342 1.00 0.00 N ATOM 2041 CA GLY A 134 19.261 1.694 14.274 1.00 0.00 C ATOM 2042 C GLY A 134 18.848 1.883 15.720 1.00 0.00 C ATOM 2043 O GLY A 134 18.559 3.000 16.149 1.00 0.00 O ATOM 0 H GLY A 134 17.584 2.821 13.715 1.00 0.00 H new ATOM 0 HA2 GLY A 134 19.483 0.641 14.097 1.00 0.00 H new ATOM 0 HA3 GLY A 134 20.180 2.249 14.086 1.00 0.00 H new TER 2047 GLY A 134