USER MOD reduce.3.24.130724 H: found=0, std=0, add=870, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 866 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 17 THR OG1 : rot 33:sc= -0.559 USER MOD Set 1.2: A 105 HIS : no HE2:sc= -0.364 K(o=-0.92,f=-1.8) 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 45:sc= 0.877 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= -0.553 K(o=-0.55,f=-2.2) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -0.389 X(o=-0.39,f=0) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -1.64 K(o=-1.6,f=-6.2!) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.0643 USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 41 GLN : amide:sc= -3.41! X(o=-3.4!,f=-3.3) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.657 K(o=-0.66,f=-1.2) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= 0 X(o=0,f=-0.063) USER MOD Single : A 67 GLN : amide:sc= -0.212 X(o=-0.21,f=-0.03) USER MOD Single : A 71 LYS NZ :NH3+ -114:sc= -0.0961 (180deg=-1.31) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= -0.276 K(o=-0.28,f=-0.93) USER MOD Single : A 78 GLN :FLIP amide:sc= -4.15! F(o=-5.2,f=-4.2!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 ASN : amide:sc= -0.341 X(o=-0.34,f=-0.34) USER MOD Single : A 85 HIS : no HE2:sc= 0.0617 K(o=0.062,f=-0.54) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN :FLIP amide:sc= -2.07! C(o=-2.8!,f=-2.1!) USER MOD Single : A 108 GLN : amide:sc= -1.29! C(o=-1.3!,f=-2.6!) USER MOD Single : A 110 GLN : amide:sc= -2.57 K(o=-2.6,f=-14!) USER MOD Single : A 111 ASN : amide:sc= -0.125 X(o=-0.12,f=-0.002) USER MOD Single : A 115 SER OG : rot 13:sc= 1.13 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -28.165 21.866 3.454 1.00 0.00 N ATOM 2 CA GLY A 1 -27.209 20.786 3.611 1.00 0.00 C ATOM 3 C GLY A 1 -26.272 20.663 2.425 1.00 0.00 C ATOM 4 O GLY A 1 -26.704 20.362 1.313 1.00 0.00 O ATOM 0 H1 GLY A 1 -28.782 21.908 4.290 1.00 0.00 H new ATOM 0 H2 GLY A 1 -27.657 22.768 3.353 1.00 0.00 H new ATOM 0 H3 GLY A 1 -28.743 21.698 2.606 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -26.625 20.951 4.516 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -27.746 19.847 3.745 1.00 0.00 H new ATOM 8 N SER A 2 -24.986 20.899 2.663 1.00 0.00 N ATOM 9 CA SER A 2 -23.986 20.819 1.604 1.00 0.00 C ATOM 10 C SER A 2 -23.345 19.435 1.566 1.00 0.00 C ATOM 11 O SER A 2 -22.130 19.306 1.410 1.00 0.00 O ATOM 12 CB SER A 2 -22.910 21.887 1.808 1.00 0.00 C ATOM 13 OG SER A 2 -23.469 23.189 1.765 1.00 0.00 O ATOM 0 H SER A 2 -24.612 21.147 3.579 1.00 0.00 H new ATOM 0 HA SER A 2 -24.486 20.995 0.652 1.00 0.00 H new ATOM 0 HB2 SER A 2 -22.416 21.731 2.767 1.00 0.00 H new ATOM 0 HB3 SER A 2 -22.146 21.790 1.037 1.00 0.00 H new ATOM 0 HG SER A 2 -22.761 23.853 1.900 1.00 0.00 H new ATOM 19 N SER A 3 -24.170 18.403 1.711 1.00 0.00 N ATOM 20 CA SER A 3 -23.684 17.028 1.698 1.00 0.00 C ATOM 21 C SER A 3 -22.639 16.832 0.603 1.00 0.00 C ATOM 22 O SER A 3 -21.553 16.312 0.853 1.00 0.00 O ATOM 23 CB SER A 3 -24.846 16.056 1.490 1.00 0.00 C ATOM 24 OG SER A 3 -25.635 15.945 2.662 1.00 0.00 O ATOM 0 H SER A 3 -25.178 18.493 1.839 1.00 0.00 H new ATOM 0 HA SER A 3 -23.218 16.824 2.662 1.00 0.00 H new ATOM 0 HB2 SER A 3 -25.466 16.398 0.661 1.00 0.00 H new ATOM 0 HB3 SER A 3 -24.459 15.075 1.214 1.00 0.00 H new ATOM 0 HG SER A 3 -26.372 15.319 2.502 1.00 0.00 H new ATOM 30 N GLY A 4 -22.978 17.253 -0.612 1.00 0.00 N ATOM 31 CA GLY A 4 -22.060 17.114 -1.727 1.00 0.00 C ATOM 32 C GLY A 4 -22.539 17.847 -2.965 1.00 0.00 C ATOM 33 O GLY A 4 -22.875 17.223 -3.972 1.00 0.00 O ATOM 0 H GLY A 4 -23.871 17.687 -0.844 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.081 17.496 -1.438 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -21.933 16.057 -1.960 1.00 0.00 H new ATOM 37 N SER A 5 -22.571 19.173 -2.891 1.00 0.00 N ATOM 38 CA SER A 5 -23.017 19.991 -4.013 1.00 0.00 C ATOM 39 C SER A 5 -21.832 20.444 -4.860 1.00 0.00 C ATOM 40 O SER A 5 -21.310 21.544 -4.679 1.00 0.00 O ATOM 41 CB SER A 5 -23.792 21.209 -3.507 1.00 0.00 C ATOM 42 OG SER A 5 -22.979 22.025 -2.683 1.00 0.00 O ATOM 0 H SER A 5 -22.293 19.704 -2.066 1.00 0.00 H new ATOM 0 HA SER A 5 -23.674 19.383 -4.635 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.155 21.790 -4.354 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.668 20.880 -2.947 1.00 0.00 H new ATOM 0 HG SER A 5 -22.100 22.140 -3.101 1.00 0.00 H new ATOM 48 N SER A 6 -21.412 19.588 -5.786 1.00 0.00 N ATOM 49 CA SER A 6 -20.286 19.897 -6.659 1.00 0.00 C ATOM 50 C SER A 6 -20.177 18.875 -7.787 1.00 0.00 C ATOM 51 O SER A 6 -20.601 17.730 -7.645 1.00 0.00 O ATOM 52 CB SER A 6 -18.984 19.929 -5.856 1.00 0.00 C ATOM 53 OG SER A 6 -18.052 20.827 -6.432 1.00 0.00 O ATOM 0 H SER A 6 -21.835 18.675 -5.951 1.00 0.00 H new ATOM 0 HA SER A 6 -20.457 20.880 -7.098 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.194 20.227 -4.829 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.553 18.929 -5.816 1.00 0.00 H new ATOM 0 HG SER A 6 -17.229 20.831 -5.900 1.00 0.00 H new ATOM 59 N GLY A 7 -19.603 19.300 -8.909 1.00 0.00 N ATOM 60 CA GLY A 7 -19.447 18.411 -10.045 1.00 0.00 C ATOM 61 C GLY A 7 -18.370 17.368 -9.822 1.00 0.00 C ATOM 62 O GLY A 7 -18.650 16.170 -9.816 1.00 0.00 O ATOM 0 H GLY A 7 -19.244 20.244 -9.051 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.395 17.912 -10.245 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.202 18.998 -10.931 1.00 0.00 H new ATOM 66 N MET A 8 -17.135 17.824 -9.638 1.00 0.00 N ATOM 67 CA MET A 8 -16.013 16.920 -9.414 1.00 0.00 C ATOM 68 C MET A 8 -15.285 17.269 -8.120 1.00 0.00 C ATOM 69 O MET A 8 -15.101 18.442 -7.797 1.00 0.00 O ATOM 70 CB MET A 8 -15.039 16.980 -10.593 1.00 0.00 C ATOM 71 CG MET A 8 -15.420 16.062 -11.743 1.00 0.00 C ATOM 72 SD MET A 8 -16.927 16.589 -12.582 1.00 0.00 S ATOM 73 CE MET A 8 -17.174 15.227 -13.719 1.00 0.00 C ATOM 0 H MET A 8 -16.886 18.813 -9.640 1.00 0.00 H new ATOM 0 HA MET A 8 -16.406 15.907 -9.328 1.00 0.00 H new ATOM 0 HB2 MET A 8 -14.987 18.005 -10.959 1.00 0.00 H new ATOM 0 HB3 MET A 8 -14.041 16.716 -10.243 1.00 0.00 H new ATOM 0 HG2 MET A 8 -14.601 16.028 -12.462 1.00 0.00 H new ATOM 0 HG3 MET A 8 -15.555 15.049 -11.365 1.00 0.00 H new ATOM 0 HE1 MET A 8 -18.071 15.406 -14.312 1.00 0.00 H new ATOM 0 HE2 MET A 8 -16.312 15.145 -14.381 1.00 0.00 H new ATOM 0 HE3 MET A 8 -17.289 14.300 -13.157 1.00 0.00 H new ATOM 83 N ASN A 9 -14.872 16.242 -7.383 1.00 0.00 N ATOM 84 CA ASN A 9 -14.165 16.441 -6.123 1.00 0.00 C ATOM 85 C ASN A 9 -13.319 15.219 -5.776 1.00 0.00 C ATOM 86 O ASN A 9 -13.811 14.092 -5.773 1.00 0.00 O ATOM 87 CB ASN A 9 -15.159 16.724 -4.995 1.00 0.00 C ATOM 88 CG ASN A 9 -15.877 15.472 -4.530 1.00 0.00 C ATOM 89 OD1 ASN A 9 -16.297 14.646 -5.340 1.00 0.00 O ATOM 90 ND2 ASN A 9 -16.021 15.326 -3.217 1.00 0.00 N ATOM 0 H ASN A 9 -15.015 15.264 -7.637 1.00 0.00 H new ATOM 0 HA ASN A 9 -13.503 17.299 -6.238 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -14.631 17.171 -4.153 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -15.892 17.455 -5.335 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -16.496 14.504 -2.844 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -15.657 16.036 -2.582 1.00 0.00 H new ATOM 97 N GLY A 10 -12.043 15.453 -5.484 1.00 0.00 N ATOM 98 CA GLY A 10 -11.149 14.364 -5.138 1.00 0.00 C ATOM 99 C GLY A 10 -10.821 14.330 -3.659 1.00 0.00 C ATOM 100 O GLY A 10 -10.290 15.296 -3.112 1.00 0.00 O ATOM 0 H GLY A 10 -11.613 16.378 -5.481 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -11.606 13.417 -5.427 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.226 14.461 -5.709 1.00 0.00 H new ATOM 104 N ARG A 11 -11.138 13.214 -3.009 1.00 0.00 N ATOM 105 CA ARG A 11 -10.876 13.060 -1.584 1.00 0.00 C ATOM 106 C ARG A 11 -9.633 12.207 -1.349 1.00 0.00 C ATOM 107 O ARG A 11 -9.185 11.485 -2.240 1.00 0.00 O ATOM 108 CB ARG A 11 -12.081 12.425 -0.888 1.00 0.00 C ATOM 109 CG ARG A 11 -12.243 12.855 0.562 1.00 0.00 C ATOM 110 CD ARG A 11 -12.694 14.303 0.666 1.00 0.00 C ATOM 111 NE ARG A 11 -14.149 14.426 0.652 1.00 0.00 N ATOM 112 CZ ARG A 11 -14.924 14.105 1.683 1.00 0.00 C ATOM 113 NH1 ARG A 11 -14.385 13.644 2.803 1.00 0.00 N ATOM 114 NH2 ARG A 11 -16.240 14.245 1.594 1.00 0.00 N ATOM 0 H ARG A 11 -11.576 12.404 -3.447 1.00 0.00 H new ATOM 0 HA ARG A 11 -10.702 14.050 -1.163 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -12.986 12.684 -1.438 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -11.983 11.340 -0.928 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.970 12.210 1.055 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -11.297 12.729 1.088 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -12.302 14.739 1.585 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -12.274 14.874 -0.162 1.00 0.00 H new ATOM 0 HE ARG A 11 -14.595 14.777 -0.195 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -13.373 13.535 2.875 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -14.982 13.398 3.593 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -16.658 14.599 0.734 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -16.834 13.998 2.386 1.00 0.00 H new ATOM 128 N VAL A 12 -9.078 12.297 -0.144 1.00 0.00 N ATOM 129 CA VAL A 12 -7.887 11.534 0.208 1.00 0.00 C ATOM 130 C VAL A 12 -8.213 10.444 1.224 1.00 0.00 C ATOM 131 O VAL A 12 -7.319 9.892 1.866 1.00 0.00 O ATOM 132 CB VAL A 12 -6.787 12.445 0.785 1.00 0.00 C ATOM 133 CG1 VAL A 12 -6.991 12.650 2.278 1.00 0.00 C ATOM 134 CG2 VAL A 12 -5.411 11.861 0.502 1.00 0.00 C ATOM 0 H VAL A 12 -9.435 12.891 0.605 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.523 11.074 -0.711 1.00 0.00 H new ATOM 0 HB VAL A 12 -6.852 13.418 0.298 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -6.204 13.296 2.667 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.962 13.115 2.452 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.954 11.686 2.786 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -4.645 12.517 0.916 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.332 10.876 0.962 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -5.268 11.771 -0.575 1.00 0.00 H new ATOM 144 N ASP A 13 -9.498 10.139 1.364 1.00 0.00 N ATOM 145 CA ASP A 13 -9.943 9.114 2.301 1.00 0.00 C ATOM 146 C ASP A 13 -10.143 7.779 1.591 1.00 0.00 C ATOM 147 O ASP A 13 -11.092 7.607 0.825 1.00 0.00 O ATOM 148 CB ASP A 13 -11.244 9.544 2.981 1.00 0.00 C ATOM 149 CG ASP A 13 -11.073 10.795 3.819 1.00 0.00 C ATOM 150 OD1 ASP A 13 -10.169 11.599 3.509 1.00 0.00 O ATOM 151 OD2 ASP A 13 -11.843 10.971 4.786 1.00 0.00 O ATOM 0 H ASP A 13 -10.250 10.587 0.841 1.00 0.00 H new ATOM 0 HA ASP A 13 -9.170 8.990 3.059 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -12.006 9.720 2.222 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -11.605 8.733 3.613 1.00 0.00 H new ATOM 156 N TYR A 14 -9.243 6.837 1.849 1.00 0.00 N ATOM 157 CA TYR A 14 -9.318 5.518 1.232 1.00 0.00 C ATOM 158 C TYR A 14 -8.677 4.461 2.125 1.00 0.00 C ATOM 159 O TYR A 14 -7.586 4.661 2.660 1.00 0.00 O ATOM 160 CB TYR A 14 -8.631 5.531 -0.135 1.00 0.00 C ATOM 161 CG TYR A 14 -7.272 6.194 -0.123 1.00 0.00 C ATOM 162 CD1 TYR A 14 -7.151 7.573 -0.013 1.00 0.00 C ATOM 163 CD2 TYR A 14 -6.109 5.440 -0.223 1.00 0.00 C ATOM 164 CE1 TYR A 14 -5.911 8.183 -0.002 1.00 0.00 C ATOM 165 CE2 TYR A 14 -4.865 6.041 -0.211 1.00 0.00 C ATOM 166 CZ TYR A 14 -4.772 7.412 -0.101 1.00 0.00 C ATOM 167 OH TYR A 14 -3.535 8.015 -0.091 1.00 0.00 O ATOM 0 H TYR A 14 -8.453 6.962 2.481 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.370 5.267 1.100 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -8.523 4.505 -0.488 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -9.272 6.048 -0.850 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -8.041 8.179 0.065 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.179 4.366 -0.312 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -5.834 9.257 0.084 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -3.971 5.440 -0.287 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.837 7.331 -0.168 1.00 0.00 H new ATOM 177 N LEU A 15 -9.362 3.334 2.282 1.00 0.00 N ATOM 178 CA LEU A 15 -8.861 2.242 3.110 1.00 0.00 C ATOM 179 C LEU A 15 -7.707 1.522 2.421 1.00 0.00 C ATOM 180 O LEU A 15 -7.625 1.490 1.193 1.00 0.00 O ATOM 181 CB LEU A 15 -9.985 1.251 3.418 1.00 0.00 C ATOM 182 CG LEU A 15 -10.111 0.062 2.464 1.00 0.00 C ATOM 183 CD1 LEU A 15 -10.149 0.538 1.020 1.00 0.00 C ATOM 184 CD2 LEU A 15 -8.964 -0.915 2.676 1.00 0.00 C ATOM 0 H LEU A 15 -10.266 3.152 1.847 1.00 0.00 H new ATOM 0 HA LEU A 15 -8.494 2.667 4.044 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -9.838 0.867 4.428 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.931 1.793 3.418 1.00 0.00 H new ATOM 0 HG LEU A 15 -11.046 -0.455 2.679 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.239 -0.322 0.356 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -11.004 1.198 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.231 1.079 0.791 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -9.070 -1.755 1.989 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -8.016 -0.410 2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -8.983 -1.281 3.702 1.00 0.00 H new ATOM 196 N VAL A 16 -6.816 0.942 3.220 1.00 0.00 N ATOM 197 CA VAL A 16 -5.668 0.219 2.687 1.00 0.00 C ATOM 198 C VAL A 16 -5.650 -1.224 3.181 1.00 0.00 C ATOM 199 O VAL A 16 -6.131 -1.524 4.275 1.00 0.00 O ATOM 200 CB VAL A 16 -4.344 0.901 3.079 1.00 0.00 C ATOM 201 CG1 VAL A 16 -4.280 2.310 2.510 1.00 0.00 C ATOM 202 CG2 VAL A 16 -4.182 0.920 4.592 1.00 0.00 C ATOM 0 H VAL A 16 -6.868 0.959 4.239 1.00 0.00 H new ATOM 0 HA VAL A 16 -5.765 0.227 1.601 1.00 0.00 H new ATOM 0 HB VAL A 16 -3.520 0.326 2.656 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.337 2.776 2.797 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -4.347 2.267 1.423 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -5.110 2.898 2.901 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -3.241 1.405 4.851 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -5.010 1.470 5.040 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.179 -0.102 4.970 1.00 0.00 H new ATOM 212 N THR A 17 -5.091 -2.115 2.369 1.00 0.00 N ATOM 213 CA THR A 17 -5.010 -3.527 2.722 1.00 0.00 C ATOM 214 C THR A 17 -3.593 -4.059 2.538 1.00 0.00 C ATOM 215 O THR A 17 -3.002 -3.917 1.469 1.00 0.00 O ATOM 216 CB THR A 17 -5.978 -4.374 1.875 1.00 0.00 C ATOM 217 OG1 THR A 17 -5.623 -4.288 0.491 1.00 0.00 O ATOM 218 CG2 THR A 17 -7.414 -3.907 2.066 1.00 0.00 C ATOM 0 H THR A 17 -4.687 -1.884 1.461 1.00 0.00 H new ATOM 0 HA THR A 17 -5.292 -3.607 3.772 1.00 0.00 H new ATOM 0 HB THR A 17 -5.902 -5.410 2.204 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.652 -4.187 0.408 1.00 0.00 H new ATOM 0 HG21 THR A 17 -8.080 -4.520 1.458 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.691 -4.002 3.116 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.501 -2.864 1.761 1.00 0.00 H new ATOM 226 N GLU A 18 -3.056 -4.672 3.588 1.00 0.00 N ATOM 227 CA GLU A 18 -1.708 -5.226 3.541 1.00 0.00 C ATOM 228 C GLU A 18 -1.728 -6.667 3.040 1.00 0.00 C ATOM 229 O GLU A 18 -2.415 -7.520 3.601 1.00 0.00 O ATOM 230 CB GLU A 18 -1.059 -5.165 4.925 1.00 0.00 C ATOM 231 CG GLU A 18 -0.319 -3.866 5.194 1.00 0.00 C ATOM 232 CD GLU A 18 -0.243 -3.532 6.671 1.00 0.00 C ATOM 233 OE1 GLU A 18 0.698 -4.009 7.339 1.00 0.00 O ATOM 234 OE2 GLU A 18 -1.125 -2.795 7.160 1.00 0.00 O ATOM 0 H GLU A 18 -3.533 -4.797 4.481 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.121 -4.626 2.845 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -1.830 -5.298 5.684 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -0.363 -5.998 5.028 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.691 -3.937 4.789 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -0.817 -3.053 4.667 1.00 0.00 H new ATOM 241 N GLU A 19 -0.972 -6.929 1.979 1.00 0.00 N ATOM 242 CA GLU A 19 -0.905 -8.266 1.401 1.00 0.00 C ATOM 243 C GLU A 19 0.523 -8.607 0.982 1.00 0.00 C ATOM 244 O GLU A 19 1.262 -7.746 0.506 1.00 0.00 O ATOM 245 CB GLU A 19 -1.841 -8.373 0.195 1.00 0.00 C ATOM 246 CG GLU A 19 -1.867 -9.755 -0.435 1.00 0.00 C ATOM 247 CD GLU A 19 -2.926 -10.654 0.174 1.00 0.00 C ATOM 248 OE1 GLU A 19 -2.692 -11.177 1.284 1.00 0.00 O ATOM 249 OE2 GLU A 19 -3.986 -10.835 -0.459 1.00 0.00 O ATOM 0 H GLU A 19 -0.398 -6.234 1.502 1.00 0.00 H new ATOM 0 HA GLU A 19 -1.222 -8.979 2.162 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.851 -8.105 0.505 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.535 -7.646 -0.557 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -2.049 -9.659 -1.505 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.889 -10.222 -0.319 1.00 0.00 H new ATOM 256 N GLU A 20 0.901 -9.869 1.162 1.00 0.00 N ATOM 257 CA GLU A 20 2.240 -10.322 0.805 1.00 0.00 C ATOM 258 C GLU A 20 2.205 -11.175 -0.461 1.00 0.00 C ATOM 259 O GLU A 20 1.554 -12.219 -0.501 1.00 0.00 O ATOM 260 CB GLU A 20 2.856 -11.122 1.954 1.00 0.00 C ATOM 261 CG GLU A 20 4.375 -11.148 1.932 1.00 0.00 C ATOM 262 CD GLU A 20 4.972 -11.519 3.276 1.00 0.00 C ATOM 263 OE1 GLU A 20 4.791 -12.677 3.707 1.00 0.00 O ATOM 264 OE2 GLU A 20 5.620 -10.650 3.897 1.00 0.00 O ATOM 0 H GLU A 20 0.300 -10.595 1.552 1.00 0.00 H new ATOM 0 HA GLU A 20 2.855 -9.442 0.614 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.522 -10.698 2.901 1.00 0.00 H new ATOM 0 HB3 GLU A 20 2.483 -12.145 1.914 1.00 0.00 H new ATOM 0 HG2 GLU A 20 4.712 -11.862 1.180 1.00 0.00 H new ATOM 0 HG3 GLU A 20 4.747 -10.169 1.631 1.00 0.00 H new ATOM 271 N ILE A 21 2.910 -10.721 -1.492 1.00 0.00 N ATOM 272 CA ILE A 21 2.960 -11.441 -2.758 1.00 0.00 C ATOM 273 C ILE A 21 4.163 -12.377 -2.811 1.00 0.00 C ATOM 274 O ILE A 21 5.304 -11.931 -2.917 1.00 0.00 O ATOM 275 CB ILE A 21 3.024 -10.473 -3.955 1.00 0.00 C ATOM 276 CG1 ILE A 21 1.822 -9.526 -3.938 1.00 0.00 C ATOM 277 CG2 ILE A 21 3.075 -11.250 -5.262 1.00 0.00 C ATOM 278 CD1 ILE A 21 0.518 -10.199 -4.304 1.00 0.00 C ATOM 0 H ILE A 21 3.454 -9.858 -1.475 1.00 0.00 H new ATOM 0 HA ILE A 21 2.043 -12.027 -2.824 1.00 0.00 H new ATOM 0 HB ILE A 21 3.933 -9.877 -3.874 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.729 -9.088 -2.944 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.006 -8.706 -4.632 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.120 -10.553 -6.098 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.960 -11.887 -5.273 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.182 -11.868 -5.353 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -0.290 -9.468 -4.271 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.592 -10.613 -5.309 1.00 0.00 H new ATOM 0 HD13 ILE A 21 0.311 -11.001 -3.595 1.00 0.00 H new ATOM 290 N ASN A 22 3.898 -13.677 -2.737 1.00 0.00 N ATOM 291 CA ASN A 22 4.959 -14.677 -2.778 1.00 0.00 C ATOM 292 C ASN A 22 5.320 -15.029 -4.218 1.00 0.00 C ATOM 293 O ASN A 22 4.584 -15.746 -4.896 1.00 0.00 O ATOM 294 CB ASN A 22 4.529 -15.938 -2.025 1.00 0.00 C ATOM 295 CG ASN A 22 4.765 -15.829 -0.531 1.00 0.00 C ATOM 296 OD1 ASN A 22 5.449 -16.663 0.063 1.00 0.00 O ATOM 297 ND2 ASN A 22 4.199 -14.797 0.083 1.00 0.00 N ATOM 0 H ASN A 22 2.958 -14.063 -2.648 1.00 0.00 H new ATOM 0 HA ASN A 22 5.840 -14.256 -2.294 1.00 0.00 H new ATOM 0 HB2 ASN A 22 3.471 -16.125 -2.210 1.00 0.00 H new ATOM 0 HB3 ASN A 22 5.078 -16.795 -2.415 1.00 0.00 H new ATOM 0 HD21 ASN A 22 4.323 -14.671 1.088 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.640 -14.130 -0.450 1.00 0.00 H new ATOM 304 N LEU A 23 6.458 -14.520 -4.677 1.00 0.00 N ATOM 305 CA LEU A 23 6.918 -14.780 -6.037 1.00 0.00 C ATOM 306 C LEU A 23 8.183 -15.633 -6.029 1.00 0.00 C ATOM 307 O LEU A 23 8.819 -15.812 -4.990 1.00 0.00 O ATOM 308 CB LEU A 23 7.181 -13.463 -6.769 1.00 0.00 C ATOM 309 CG LEU A 23 6.016 -12.474 -6.810 1.00 0.00 C ATOM 310 CD1 LEU A 23 6.530 -11.050 -6.953 1.00 0.00 C ATOM 311 CD2 LEU A 23 5.065 -12.817 -7.947 1.00 0.00 C ATOM 0 H LEU A 23 7.079 -13.925 -4.128 1.00 0.00 H new ATOM 0 HA LEU A 23 6.135 -15.328 -6.561 1.00 0.00 H new ATOM 0 HB2 LEU A 23 8.032 -12.972 -6.297 1.00 0.00 H new ATOM 0 HB3 LEU A 23 7.473 -13.692 -7.794 1.00 0.00 H new ATOM 0 HG LEU A 23 5.468 -12.548 -5.871 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.687 -10.360 -6.980 1.00 0.00 H new ATOM 0 HD12 LEU A 23 7.170 -10.807 -6.105 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.102 -10.961 -7.876 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.242 -12.103 -7.961 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.601 -12.772 -8.895 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.670 -13.822 -7.800 1.00 0.00 H new ATOM 323 N THR A 24 8.545 -16.156 -7.197 1.00 0.00 N ATOM 324 CA THR A 24 9.734 -16.989 -7.326 1.00 0.00 C ATOM 325 C THR A 24 10.728 -16.379 -8.307 1.00 0.00 C ATOM 326 O THR A 24 10.348 -15.907 -9.378 1.00 0.00 O ATOM 327 CB THR A 24 9.375 -18.412 -7.793 1.00 0.00 C ATOM 328 OG1 THR A 24 8.516 -19.040 -6.835 1.00 0.00 O ATOM 329 CG2 THR A 24 10.630 -19.251 -7.984 1.00 0.00 C ATOM 0 H THR A 24 8.031 -16.017 -8.067 1.00 0.00 H new ATOM 0 HA THR A 24 10.191 -17.044 -6.338 1.00 0.00 H new ATOM 0 HB THR A 24 8.858 -18.337 -8.750 1.00 0.00 H new ATOM 0 HG1 THR A 24 8.291 -19.944 -7.140 1.00 0.00 H new ATOM 0 HG21 THR A 24 10.352 -20.252 -8.314 1.00 0.00 H new ATOM 0 HG22 THR A 24 11.268 -18.786 -8.735 1.00 0.00 H new ATOM 0 HG23 THR A 24 11.170 -19.317 -7.040 1.00 0.00 H new ATOM 337 N ARG A 25 12.004 -16.393 -7.935 1.00 0.00 N ATOM 338 CA ARG A 25 13.053 -15.840 -8.783 1.00 0.00 C ATOM 339 C ARG A 25 13.264 -16.706 -10.021 1.00 0.00 C ATOM 340 O ARG A 25 13.410 -17.924 -9.923 1.00 0.00 O ATOM 341 CB ARG A 25 14.363 -15.724 -8.000 1.00 0.00 C ATOM 342 CG ARG A 25 15.438 -14.932 -8.726 1.00 0.00 C ATOM 343 CD ARG A 25 16.832 -15.393 -8.330 1.00 0.00 C ATOM 344 NE ARG A 25 17.024 -16.821 -8.564 1.00 0.00 N ATOM 345 CZ ARG A 25 18.197 -17.434 -8.451 1.00 0.00 C ATOM 346 NH1 ARG A 25 19.278 -16.746 -8.107 1.00 0.00 N ATOM 347 NH2 ARG A 25 18.292 -18.737 -8.680 1.00 0.00 N ATOM 0 H ARG A 25 12.336 -16.781 -7.052 1.00 0.00 H new ATOM 0 HA ARG A 25 12.740 -14.847 -9.104 1.00 0.00 H new ATOM 0 HB2 ARG A 25 14.161 -15.251 -7.039 1.00 0.00 H new ATOM 0 HB3 ARG A 25 14.741 -16.725 -7.789 1.00 0.00 H new ATOM 0 HG2 ARG A 25 15.309 -15.043 -9.803 1.00 0.00 H new ATOM 0 HG3 ARG A 25 15.326 -13.872 -8.499 1.00 0.00 H new ATOM 0 HD2 ARG A 25 17.574 -14.830 -8.896 1.00 0.00 H new ATOM 0 HD3 ARG A 25 17.001 -15.173 -7.276 1.00 0.00 H new ATOM 0 HE ARG A 25 16.212 -17.379 -8.829 1.00 0.00 H new ATOM 0 HH11 ARG A 25 19.209 -15.744 -7.929 1.00 0.00 H new ATOM 0 HH12 ARG A 25 20.178 -17.219 -8.021 1.00 0.00 H new ATOM 0 HH21 ARG A 25 17.463 -19.270 -8.943 1.00 0.00 H new ATOM 0 HH22 ARG A 25 19.194 -19.206 -8.593 1.00 0.00 H new ATOM 361 N GLY A 26 13.276 -16.069 -11.188 1.00 0.00 N ATOM 362 CA GLY A 26 13.468 -16.796 -12.429 1.00 0.00 C ATOM 363 C GLY A 26 14.933 -16.985 -12.770 1.00 0.00 C ATOM 364 O GLY A 26 15.795 -17.038 -11.892 1.00 0.00 O ATOM 0 H GLY A 26 13.156 -15.062 -11.296 1.00 0.00 H new ATOM 0 HA2 GLY A 26 12.987 -17.771 -12.353 1.00 0.00 H new ATOM 0 HA3 GLY A 26 12.976 -16.260 -13.240 1.00 0.00 H new ATOM 368 N PRO A 27 15.232 -17.091 -14.073 1.00 0.00 N ATOM 369 CA PRO A 27 16.603 -17.278 -14.558 1.00 0.00 C ATOM 370 C PRO A 27 17.462 -16.033 -14.362 1.00 0.00 C ATOM 371 O PRO A 27 18.644 -16.129 -14.031 1.00 0.00 O ATOM 372 CB PRO A 27 16.416 -17.569 -16.049 1.00 0.00 C ATOM 373 CG PRO A 27 15.119 -16.925 -16.400 1.00 0.00 C ATOM 374 CD PRO A 27 14.256 -17.036 -15.174 1.00 0.00 C ATOM 0 HA PRO A 27 17.122 -18.070 -14.017 1.00 0.00 H new ATOM 0 HB2 PRO A 27 17.235 -17.157 -16.639 1.00 0.00 H new ATOM 0 HB3 PRO A 27 16.391 -18.641 -16.243 1.00 0.00 H new ATOM 0 HG2 PRO A 27 15.265 -15.882 -16.681 1.00 0.00 H new ATOM 0 HG3 PRO A 27 14.654 -17.423 -17.251 1.00 0.00 H new ATOM 0 HD2 PRO A 27 13.587 -16.181 -15.075 1.00 0.00 H new ATOM 0 HD3 PRO A 27 13.631 -17.929 -15.202 1.00 0.00 H new ATOM 382 N SER A 28 16.860 -14.866 -14.567 1.00 0.00 N ATOM 383 CA SER A 28 17.571 -13.602 -14.415 1.00 0.00 C ATOM 384 C SER A 28 16.759 -12.618 -13.579 1.00 0.00 C ATOM 385 O SER A 28 15.826 -11.987 -14.074 1.00 0.00 O ATOM 386 CB SER A 28 17.873 -12.995 -15.787 1.00 0.00 C ATOM 387 OG SER A 28 18.643 -11.812 -15.663 1.00 0.00 O ATOM 0 H SER A 28 15.882 -14.770 -14.839 1.00 0.00 H new ATOM 0 HA SER A 28 18.510 -13.802 -13.898 1.00 0.00 H new ATOM 0 HB2 SER A 28 18.410 -13.720 -16.399 1.00 0.00 H new ATOM 0 HB3 SER A 28 16.939 -12.772 -16.303 1.00 0.00 H new ATOM 0 HG SER A 28 18.824 -11.445 -16.553 1.00 0.00 H new ATOM 393 N GLY A 29 17.121 -12.494 -12.305 1.00 0.00 N ATOM 394 CA GLY A 29 16.417 -11.586 -11.419 1.00 0.00 C ATOM 395 C GLY A 29 14.914 -11.784 -11.461 1.00 0.00 C ATOM 396 O GLY A 29 14.433 -12.887 -11.722 1.00 0.00 O ATOM 0 H GLY A 29 17.889 -13.006 -11.871 1.00 0.00 H new ATOM 0 HA2 GLY A 29 16.771 -11.731 -10.398 1.00 0.00 H new ATOM 0 HA3 GLY A 29 16.653 -10.558 -11.695 1.00 0.00 H new ATOM 400 N LEU A 30 14.171 -10.713 -11.203 1.00 0.00 N ATOM 401 CA LEU A 30 12.714 -10.774 -11.211 1.00 0.00 C ATOM 402 C LEU A 30 12.158 -10.355 -12.568 1.00 0.00 C ATOM 403 O LEU A 30 12.912 -10.094 -13.505 1.00 0.00 O ATOM 404 CB LEU A 30 12.140 -9.876 -10.113 1.00 0.00 C ATOM 405 CG LEU A 30 12.468 -10.281 -8.676 1.00 0.00 C ATOM 406 CD1 LEU A 30 12.330 -9.089 -7.741 1.00 0.00 C ATOM 407 CD2 LEU A 30 11.567 -11.421 -8.224 1.00 0.00 C ATOM 0 H LEU A 30 14.554 -9.793 -10.986 1.00 0.00 H new ATOM 0 HA LEU A 30 12.418 -11.806 -11.021 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.503 -8.861 -10.275 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.056 -9.849 -10.223 1.00 0.00 H new ATOM 0 HG LEU A 30 13.502 -10.626 -8.643 1.00 0.00 H new ATOM 0 HD11 LEU A 30 12.567 -9.396 -6.722 1.00 0.00 H new ATOM 0 HD12 LEU A 30 13.016 -8.301 -8.052 1.00 0.00 H new ATOM 0 HD13 LEU A 30 11.307 -8.714 -7.778 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.815 -11.696 -7.199 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.526 -11.103 -8.273 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.714 -12.282 -8.876 1.00 0.00 H new ATOM 419 N GLY A 31 10.834 -10.292 -12.667 1.00 0.00 N ATOM 420 CA GLY A 31 10.200 -9.902 -13.913 1.00 0.00 C ATOM 421 C GLY A 31 9.393 -8.626 -13.778 1.00 0.00 C ATOM 422 O GLY A 31 8.285 -8.526 -14.305 1.00 0.00 O ATOM 0 H GLY A 31 10.189 -10.504 -11.906 1.00 0.00 H new ATOM 0 HA2 GLY A 31 10.964 -9.766 -14.679 1.00 0.00 H new ATOM 0 HA3 GLY A 31 9.548 -10.707 -14.253 1.00 0.00 H new ATOM 426 N PHE A 32 9.947 -7.649 -13.069 1.00 0.00 N ATOM 427 CA PHE A 32 9.270 -6.374 -12.864 1.00 0.00 C ATOM 428 C PHE A 32 10.239 -5.323 -12.331 1.00 0.00 C ATOM 429 O PHE A 32 11.122 -5.626 -11.530 1.00 0.00 O ATOM 430 CB PHE A 32 8.100 -6.544 -11.892 1.00 0.00 C ATOM 431 CG PHE A 32 8.521 -6.978 -10.517 1.00 0.00 C ATOM 432 CD1 PHE A 32 8.832 -6.041 -9.545 1.00 0.00 C ATOM 433 CD2 PHE A 32 8.605 -8.323 -10.197 1.00 0.00 C ATOM 434 CE1 PHE A 32 9.220 -6.438 -8.280 1.00 0.00 C ATOM 435 CE2 PHE A 32 8.992 -8.726 -8.932 1.00 0.00 C ATOM 436 CZ PHE A 32 9.299 -7.782 -7.972 1.00 0.00 C ATOM 0 H PHE A 32 10.864 -7.716 -12.626 1.00 0.00 H new ATOM 0 HA PHE A 32 8.888 -6.035 -13.827 1.00 0.00 H new ATOM 0 HB2 PHE A 32 7.560 -5.600 -11.817 1.00 0.00 H new ATOM 0 HB3 PHE A 32 7.404 -7.278 -12.299 1.00 0.00 H new ATOM 0 HD1 PHE A 32 8.770 -4.988 -9.779 1.00 0.00 H new ATOM 0 HD2 PHE A 32 8.366 -9.065 -10.944 1.00 0.00 H new ATOM 0 HE1 PHE A 32 9.462 -5.697 -7.532 1.00 0.00 H new ATOM 0 HE2 PHE A 32 9.054 -9.778 -8.695 1.00 0.00 H new ATOM 0 HZ PHE A 32 9.600 -8.094 -6.983 1.00 0.00 H new ATOM 446 N ASN A 33 10.067 -4.085 -12.783 1.00 0.00 N ATOM 447 CA ASN A 33 10.927 -2.988 -12.353 1.00 0.00 C ATOM 448 C ASN A 33 10.336 -2.276 -11.140 1.00 0.00 C ATOM 449 O ASN A 33 9.118 -2.239 -10.962 1.00 0.00 O ATOM 450 CB ASN A 33 11.126 -1.990 -13.497 1.00 0.00 C ATOM 451 CG ASN A 33 12.068 -0.862 -13.122 1.00 0.00 C ATOM 452 OD1 ASN A 33 11.742 -0.019 -12.286 1.00 0.00 O ATOM 453 ND2 ASN A 33 13.242 -0.842 -13.741 1.00 0.00 N ATOM 0 H ASN A 33 9.340 -3.816 -13.447 1.00 0.00 H new ATOM 0 HA ASN A 33 11.893 -3.406 -12.071 1.00 0.00 H new ATOM 0 HB2 ASN A 33 11.519 -2.514 -14.368 1.00 0.00 H new ATOM 0 HB3 ASN A 33 10.161 -1.573 -13.784 1.00 0.00 H new ATOM 0 HD21 ASN A 33 13.917 -0.107 -13.531 1.00 0.00 H new ATOM 0 HD22 ASN A 33 13.469 -1.562 -14.427 1.00 0.00 H new ATOM 460 N ILE A 34 11.206 -1.713 -10.309 1.00 0.00 N ATOM 461 CA ILE A 34 10.770 -1.001 -9.114 1.00 0.00 C ATOM 462 C ILE A 34 11.343 0.412 -9.076 1.00 0.00 C ATOM 463 O ILE A 34 12.332 0.711 -9.746 1.00 0.00 O ATOM 464 CB ILE A 34 11.186 -1.746 -7.832 1.00 0.00 C ATOM 465 CG1 ILE A 34 12.650 -2.184 -7.923 1.00 0.00 C ATOM 466 CG2 ILE A 34 10.282 -2.947 -7.600 1.00 0.00 C ATOM 467 CD1 ILE A 34 13.259 -2.537 -6.584 1.00 0.00 C ATOM 0 H ILE A 34 12.217 -1.736 -10.441 1.00 0.00 H new ATOM 0 HA ILE A 34 9.682 -0.948 -9.157 1.00 0.00 H new ATOM 0 HB ILE A 34 11.081 -1.068 -6.985 1.00 0.00 H new ATOM 0 HG12 ILE A 34 12.722 -3.047 -8.585 1.00 0.00 H new ATOM 0 HG13 ILE A 34 13.233 -1.383 -8.378 1.00 0.00 H new ATOM 0 HG21 ILE A 34 10.589 -3.463 -6.690 1.00 0.00 H new ATOM 0 HG22 ILE A 34 9.250 -2.611 -7.496 1.00 0.00 H new ATOM 0 HG23 ILE A 34 10.358 -3.629 -8.447 1.00 0.00 H new ATOM 0 HD11 ILE A 34 14.297 -2.838 -6.724 1.00 0.00 H new ATOM 0 HD12 ILE A 34 13.219 -1.669 -5.926 1.00 0.00 H new ATOM 0 HD13 ILE A 34 12.700 -3.359 -6.135 1.00 0.00 H new ATOM 479 N VAL A 35 10.715 1.278 -8.287 1.00 0.00 N ATOM 480 CA VAL A 35 11.163 2.659 -8.159 1.00 0.00 C ATOM 481 C VAL A 35 11.308 3.056 -6.694 1.00 0.00 C ATOM 482 O VAL A 35 10.344 3.016 -5.931 1.00 0.00 O ATOM 483 CB VAL A 35 10.188 3.632 -8.849 1.00 0.00 C ATOM 484 CG1 VAL A 35 10.255 3.473 -10.360 1.00 0.00 C ATOM 485 CG2 VAL A 35 8.770 3.412 -8.344 1.00 0.00 C ATOM 0 H VAL A 35 9.894 1.047 -7.727 1.00 0.00 H new ATOM 0 HA VAL A 35 12.135 2.723 -8.648 1.00 0.00 H new ATOM 0 HB VAL A 35 10.483 4.652 -8.602 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.560 4.168 -10.830 1.00 0.00 H new ATOM 0 HG12 VAL A 35 11.268 3.685 -10.704 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.986 2.452 -10.631 1.00 0.00 H new ATOM 0 HG21 VAL A 35 8.094 4.108 -8.842 1.00 0.00 H new ATOM 0 HG22 VAL A 35 8.461 2.389 -8.560 1.00 0.00 H new ATOM 0 HG23 VAL A 35 8.737 3.581 -7.268 1.00 0.00 H new ATOM 495 N GLY A 36 12.521 3.440 -6.308 1.00 0.00 N ATOM 496 CA GLY A 36 12.771 3.839 -4.935 1.00 0.00 C ATOM 497 C GLY A 36 14.151 4.436 -4.747 1.00 0.00 C ATOM 498 O GLY A 36 14.934 4.517 -5.692 1.00 0.00 O ATOM 0 H GLY A 36 13.335 3.482 -6.921 1.00 0.00 H new ATOM 0 HA2 GLY A 36 12.019 4.566 -4.629 1.00 0.00 H new ATOM 0 HA3 GLY A 36 12.661 2.973 -4.282 1.00 0.00 H new ATOM 502 N GLY A 37 14.451 4.856 -3.521 1.00 0.00 N ATOM 503 CA GLY A 37 15.746 5.445 -3.235 1.00 0.00 C ATOM 504 C GLY A 37 15.655 6.928 -2.932 1.00 0.00 C ATOM 505 O GLY A 37 15.287 7.725 -3.796 1.00 0.00 O ATOM 0 H GLY A 37 13.820 4.799 -2.721 1.00 0.00 H new ATOM 0 HA2 GLY A 37 16.196 4.931 -2.386 1.00 0.00 H new ATOM 0 HA3 GLY A 37 16.408 5.292 -4.087 1.00 0.00 H new ATOM 509 N THR A 38 15.989 7.300 -1.701 1.00 0.00 N ATOM 510 CA THR A 38 15.941 8.696 -1.285 1.00 0.00 C ATOM 511 C THR A 38 16.418 9.619 -2.401 1.00 0.00 C ATOM 512 O THR A 38 16.033 10.787 -2.461 1.00 0.00 O ATOM 513 CB THR A 38 16.801 8.939 -0.030 1.00 0.00 C ATOM 514 OG1 THR A 38 18.111 8.394 -0.221 1.00 0.00 O ATOM 515 CG2 THR A 38 16.158 8.310 1.196 1.00 0.00 C ATOM 0 H THR A 38 16.296 6.654 -0.974 1.00 0.00 H new ATOM 0 HA THR A 38 14.900 8.920 -1.052 1.00 0.00 H new ATOM 0 HB THR A 38 16.876 10.015 0.130 1.00 0.00 H new ATOM 0 HG1 THR A 38 18.652 8.554 0.580 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.783 8.495 2.070 1.00 0.00 H new ATOM 0 HG22 THR A 38 15.173 8.748 1.355 1.00 0.00 H new ATOM 0 HG23 THR A 38 16.057 7.236 1.043 1.00 0.00 H new ATOM 523 N ASP A 39 17.258 9.088 -3.282 1.00 0.00 N ATOM 524 CA ASP A 39 17.786 9.865 -4.398 1.00 0.00 C ATOM 525 C ASP A 39 16.954 9.643 -5.657 1.00 0.00 C ATOM 526 O ASP A 39 16.725 10.571 -6.431 1.00 0.00 O ATOM 527 CB ASP A 39 19.245 9.488 -4.663 1.00 0.00 C ATOM 528 CG ASP A 39 19.846 10.274 -5.812 1.00 0.00 C ATOM 529 OD1 ASP A 39 19.626 11.502 -5.870 1.00 0.00 O ATOM 530 OD2 ASP A 39 20.536 9.661 -6.654 1.00 0.00 O ATOM 0 H ASP A 39 17.588 8.124 -3.246 1.00 0.00 H new ATOM 0 HA ASP A 39 17.733 10.921 -4.131 1.00 0.00 H new ATOM 0 HB2 ASP A 39 19.832 9.662 -3.761 1.00 0.00 H new ATOM 0 HB3 ASP A 39 19.308 8.422 -4.883 1.00 0.00 H new ATOM 535 N GLN A 40 16.506 8.407 -5.854 1.00 0.00 N ATOM 536 CA GLN A 40 15.701 8.064 -7.020 1.00 0.00 C ATOM 537 C GLN A 40 14.218 8.024 -6.665 1.00 0.00 C ATOM 538 O GLN A 40 13.416 7.428 -7.382 1.00 0.00 O ATOM 539 CB GLN A 40 16.138 6.713 -7.588 1.00 0.00 C ATOM 540 CG GLN A 40 17.475 6.760 -8.311 1.00 0.00 C ATOM 541 CD GLN A 40 17.329 7.069 -9.788 1.00 0.00 C ATOM 542 OE1 GLN A 40 16.863 8.145 -10.166 1.00 0.00 O ATOM 543 NE2 GLN A 40 17.728 6.125 -10.633 1.00 0.00 N ATOM 0 H GLN A 40 16.687 7.627 -5.222 1.00 0.00 H new ATOM 0 HA GLN A 40 15.854 8.835 -7.775 1.00 0.00 H new ATOM 0 HB2 GLN A 40 16.199 5.989 -6.775 1.00 0.00 H new ATOM 0 HB3 GLN A 40 15.374 6.354 -8.278 1.00 0.00 H new ATOM 0 HG2 GLN A 40 18.109 7.516 -7.847 1.00 0.00 H new ATOM 0 HG3 GLN A 40 17.982 5.802 -8.192 1.00 0.00 H new ATOM 0 HE21 GLN A 40 18.108 5.248 -10.276 1.00 0.00 H new ATOM 0 HE22 GLN A 40 17.654 6.277 -11.639 1.00 0.00 H new ATOM 552 N GLN A 41 13.863 8.663 -5.555 1.00 0.00 N ATOM 553 CA GLN A 41 12.477 8.699 -5.105 1.00 0.00 C ATOM 554 C GLN A 41 11.529 8.918 -6.280 1.00 0.00 C ATOM 555 O GLN A 41 11.595 9.941 -6.961 1.00 0.00 O ATOM 556 CB GLN A 41 12.284 9.804 -4.066 1.00 0.00 C ATOM 557 CG GLN A 41 13.010 9.541 -2.757 1.00 0.00 C ATOM 558 CD GLN A 41 12.814 10.655 -1.747 1.00 0.00 C ATOM 559 OE1 GLN A 41 13.762 11.089 -1.092 1.00 0.00 O ATOM 560 NE2 GLN A 41 11.579 11.124 -1.615 1.00 0.00 N ATOM 0 H GLN A 41 14.516 9.163 -4.951 1.00 0.00 H new ATOM 0 HA GLN A 41 12.245 7.737 -4.648 1.00 0.00 H new ATOM 0 HB2 GLN A 41 12.634 10.748 -4.483 1.00 0.00 H new ATOM 0 HB3 GLN A 41 11.219 9.920 -3.864 1.00 0.00 H new ATOM 0 HG2 GLN A 41 12.655 8.603 -2.331 1.00 0.00 H new ATOM 0 HG3 GLN A 41 14.075 9.418 -2.955 1.00 0.00 H new ATOM 0 HE21 GLN A 41 10.823 10.735 -2.178 1.00 0.00 H new ATOM 0 HE22 GLN A 41 11.386 11.873 -0.950 1.00 0.00 H new ATOM 569 N TYR A 42 10.648 7.951 -6.511 1.00 0.00 N ATOM 570 CA TYR A 42 9.688 8.037 -7.606 1.00 0.00 C ATOM 571 C TYR A 42 8.997 9.397 -7.618 1.00 0.00 C ATOM 572 O TYR A 42 8.607 9.899 -8.672 1.00 0.00 O ATOM 573 CB TYR A 42 8.646 6.924 -7.487 1.00 0.00 C ATOM 574 CG TYR A 42 7.862 6.690 -8.758 1.00 0.00 C ATOM 575 CD1 TYR A 42 8.469 6.141 -9.881 1.00 0.00 C ATOM 576 CD2 TYR A 42 6.514 7.018 -8.836 1.00 0.00 C ATOM 577 CE1 TYR A 42 7.756 5.926 -11.045 1.00 0.00 C ATOM 578 CE2 TYR A 42 5.793 6.805 -9.995 1.00 0.00 C ATOM 579 CZ TYR A 42 6.419 6.260 -11.097 1.00 0.00 C ATOM 580 OH TYR A 42 5.705 6.046 -12.254 1.00 0.00 O ATOM 0 H TYR A 42 10.578 7.099 -5.955 1.00 0.00 H new ATOM 0 HA TYR A 42 10.232 7.917 -8.543 1.00 0.00 H new ATOM 0 HB2 TYR A 42 9.146 5.998 -7.203 1.00 0.00 H new ATOM 0 HB3 TYR A 42 7.953 7.171 -6.683 1.00 0.00 H new ATOM 0 HD1 TYR A 42 9.516 5.878 -9.843 1.00 0.00 H new ATOM 0 HD2 TYR A 42 6.021 7.447 -7.976 1.00 0.00 H new ATOM 0 HE1 TYR A 42 8.243 5.499 -11.909 1.00 0.00 H new ATOM 0 HE2 TYR A 42 4.745 7.064 -10.038 1.00 0.00 H new ATOM 0 HH TYR A 42 4.777 6.334 -12.124 1.00 0.00 H new ATOM 590 N VAL A 43 8.849 9.989 -6.437 1.00 0.00 N ATOM 591 CA VAL A 43 8.207 11.292 -6.310 1.00 0.00 C ATOM 592 C VAL A 43 8.678 12.017 -5.055 1.00 0.00 C ATOM 593 O VAL A 43 9.154 11.393 -4.106 1.00 0.00 O ATOM 594 CB VAL A 43 6.673 11.160 -6.269 1.00 0.00 C ATOM 595 CG1 VAL A 43 6.013 12.454 -6.719 1.00 0.00 C ATOM 596 CG2 VAL A 43 6.216 9.991 -7.129 1.00 0.00 C ATOM 0 H VAL A 43 9.165 9.587 -5.555 1.00 0.00 H new ATOM 0 HA VAL A 43 8.491 11.872 -7.188 1.00 0.00 H new ATOM 0 HB VAL A 43 6.370 10.965 -5.240 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.929 12.341 -6.683 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.315 13.266 -6.058 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.320 12.684 -7.739 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.130 9.912 -7.088 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.530 10.153 -8.160 1.00 0.00 H new ATOM 0 HG23 VAL A 43 6.661 9.069 -6.755 1.00 0.00 H new ATOM 606 N SER A 44 8.541 13.339 -5.055 1.00 0.00 N ATOM 607 CA SER A 44 8.956 14.151 -3.917 1.00 0.00 C ATOM 608 C SER A 44 8.350 13.619 -2.621 1.00 0.00 C ATOM 609 O SER A 44 9.019 13.557 -1.590 1.00 0.00 O ATOM 610 CB SER A 44 8.543 15.609 -4.125 1.00 0.00 C ATOM 611 OG SER A 44 9.226 16.180 -5.228 1.00 0.00 O ATOM 0 H SER A 44 8.146 13.871 -5.831 1.00 0.00 H new ATOM 0 HA SER A 44 10.042 14.096 -3.840 1.00 0.00 H new ATOM 0 HB2 SER A 44 7.467 15.665 -4.291 1.00 0.00 H new ATOM 0 HB3 SER A 44 8.757 16.183 -3.224 1.00 0.00 H new ATOM 0 HG SER A 44 8.943 17.112 -5.341 1.00 0.00 H new ATOM 617 N ASN A 45 7.079 13.237 -2.683 1.00 0.00 N ATOM 618 CA ASN A 45 6.382 12.710 -1.515 1.00 0.00 C ATOM 619 C ASN A 45 6.367 11.185 -1.531 1.00 0.00 C ATOM 620 O ASN A 45 5.765 10.550 -0.665 1.00 0.00 O ATOM 621 CB ASN A 45 4.949 13.244 -1.468 1.00 0.00 C ATOM 622 CG ASN A 45 4.215 12.822 -0.209 1.00 0.00 C ATOM 623 OD1 ASN A 45 3.516 11.809 -0.196 1.00 0.00 O ATOM 624 ND2 ASN A 45 4.373 13.599 0.856 1.00 0.00 N ATOM 0 H ASN A 45 6.511 13.282 -3.529 1.00 0.00 H new ATOM 0 HA ASN A 45 6.917 13.040 -0.624 1.00 0.00 H new ATOM 0 HB2 ASN A 45 4.968 14.332 -1.527 1.00 0.00 H new ATOM 0 HB3 ASN A 45 4.402 12.887 -2.341 1.00 0.00 H new ATOM 0 HD21 ASN A 45 3.905 13.365 1.732 1.00 0.00 H new ATOM 0 HD22 ASN A 45 4.963 14.429 0.799 1.00 0.00 H new ATOM 631 N ASP A 46 7.035 10.603 -2.522 1.00 0.00 N ATOM 632 CA ASP A 46 7.101 9.152 -2.651 1.00 0.00 C ATOM 633 C ASP A 46 8.549 8.672 -2.654 1.00 0.00 C ATOM 634 O ASP A 46 9.287 8.901 -3.611 1.00 0.00 O ATOM 635 CB ASP A 46 6.398 8.700 -3.932 1.00 0.00 C ATOM 636 CG ASP A 46 6.202 7.198 -3.985 1.00 0.00 C ATOM 637 OD1 ASP A 46 7.213 6.469 -4.054 1.00 0.00 O ATOM 638 OD2 ASP A 46 5.036 6.751 -3.958 1.00 0.00 O ATOM 0 H ASP A 46 7.538 11.114 -3.247 1.00 0.00 H new ATOM 0 HA ASP A 46 6.593 8.712 -1.793 1.00 0.00 H new ATOM 0 HB2 ASP A 46 5.428 9.193 -4.004 1.00 0.00 H new ATOM 0 HB3 ASP A 46 6.982 9.018 -4.795 1.00 0.00 H new ATOM 643 N SER A 47 8.948 8.007 -1.575 1.00 0.00 N ATOM 644 CA SER A 47 10.309 7.499 -1.450 1.00 0.00 C ATOM 645 C SER A 47 10.310 5.983 -1.271 1.00 0.00 C ATOM 646 O SER A 47 11.330 5.324 -1.464 1.00 0.00 O ATOM 647 CB SER A 47 11.019 8.163 -0.269 1.00 0.00 C ATOM 648 OG SER A 47 10.221 8.108 0.901 1.00 0.00 O ATOM 0 H SER A 47 8.348 7.807 -0.775 1.00 0.00 H new ATOM 0 HA SER A 47 10.845 7.740 -2.368 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.972 7.666 -0.087 1.00 0.00 H new ATOM 0 HB3 SER A 47 11.243 9.202 -0.512 1.00 0.00 H new ATOM 0 HG SER A 47 10.697 8.537 1.642 1.00 0.00 H new ATOM 654 N GLY A 48 9.155 5.437 -0.900 1.00 0.00 N ATOM 655 CA GLY A 48 9.043 4.004 -0.701 1.00 0.00 C ATOM 656 C GLY A 48 9.408 3.216 -1.942 1.00 0.00 C ATOM 657 O GLY A 48 9.711 3.794 -2.986 1.00 0.00 O ATOM 0 H GLY A 48 8.296 5.961 -0.734 1.00 0.00 H new ATOM 0 HA2 GLY A 48 9.692 3.703 0.121 1.00 0.00 H new ATOM 0 HA3 GLY A 48 8.022 3.760 -0.407 1.00 0.00 H new ATOM 661 N ILE A 49 9.381 1.892 -1.830 1.00 0.00 N ATOM 662 CA ILE A 49 9.712 1.023 -2.952 1.00 0.00 C ATOM 663 C ILE A 49 8.453 0.550 -3.672 1.00 0.00 C ATOM 664 O ILE A 49 7.726 -0.309 -3.172 1.00 0.00 O ATOM 665 CB ILE A 49 10.520 -0.205 -2.495 1.00 0.00 C ATOM 666 CG1 ILE A 49 11.717 0.232 -1.648 1.00 0.00 C ATOM 667 CG2 ILE A 49 10.982 -1.013 -3.698 1.00 0.00 C ATOM 668 CD1 ILE A 49 12.629 1.213 -2.350 1.00 0.00 C ATOM 0 H ILE A 49 9.133 1.398 -0.973 1.00 0.00 H new ATOM 0 HA ILE A 49 10.320 1.613 -3.638 1.00 0.00 H new ATOM 0 HB ILE A 49 9.877 -0.838 -1.883 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.353 0.683 -0.725 1.00 0.00 H new ATOM 0 HG13 ILE A 49 12.293 -0.649 -1.366 1.00 0.00 H new ATOM 0 HG21 ILE A 49 11.552 -1.878 -3.358 1.00 0.00 H new ATOM 0 HG22 ILE A 49 10.114 -1.350 -4.265 1.00 0.00 H new ATOM 0 HG23 ILE A 49 11.611 -0.391 -4.334 1.00 0.00 H new ATOM 0 HD11 ILE A 49 13.455 1.478 -1.690 1.00 0.00 H new ATOM 0 HD12 ILE A 49 13.022 0.758 -3.259 1.00 0.00 H new ATOM 0 HD13 ILE A 49 12.068 2.111 -2.608 1.00 0.00 H new ATOM 680 N TYR A 50 8.203 1.115 -4.847 1.00 0.00 N ATOM 681 CA TYR A 50 7.031 0.752 -5.636 1.00 0.00 C ATOM 682 C TYR A 50 7.438 0.010 -6.905 1.00 0.00 C ATOM 683 O TYR A 50 8.618 -0.259 -7.131 1.00 0.00 O ATOM 684 CB TYR A 50 6.227 2.002 -5.998 1.00 0.00 C ATOM 685 CG TYR A 50 5.789 2.809 -4.797 1.00 0.00 C ATOM 686 CD1 TYR A 50 6.694 3.597 -4.097 1.00 0.00 C ATOM 687 CD2 TYR A 50 4.469 2.785 -4.363 1.00 0.00 C ATOM 688 CE1 TYR A 50 6.299 4.335 -2.999 1.00 0.00 C ATOM 689 CE2 TYR A 50 4.064 3.522 -3.267 1.00 0.00 C ATOM 690 CZ TYR A 50 4.983 4.295 -2.588 1.00 0.00 C ATOM 691 OH TYR A 50 4.585 5.030 -1.495 1.00 0.00 O ATOM 0 H TYR A 50 8.796 1.826 -5.275 1.00 0.00 H new ATOM 0 HA TYR A 50 6.409 0.090 -5.033 1.00 0.00 H new ATOM 0 HB2 TYR A 50 6.829 2.635 -6.650 1.00 0.00 H new ATOM 0 HB3 TYR A 50 5.346 1.705 -6.567 1.00 0.00 H new ATOM 0 HD1 TYR A 50 7.725 3.633 -4.417 1.00 0.00 H new ATOM 0 HD2 TYR A 50 3.747 2.180 -4.892 1.00 0.00 H new ATOM 0 HE1 TYR A 50 7.017 4.940 -2.465 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.034 3.493 -2.944 1.00 0.00 H new ATOM 0 HH TYR A 50 3.627 4.892 -1.339 1.00 0.00 H new ATOM 701 N VAL A 51 6.450 -0.319 -7.733 1.00 0.00 N ATOM 702 CA VAL A 51 6.703 -1.028 -8.981 1.00 0.00 C ATOM 703 C VAL A 51 6.454 -0.128 -10.185 1.00 0.00 C ATOM 704 O VAL A 51 5.342 0.357 -10.391 1.00 0.00 O ATOM 705 CB VAL A 51 5.820 -2.284 -9.101 1.00 0.00 C ATOM 706 CG1 VAL A 51 6.143 -3.044 -10.379 1.00 0.00 C ATOM 707 CG2 VAL A 51 5.994 -3.177 -7.882 1.00 0.00 C ATOM 0 H VAL A 51 5.468 -0.105 -7.561 1.00 0.00 H new ATOM 0 HA VAL A 51 7.751 -1.329 -8.967 1.00 0.00 H new ATOM 0 HB VAL A 51 4.777 -1.970 -9.147 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.509 -3.928 -10.446 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.962 -2.401 -11.240 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.190 -3.348 -10.367 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.362 -4.059 -7.984 1.00 0.00 H new ATOM 0 HG22 VAL A 51 7.037 -3.484 -7.802 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.708 -2.628 -6.985 1.00 0.00 H new ATOM 717 N SER A 52 7.497 0.092 -10.979 1.00 0.00 N ATOM 718 CA SER A 52 7.393 0.937 -12.163 1.00 0.00 C ATOM 719 C SER A 52 6.625 0.226 -13.273 1.00 0.00 C ATOM 720 O SER A 52 5.613 0.728 -13.763 1.00 0.00 O ATOM 721 CB SER A 52 8.786 1.328 -12.661 1.00 0.00 C ATOM 722 OG SER A 52 8.744 1.749 -14.013 1.00 0.00 O ATOM 0 H SER A 52 8.424 -0.303 -10.824 1.00 0.00 H new ATOM 0 HA SER A 52 6.847 1.839 -11.888 1.00 0.00 H new ATOM 0 HB2 SER A 52 9.186 2.129 -12.040 1.00 0.00 H new ATOM 0 HB3 SER A 52 9.463 0.479 -12.562 1.00 0.00 H new ATOM 0 HG SER A 52 9.646 1.995 -14.307 1.00 0.00 H new ATOM 728 N ARG A 53 7.113 -0.947 -13.664 1.00 0.00 N ATOM 729 CA ARG A 53 6.474 -1.728 -14.716 1.00 0.00 C ATOM 730 C ARG A 53 6.661 -3.222 -14.474 1.00 0.00 C ATOM 731 O ARG A 53 7.608 -3.639 -13.806 1.00 0.00 O ATOM 732 CB ARG A 53 7.047 -1.346 -16.083 1.00 0.00 C ATOM 733 CG ARG A 53 6.094 -1.608 -17.237 1.00 0.00 C ATOM 734 CD ARG A 53 5.019 -0.536 -17.325 1.00 0.00 C ATOM 735 NE ARG A 53 5.479 0.643 -18.054 1.00 0.00 N ATOM 736 CZ ARG A 53 5.553 0.706 -19.379 1.00 0.00 C ATOM 737 NH1 ARG A 53 5.198 -0.338 -20.116 1.00 0.00 N ATOM 738 NH2 ARG A 53 5.983 1.814 -19.969 1.00 0.00 N ATOM 0 H ARG A 53 7.949 -1.377 -13.268 1.00 0.00 H new ATOM 0 HA ARG A 53 5.407 -1.506 -14.701 1.00 0.00 H new ATOM 0 HB2 ARG A 53 7.311 -0.289 -16.074 1.00 0.00 H new ATOM 0 HB3 ARG A 53 7.969 -1.904 -16.250 1.00 0.00 H new ATOM 0 HG2 ARG A 53 6.653 -1.642 -18.172 1.00 0.00 H new ATOM 0 HG3 ARG A 53 5.626 -2.584 -17.110 1.00 0.00 H new ATOM 0 HD2 ARG A 53 4.138 -0.946 -17.818 1.00 0.00 H new ATOM 0 HD3 ARG A 53 4.715 -0.245 -16.320 1.00 0.00 H new ATOM 0 HE ARG A 53 5.759 1.463 -17.516 1.00 0.00 H new ATOM 0 HH11 ARG A 53 4.867 -1.191 -19.666 1.00 0.00 H new ATOM 0 HH12 ARG A 53 5.256 -0.287 -21.133 1.00 0.00 H new ATOM 0 HH21 ARG A 53 6.257 2.619 -19.405 1.00 0.00 H new ATOM 0 HH22 ARG A 53 6.039 1.861 -20.986 1.00 0.00 H new ATOM 752 N ILE A 54 5.752 -4.023 -15.019 1.00 0.00 N ATOM 753 CA ILE A 54 5.817 -5.471 -14.862 1.00 0.00 C ATOM 754 C ILE A 54 5.926 -6.166 -16.215 1.00 0.00 C ATOM 755 O ILE A 54 5.079 -5.983 -17.090 1.00 0.00 O ATOM 756 CB ILE A 54 4.582 -6.012 -14.118 1.00 0.00 C ATOM 757 CG1 ILE A 54 4.681 -5.695 -12.624 1.00 0.00 C ATOM 758 CG2 ILE A 54 4.446 -7.511 -14.338 1.00 0.00 C ATOM 759 CD1 ILE A 54 3.413 -5.999 -11.857 1.00 0.00 C ATOM 0 H ILE A 54 4.962 -3.694 -15.573 1.00 0.00 H new ATOM 0 HA ILE A 54 6.709 -5.685 -14.273 1.00 0.00 H new ATOM 0 HB ILE A 54 3.693 -5.524 -14.517 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.503 -6.267 -12.193 1.00 0.00 H new ATOM 0 HG13 ILE A 54 4.927 -4.640 -12.500 1.00 0.00 H new ATOM 0 HG21 ILE A 54 3.569 -7.879 -13.806 1.00 0.00 H new ATOM 0 HG22 ILE A 54 4.336 -7.714 -15.403 1.00 0.00 H new ATOM 0 HG23 ILE A 54 5.336 -8.016 -13.963 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.555 -5.750 -10.805 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.592 -5.407 -12.262 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.177 -7.059 -11.950 1.00 0.00 H new ATOM 771 N LYS A 55 6.973 -6.967 -16.380 1.00 0.00 N ATOM 772 CA LYS A 55 7.193 -7.693 -17.625 1.00 0.00 C ATOM 773 C LYS A 55 5.958 -8.502 -18.008 1.00 0.00 C ATOM 774 O LYS A 55 5.083 -8.746 -17.178 1.00 0.00 O ATOM 775 CB LYS A 55 8.402 -8.621 -17.491 1.00 0.00 C ATOM 776 CG LYS A 55 9.734 -7.917 -17.688 1.00 0.00 C ATOM 777 CD LYS A 55 10.787 -8.862 -18.243 1.00 0.00 C ATOM 778 CE LYS A 55 11.860 -8.108 -19.014 1.00 0.00 C ATOM 779 NZ LYS A 55 12.914 -7.567 -18.112 1.00 0.00 N ATOM 0 H LYS A 55 7.683 -7.130 -15.666 1.00 0.00 H new ATOM 0 HA LYS A 55 7.387 -6.964 -18.412 1.00 0.00 H new ATOM 0 HB2 LYS A 55 8.387 -9.083 -16.504 1.00 0.00 H new ATOM 0 HB3 LYS A 55 8.314 -9.426 -18.221 1.00 0.00 H new ATOM 0 HG2 LYS A 55 9.605 -7.075 -18.368 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.075 -7.509 -16.737 1.00 0.00 H new ATOM 0 HD2 LYS A 55 11.247 -9.417 -17.425 1.00 0.00 H new ATOM 0 HD3 LYS A 55 10.313 -9.593 -18.898 1.00 0.00 H new ATOM 0 HE2 LYS A 55 12.316 -8.774 -19.747 1.00 0.00 H new ATOM 0 HE3 LYS A 55 11.401 -7.289 -19.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 13.626 -7.060 -18.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.483 -6.912 -17.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 13.370 -8.350 -17.601 1.00 0.00 H new ATOM 793 N GLU A 56 5.895 -8.917 -19.270 1.00 0.00 N ATOM 794 CA GLU A 56 4.767 -9.700 -19.761 1.00 0.00 C ATOM 795 C GLU A 56 4.983 -11.188 -19.501 1.00 0.00 C ATOM 796 O GLU A 56 4.060 -11.901 -19.109 1.00 0.00 O ATOM 797 CB GLU A 56 4.562 -9.456 -21.257 1.00 0.00 C ATOM 798 CG GLU A 56 5.807 -9.708 -22.091 1.00 0.00 C ATOM 799 CD GLU A 56 5.557 -9.541 -23.577 1.00 0.00 C ATOM 800 OE1 GLU A 56 4.542 -10.075 -24.072 1.00 0.00 O ATOM 801 OE2 GLU A 56 6.376 -8.877 -24.246 1.00 0.00 O ATOM 0 H GLU A 56 6.611 -8.724 -19.970 1.00 0.00 H new ATOM 0 HA GLU A 56 3.874 -9.381 -19.223 1.00 0.00 H new ATOM 0 HB2 GLU A 56 3.759 -10.100 -21.615 1.00 0.00 H new ATOM 0 HB3 GLU A 56 4.236 -8.427 -21.407 1.00 0.00 H new ATOM 0 HG2 GLU A 56 6.594 -9.021 -21.779 1.00 0.00 H new ATOM 0 HG3 GLU A 56 6.170 -10.717 -21.899 1.00 0.00 H new ATOM 808 N ASN A 57 6.210 -11.649 -19.724 1.00 0.00 N ATOM 809 CA ASN A 57 6.548 -13.053 -19.515 1.00 0.00 C ATOM 810 C ASN A 57 7.564 -13.206 -18.388 1.00 0.00 C ATOM 811 O ASN A 57 8.494 -14.005 -18.481 1.00 0.00 O ATOM 812 CB ASN A 57 7.103 -13.662 -20.804 1.00 0.00 C ATOM 813 CG ASN A 57 6.009 -14.174 -21.720 1.00 0.00 C ATOM 814 OD1 ASN A 57 5.200 -15.015 -21.329 1.00 0.00 O ATOM 815 ND2 ASN A 57 5.980 -13.668 -22.948 1.00 0.00 N ATOM 0 H ASN A 57 6.986 -11.072 -20.049 1.00 0.00 H new ATOM 0 HA ASN A 57 5.638 -13.582 -19.233 1.00 0.00 H new ATOM 0 HB2 ASN A 57 7.694 -12.913 -21.331 1.00 0.00 H new ATOM 0 HB3 ASN A 57 7.777 -14.481 -20.554 1.00 0.00 H new ATOM 0 HD21 ASN A 57 5.267 -13.975 -23.609 1.00 0.00 H new ATOM 0 HD22 ASN A 57 6.671 -12.972 -23.229 1.00 0.00 H new ATOM 822 N GLY A 58 7.378 -12.433 -17.322 1.00 0.00 N ATOM 823 CA GLY A 58 8.286 -12.498 -16.191 1.00 0.00 C ATOM 824 C GLY A 58 7.638 -13.103 -14.962 1.00 0.00 C ATOM 825 O GLY A 58 6.494 -13.554 -15.013 1.00 0.00 O ATOM 0 H GLY A 58 6.615 -11.763 -17.221 1.00 0.00 H new ATOM 0 HA2 GLY A 58 9.161 -13.088 -16.465 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.640 -11.494 -15.955 1.00 0.00 H new ATOM 829 N ALA A 59 8.371 -13.115 -13.853 1.00 0.00 N ATOM 830 CA ALA A 59 7.861 -13.668 -12.605 1.00 0.00 C ATOM 831 C ALA A 59 6.593 -12.946 -12.162 1.00 0.00 C ATOM 832 O ALA A 59 5.556 -13.571 -11.942 1.00 0.00 O ATOM 833 CB ALA A 59 8.923 -13.589 -11.519 1.00 0.00 C ATOM 0 H ALA A 59 9.321 -12.748 -13.794 1.00 0.00 H new ATOM 0 HA ALA A 59 7.610 -14.715 -12.776 1.00 0.00 H new ATOM 0 HB1 ALA A 59 8.528 -14.006 -10.593 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.801 -14.157 -11.827 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.202 -12.548 -11.358 1.00 0.00 H new ATOM 839 N ALA A 60 6.684 -11.626 -12.033 1.00 0.00 N ATOM 840 CA ALA A 60 5.544 -10.819 -11.617 1.00 0.00 C ATOM 841 C ALA A 60 4.354 -11.028 -12.548 1.00 0.00 C ATOM 842 O ALA A 60 3.215 -11.149 -12.099 1.00 0.00 O ATOM 843 CB ALA A 60 5.928 -9.348 -11.570 1.00 0.00 C ATOM 0 H ALA A 60 7.536 -11.093 -12.211 1.00 0.00 H new ATOM 0 HA ALA A 60 5.250 -11.138 -10.617 1.00 0.00 H new ATOM 0 HB1 ALA A 60 5.067 -8.757 -11.258 1.00 0.00 H new ATOM 0 HB2 ALA A 60 6.742 -9.207 -10.859 1.00 0.00 H new ATOM 0 HB3 ALA A 60 6.251 -9.024 -12.560 1.00 0.00 H new ATOM 849 N ALA A 61 4.627 -11.068 -13.849 1.00 0.00 N ATOM 850 CA ALA A 61 3.579 -11.264 -14.843 1.00 0.00 C ATOM 851 C ALA A 61 2.920 -12.630 -14.684 1.00 0.00 C ATOM 852 O ALA A 61 1.697 -12.731 -14.576 1.00 0.00 O ATOM 853 CB ALA A 61 4.148 -11.110 -16.246 1.00 0.00 C ATOM 0 H ALA A 61 5.564 -10.967 -14.238 1.00 0.00 H new ATOM 0 HA ALA A 61 2.816 -10.502 -14.686 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.355 -11.259 -16.979 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.566 -10.110 -16.361 1.00 0.00 H new ATOM 0 HB3 ALA A 61 4.932 -11.851 -16.404 1.00 0.00 H new ATOM 859 N LEU A 62 3.736 -13.678 -14.673 1.00 0.00 N ATOM 860 CA LEU A 62 3.231 -15.039 -14.528 1.00 0.00 C ATOM 861 C LEU A 62 2.336 -15.160 -13.299 1.00 0.00 C ATOM 862 O LEU A 62 1.189 -15.598 -13.395 1.00 0.00 O ATOM 863 CB LEU A 62 4.395 -16.027 -14.425 1.00 0.00 C ATOM 864 CG LEU A 62 5.286 -16.145 -15.661 1.00 0.00 C ATOM 865 CD1 LEU A 62 6.698 -16.549 -15.265 1.00 0.00 C ATOM 866 CD2 LEU A 62 4.701 -17.145 -16.648 1.00 0.00 C ATOM 0 H LEU A 62 4.750 -13.612 -14.763 1.00 0.00 H new ATOM 0 HA LEU A 62 2.638 -15.276 -15.411 1.00 0.00 H new ATOM 0 HB2 LEU A 62 5.018 -15.737 -13.579 1.00 0.00 H new ATOM 0 HB3 LEU A 62 3.989 -17.013 -14.199 1.00 0.00 H new ATOM 0 HG LEU A 62 5.331 -15.170 -16.146 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.318 -16.628 -16.158 1.00 0.00 H new ATOM 0 HD12 LEU A 62 7.118 -15.797 -14.597 1.00 0.00 H new ATOM 0 HD13 LEU A 62 6.671 -17.512 -14.755 1.00 0.00 H new ATOM 0 HD21 LEU A 62 5.349 -17.216 -17.522 1.00 0.00 H new ATOM 0 HD22 LEU A 62 4.625 -18.123 -16.173 1.00 0.00 H new ATOM 0 HD23 LEU A 62 3.710 -16.814 -16.957 1.00 0.00 H new ATOM 878 N ASP A 63 2.866 -14.767 -12.146 1.00 0.00 N ATOM 879 CA ASP A 63 2.114 -14.828 -10.899 1.00 0.00 C ATOM 880 C ASP A 63 0.824 -14.020 -11.001 1.00 0.00 C ATOM 881 O ASP A 63 -0.233 -14.461 -10.553 1.00 0.00 O ATOM 882 CB ASP A 63 2.965 -14.307 -9.739 1.00 0.00 C ATOM 883 CG ASP A 63 2.169 -14.159 -8.458 1.00 0.00 C ATOM 884 OD1 ASP A 63 1.970 -15.177 -7.761 1.00 0.00 O ATOM 885 OD2 ASP A 63 1.745 -13.026 -8.150 1.00 0.00 O ATOM 0 H ASP A 63 3.814 -14.403 -12.049 1.00 0.00 H new ATOM 0 HA ASP A 63 1.855 -15.870 -10.711 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.798 -14.989 -9.569 1.00 0.00 H new ATOM 0 HB3 ASP A 63 3.393 -13.342 -10.011 1.00 0.00 H new ATOM 890 N GLY A 64 0.920 -12.834 -11.595 1.00 0.00 N ATOM 891 CA GLY A 64 -0.246 -11.983 -11.745 1.00 0.00 C ATOM 892 C GLY A 64 -0.604 -11.259 -10.462 1.00 0.00 C ATOM 893 O GLY A 64 -0.731 -10.035 -10.448 1.00 0.00 O ATOM 0 H GLY A 64 1.784 -12.448 -11.975 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -0.060 -11.252 -12.531 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.094 -12.587 -12.066 1.00 0.00 H new ATOM 897 N ARG A 65 -0.768 -12.016 -9.383 1.00 0.00 N ATOM 898 CA ARG A 65 -1.117 -11.439 -8.090 1.00 0.00 C ATOM 899 C ARG A 65 -0.468 -10.069 -7.914 1.00 0.00 C ATOM 900 O ARG A 65 -1.034 -9.180 -7.276 1.00 0.00 O ATOM 901 CB ARG A 65 -0.681 -12.371 -6.958 1.00 0.00 C ATOM 902 CG ARG A 65 -1.658 -12.413 -5.794 1.00 0.00 C ATOM 903 CD ARG A 65 -1.582 -13.737 -5.050 1.00 0.00 C ATOM 904 NE ARG A 65 -0.209 -14.088 -4.698 1.00 0.00 N ATOM 905 CZ ARG A 65 0.106 -15.020 -3.804 1.00 0.00 C ATOM 906 NH1 ARG A 65 -0.851 -15.690 -3.177 1.00 0.00 N ATOM 907 NH2 ARG A 65 1.379 -15.282 -3.538 1.00 0.00 N ATOM 0 H ARG A 65 -0.665 -13.031 -9.378 1.00 0.00 H new ATOM 0 HA ARG A 65 -2.200 -11.317 -8.054 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -0.558 -13.379 -7.355 1.00 0.00 H new ATOM 0 HB3 ARG A 65 0.295 -12.052 -6.591 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -1.442 -11.595 -5.107 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -2.672 -12.260 -6.163 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -2.185 -13.679 -4.144 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -2.011 -14.526 -5.668 1.00 0.00 H new ATOM 0 HE ARG A 65 0.550 -13.591 -5.164 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -1.830 -15.491 -3.380 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -0.608 -16.405 -2.491 1.00 0.00 H new ATOM 0 HH21 ARG A 65 2.117 -14.768 -4.020 1.00 0.00 H new ATOM 0 HH22 ARG A 65 1.620 -15.997 -2.852 1.00 0.00 H new ATOM 921 N LEU A 66 0.721 -9.906 -8.483 1.00 0.00 N ATOM 922 CA LEU A 66 1.447 -8.644 -8.389 1.00 0.00 C ATOM 923 C LEU A 66 1.054 -7.704 -9.524 1.00 0.00 C ATOM 924 O LEU A 66 0.980 -8.112 -10.683 1.00 0.00 O ATOM 925 CB LEU A 66 2.955 -8.898 -8.421 1.00 0.00 C ATOM 926 CG LEU A 66 3.837 -7.769 -7.885 1.00 0.00 C ATOM 927 CD1 LEU A 66 3.907 -7.822 -6.367 1.00 0.00 C ATOM 928 CD2 LEU A 66 5.232 -7.850 -8.488 1.00 0.00 C ATOM 0 H LEU A 66 1.203 -10.631 -9.014 1.00 0.00 H new ATOM 0 HA LEU A 66 1.184 -8.171 -7.443 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.164 -9.800 -7.845 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.247 -9.103 -9.451 1.00 0.00 H new ATOM 0 HG LEU A 66 3.392 -6.817 -8.175 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.539 -7.012 -6.003 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.905 -7.715 -5.953 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.328 -8.778 -6.055 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.846 -7.039 -8.095 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.685 -8.807 -8.229 1.00 0.00 H new ATOM 0 HD23 LEU A 66 5.165 -7.762 -9.572 1.00 0.00 H new ATOM 940 N GLN A 67 0.806 -6.444 -9.182 1.00 0.00 N ATOM 941 CA GLN A 67 0.422 -5.445 -10.173 1.00 0.00 C ATOM 942 C GLN A 67 1.257 -4.178 -10.021 1.00 0.00 C ATOM 943 O GLN A 67 1.736 -3.867 -8.931 1.00 0.00 O ATOM 944 CB GLN A 67 -1.064 -5.110 -10.042 1.00 0.00 C ATOM 945 CG GLN A 67 -1.475 -4.708 -8.634 1.00 0.00 C ATOM 946 CD GLN A 67 -2.703 -3.820 -8.616 1.00 0.00 C ATOM 947 OE1 GLN A 67 -3.691 -4.120 -7.945 1.00 0.00 O ATOM 948 NE2 GLN A 67 -2.649 -2.718 -9.356 1.00 0.00 N ATOM 0 H GLN A 67 0.864 -6.091 -8.227 1.00 0.00 H new ATOM 0 HA GLN A 67 0.606 -5.863 -11.163 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -1.307 -4.299 -10.728 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -1.652 -5.975 -10.350 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -1.671 -5.605 -8.047 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -0.647 -4.187 -8.153 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -1.810 -2.508 -9.897 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -3.446 -2.082 -9.383 1.00 0.00 H new ATOM 957 N GLU A 68 1.427 -3.451 -11.121 1.00 0.00 N ATOM 958 CA GLU A 68 2.205 -2.218 -11.108 1.00 0.00 C ATOM 959 C GLU A 68 1.594 -1.199 -10.150 1.00 0.00 C ATOM 960 O GLU A 68 0.383 -1.181 -9.936 1.00 0.00 O ATOM 961 CB GLU A 68 2.287 -1.626 -12.516 1.00 0.00 C ATOM 962 CG GLU A 68 3.253 -2.361 -13.431 1.00 0.00 C ATOM 963 CD GLU A 68 3.019 -2.051 -14.896 1.00 0.00 C ATOM 964 OE1 GLU A 68 2.832 -0.862 -15.230 1.00 0.00 O ATOM 965 OE2 GLU A 68 3.023 -2.998 -15.710 1.00 0.00 O ATOM 0 H GLU A 68 1.037 -3.694 -12.031 1.00 0.00 H new ATOM 0 HA GLU A 68 3.211 -2.457 -10.763 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.294 -1.639 -12.965 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.591 -0.582 -12.445 1.00 0.00 H new ATOM 0 HG2 GLU A 68 4.275 -2.092 -13.165 1.00 0.00 H new ATOM 0 HG3 GLU A 68 3.154 -3.435 -13.270 1.00 0.00 H new ATOM 972 N GLY A 69 2.443 -0.351 -9.577 1.00 0.00 N ATOM 973 CA GLY A 69 1.970 0.659 -8.649 1.00 0.00 C ATOM 974 C GLY A 69 1.997 0.182 -7.210 1.00 0.00 C ATOM 975 O GLY A 69 1.862 0.980 -6.282 1.00 0.00 O ATOM 0 H GLY A 69 3.450 -0.346 -9.739 1.00 0.00 H new ATOM 0 HA2 GLY A 69 2.587 1.553 -8.744 1.00 0.00 H new ATOM 0 HA3 GLY A 69 0.952 0.944 -8.915 1.00 0.00 H new ATOM 979 N ASP A 70 2.169 -1.122 -7.024 1.00 0.00 N ATOM 980 CA ASP A 70 2.213 -1.704 -5.687 1.00 0.00 C ATOM 981 C ASP A 70 3.367 -1.120 -4.878 1.00 0.00 C ATOM 982 O ASP A 70 4.437 -0.836 -5.417 1.00 0.00 O ATOM 983 CB ASP A 70 2.352 -3.224 -5.774 1.00 0.00 C ATOM 984 CG ASP A 70 1.009 -3.927 -5.817 1.00 0.00 C ATOM 985 OD1 ASP A 70 -0.010 -3.277 -5.505 1.00 0.00 O ATOM 986 OD2 ASP A 70 0.978 -5.127 -6.162 1.00 0.00 O ATOM 0 H ASP A 70 2.280 -1.796 -7.781 1.00 0.00 H new ATOM 0 HA ASP A 70 1.279 -1.461 -5.181 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.923 -3.483 -6.665 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.920 -3.584 -4.916 1.00 0.00 H new ATOM 991 N LYS A 71 3.143 -0.943 -3.580 1.00 0.00 N ATOM 992 CA LYS A 71 4.163 -0.394 -2.695 1.00 0.00 C ATOM 993 C LYS A 71 4.727 -1.475 -1.778 1.00 0.00 C ATOM 994 O LYS A 71 4.128 -1.808 -0.755 1.00 0.00 O ATOM 995 CB LYS A 71 3.580 0.747 -1.858 1.00 0.00 C ATOM 996 CG LYS A 71 4.625 1.517 -1.068 1.00 0.00 C ATOM 997 CD LYS A 71 4.838 0.914 0.310 1.00 0.00 C ATOM 998 CE LYS A 71 5.874 1.694 1.105 1.00 0.00 C ATOM 999 NZ LYS A 71 7.251 1.169 0.886 1.00 0.00 N ATOM 0 H LYS A 71 2.263 -1.172 -3.118 1.00 0.00 H new ATOM 0 HA LYS A 71 4.974 -0.007 -3.312 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.053 1.437 -2.517 1.00 0.00 H new ATOM 0 HB3 LYS A 71 2.842 0.339 -1.167 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.568 1.519 -1.615 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.313 2.557 -0.967 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.893 0.903 0.854 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.160 -0.122 0.209 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.836 2.745 0.818 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.631 1.644 2.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 7.612 0.761 1.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.230 0.435 0.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.874 1.945 0.583 1.00 0.00 H new ATOM 1013 N ILE A 72 5.881 -2.017 -2.151 1.00 0.00 N ATOM 1014 CA ILE A 72 6.526 -3.058 -1.360 1.00 0.00 C ATOM 1015 C ILE A 72 7.025 -2.507 -0.029 1.00 0.00 C ATOM 1016 O ILE A 72 8.128 -1.964 0.057 1.00 0.00 O ATOM 1017 CB ILE A 72 7.709 -3.689 -2.118 1.00 0.00 C ATOM 1018 CG1 ILE A 72 7.242 -4.245 -3.464 1.00 0.00 C ATOM 1019 CG2 ILE A 72 8.351 -4.784 -1.280 1.00 0.00 C ATOM 1020 CD1 ILE A 72 8.369 -4.480 -4.445 1.00 0.00 C ATOM 0 H ILE A 72 6.389 -1.753 -2.995 1.00 0.00 H new ATOM 0 HA ILE A 72 5.774 -3.825 -1.174 1.00 0.00 H new ATOM 0 HB ILE A 72 8.455 -2.917 -2.305 1.00 0.00 H new ATOM 0 HG12 ILE A 72 6.715 -5.184 -3.297 1.00 0.00 H new ATOM 0 HG13 ILE A 72 6.526 -3.552 -3.905 1.00 0.00 H new ATOM 0 HG21 ILE A 72 9.185 -5.220 -1.829 1.00 0.00 H new ATOM 0 HG22 ILE A 72 8.715 -4.360 -0.344 1.00 0.00 H new ATOM 0 HG23 ILE A 72 7.614 -5.558 -1.065 1.00 0.00 H new ATOM 0 HD11 ILE A 72 7.964 -4.874 -5.377 1.00 0.00 H new ATOM 0 HD12 ILE A 72 8.882 -3.539 -4.642 1.00 0.00 H new ATOM 0 HD13 ILE A 72 9.074 -5.196 -4.024 1.00 0.00 H new ATOM 1032 N LEU A 73 6.208 -2.651 1.009 1.00 0.00 N ATOM 1033 CA LEU A 73 6.567 -2.170 2.338 1.00 0.00 C ATOM 1034 C LEU A 73 7.869 -2.806 2.814 1.00 0.00 C ATOM 1035 O LEU A 73 8.857 -2.113 3.059 1.00 0.00 O ATOM 1036 CB LEU A 73 5.445 -2.473 3.332 1.00 0.00 C ATOM 1037 CG LEU A 73 4.038 -2.052 2.905 1.00 0.00 C ATOM 1038 CD1 LEU A 73 2.997 -2.980 3.511 1.00 0.00 C ATOM 1039 CD2 LEU A 73 3.768 -0.610 3.306 1.00 0.00 C ATOM 0 H LEU A 73 5.292 -3.097 0.955 1.00 0.00 H new ATOM 0 HA LEU A 73 6.711 -1.091 2.280 1.00 0.00 H new ATOM 0 HB2 LEU A 73 5.438 -3.546 3.526 1.00 0.00 H new ATOM 0 HB3 LEU A 73 5.680 -1.980 4.275 1.00 0.00 H new ATOM 0 HG LEU A 73 3.971 -2.124 1.819 1.00 0.00 H new ATOM 0 HD11 LEU A 73 2.002 -2.665 3.196 1.00 0.00 H new ATOM 0 HD12 LEU A 73 3.179 -4.000 3.173 1.00 0.00 H new ATOM 0 HD13 LEU A 73 3.063 -2.940 4.598 1.00 0.00 H new ATOM 0 HD21 LEU A 73 2.762 -0.328 2.994 1.00 0.00 H new ATOM 0 HD22 LEU A 73 3.853 -0.511 4.388 1.00 0.00 H new ATOM 0 HD23 LEU A 73 4.494 0.044 2.823 1.00 0.00 H new ATOM 1051 N SER A 74 7.864 -4.129 2.942 1.00 0.00 N ATOM 1052 CA SER A 74 9.044 -4.858 3.390 1.00 0.00 C ATOM 1053 C SER A 74 9.300 -6.074 2.504 1.00 0.00 C ATOM 1054 O SER A 74 8.394 -6.573 1.838 1.00 0.00 O ATOM 1055 CB SER A 74 8.875 -5.300 4.845 1.00 0.00 C ATOM 1056 OG SER A 74 7.524 -5.627 5.125 1.00 0.00 O ATOM 0 H SER A 74 7.056 -4.718 2.742 1.00 0.00 H new ATOM 0 HA SER A 74 9.902 -4.190 3.318 1.00 0.00 H new ATOM 0 HB2 SER A 74 9.510 -6.164 5.042 1.00 0.00 H new ATOM 0 HB3 SER A 74 9.205 -4.503 5.511 1.00 0.00 H new ATOM 0 HG SER A 74 7.443 -5.908 6.060 1.00 0.00 H new ATOM 1062 N VAL A 75 10.543 -6.545 2.502 1.00 0.00 N ATOM 1063 CA VAL A 75 10.920 -7.703 1.700 1.00 0.00 C ATOM 1064 C VAL A 75 11.386 -8.855 2.583 1.00 0.00 C ATOM 1065 O VAL A 75 12.416 -8.763 3.249 1.00 0.00 O ATOM 1066 CB VAL A 75 12.039 -7.352 0.700 1.00 0.00 C ATOM 1067 CG1 VAL A 75 12.368 -8.552 -0.174 1.00 0.00 C ATOM 1068 CG2 VAL A 75 11.637 -6.157 -0.150 1.00 0.00 C ATOM 0 H VAL A 75 11.306 -6.143 3.047 1.00 0.00 H new ATOM 0 HA VAL A 75 10.031 -8.009 1.148 1.00 0.00 H new ATOM 0 HB VAL A 75 12.934 -7.085 1.261 1.00 0.00 H new ATOM 0 HG11 VAL A 75 13.160 -8.286 -0.874 1.00 0.00 H new ATOM 0 HG12 VAL A 75 12.701 -9.379 0.453 1.00 0.00 H new ATOM 0 HG13 VAL A 75 11.479 -8.853 -0.729 1.00 0.00 H new ATOM 0 HG21 VAL A 75 12.439 -5.923 -0.851 1.00 0.00 H new ATOM 0 HG22 VAL A 75 10.729 -6.394 -0.704 1.00 0.00 H new ATOM 0 HG23 VAL A 75 11.455 -5.297 0.494 1.00 0.00 H new ATOM 1078 N ASN A 76 10.619 -9.941 2.583 1.00 0.00 N ATOM 1079 CA ASN A 76 10.953 -11.113 3.384 1.00 0.00 C ATOM 1080 C ASN A 76 11.126 -10.736 4.852 1.00 0.00 C ATOM 1081 O ASN A 76 11.852 -11.398 5.592 1.00 0.00 O ATOM 1082 CB ASN A 76 12.232 -11.767 2.860 1.00 0.00 C ATOM 1083 CG ASN A 76 11.953 -12.819 1.803 1.00 0.00 C ATOM 1084 OD1 ASN A 76 11.073 -13.664 1.970 1.00 0.00 O ATOM 1085 ND2 ASN A 76 12.703 -12.772 0.709 1.00 0.00 N ATOM 0 H ASN A 76 9.762 -10.033 2.037 1.00 0.00 H new ATOM 0 HA ASN A 76 10.131 -11.824 3.304 1.00 0.00 H new ATOM 0 HB2 ASN A 76 12.884 -11.000 2.442 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.770 -12.224 3.691 1.00 0.00 H new ATOM 0 HD21 ASN A 76 12.561 -13.454 -0.036 1.00 0.00 H new ATOM 0 HD22 ASN A 76 13.421 -12.054 0.613 1.00 0.00 H new ATOM 1092 N GLY A 77 10.452 -9.668 5.267 1.00 0.00 N ATOM 1093 CA GLY A 77 10.544 -9.222 6.645 1.00 0.00 C ATOM 1094 C GLY A 77 11.363 -7.954 6.791 1.00 0.00 C ATOM 1095 O GLY A 77 11.228 -7.232 7.778 1.00 0.00 O ATOM 0 H GLY A 77 9.844 -9.104 4.674 1.00 0.00 H new ATOM 0 HA2 GLY A 77 9.541 -9.050 7.036 1.00 0.00 H new ATOM 0 HA3 GLY A 77 10.991 -10.011 7.250 1.00 0.00 H new ATOM 1099 N GLN A 78 12.214 -7.685 5.806 1.00 0.00 N ATOM 1100 CA GLN A 78 13.059 -6.498 5.831 1.00 0.00 C ATOM 1101 C GLN A 78 12.241 -5.241 5.553 1.00 0.00 C ATOM 1102 O GLN A 78 11.461 -5.195 4.602 1.00 0.00 O ATOM 1103 CB GLN A 78 14.185 -6.625 4.804 1.00 0.00 C ATOM 1104 CG GLN A 78 15.169 -7.742 5.116 1.00 0.00 C ATOM 1105 CD GLN A 78 14.552 -9.119 4.977 1.00 0.00 C ATOM 1106 OE1 GLN A 78 14.729 -9.732 3.812 1.00 0.00 O flip ATOM 1107 NE2 GLN A 78 13.924 -9.627 5.905 1.00 0.00 N flip ATOM 0 H GLN A 78 12.336 -8.273 4.981 1.00 0.00 H new ATOM 0 HA GLN A 78 13.493 -6.414 6.827 1.00 0.00 H new ATOM 0 HB2 GLN A 78 13.750 -6.799 3.820 1.00 0.00 H new ATOM 0 HB3 GLN A 78 14.726 -5.680 4.751 1.00 0.00 H new ATOM 0 HG2 GLN A 78 16.026 -7.663 4.447 1.00 0.00 H new ATOM 0 HG3 GLN A 78 15.544 -7.617 6.132 1.00 0.00 H new ATOM 0 HE21 GLN A 78 13.813 -9.120 6.783 1.00 0.00 H new ATOM 0 HE22 GLN A 78 13.515 -10.555 5.796 1.00 0.00 H new ATOM 1116 N ASP A 79 12.425 -4.224 6.388 1.00 0.00 N ATOM 1117 CA ASP A 79 11.704 -2.967 6.231 1.00 0.00 C ATOM 1118 C ASP A 79 12.410 -2.056 5.232 1.00 0.00 C ATOM 1119 O ASP A 79 13.614 -1.818 5.336 1.00 0.00 O ATOM 1120 CB ASP A 79 11.572 -2.258 7.580 1.00 0.00 C ATOM 1121 CG ASP A 79 12.895 -2.161 8.315 1.00 0.00 C ATOM 1122 OD1 ASP A 79 13.344 -3.188 8.865 1.00 0.00 O ATOM 1123 OD2 ASP A 79 13.480 -1.058 8.341 1.00 0.00 O ATOM 0 H ASP A 79 13.067 -4.246 7.180 1.00 0.00 H new ATOM 0 HA ASP A 79 10.709 -3.194 5.849 1.00 0.00 H new ATOM 0 HB2 ASP A 79 11.173 -1.256 7.423 1.00 0.00 H new ATOM 0 HB3 ASP A 79 10.854 -2.794 8.200 1.00 0.00 H new ATOM 1128 N LEU A 80 11.655 -1.551 4.263 1.00 0.00 N ATOM 1129 CA LEU A 80 12.208 -0.667 3.243 1.00 0.00 C ATOM 1130 C LEU A 80 11.944 0.795 3.587 1.00 0.00 C ATOM 1131 O LEU A 80 10.843 1.304 3.377 1.00 0.00 O ATOM 1132 CB LEU A 80 11.610 -0.997 1.874 1.00 0.00 C ATOM 1133 CG LEU A 80 11.687 -2.462 1.444 1.00 0.00 C ATOM 1134 CD1 LEU A 80 10.665 -2.753 0.356 1.00 0.00 C ATOM 1135 CD2 LEU A 80 13.090 -2.804 0.965 1.00 0.00 C ATOM 0 H LEU A 80 10.658 -1.739 4.162 1.00 0.00 H new ATOM 0 HA LEU A 80 13.286 -0.824 3.209 1.00 0.00 H new ATOM 0 HB2 LEU A 80 10.563 -0.694 1.874 1.00 0.00 H new ATOM 0 HB3 LEU A 80 12.117 -0.391 1.123 1.00 0.00 H new ATOM 0 HG LEU A 80 11.457 -3.087 2.307 1.00 0.00 H new ATOM 0 HD11 LEU A 80 10.734 -3.800 0.062 1.00 0.00 H new ATOM 0 HD12 LEU A 80 9.663 -2.548 0.733 1.00 0.00 H new ATOM 0 HD13 LEU A 80 10.864 -2.120 -0.509 1.00 0.00 H new ATOM 0 HD21 LEU A 80 13.126 -3.851 0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 80 13.349 -2.172 0.115 1.00 0.00 H new ATOM 0 HD23 LEU A 80 13.802 -2.635 1.773 1.00 0.00 H new ATOM 1147 N LYS A 81 12.961 1.467 4.116 1.00 0.00 N ATOM 1148 CA LYS A 81 12.841 2.872 4.486 1.00 0.00 C ATOM 1149 C LYS A 81 14.214 3.487 4.737 1.00 0.00 C ATOM 1150 O LYS A 81 15.063 2.887 5.394 1.00 0.00 O ATOM 1151 CB LYS A 81 11.969 3.018 5.735 1.00 0.00 C ATOM 1152 CG LYS A 81 12.483 2.237 6.932 1.00 0.00 C ATOM 1153 CD LYS A 81 11.734 2.603 8.202 1.00 0.00 C ATOM 1154 CE LYS A 81 10.413 1.856 8.305 1.00 0.00 C ATOM 1155 NZ LYS A 81 9.773 2.043 9.636 1.00 0.00 N ATOM 0 H LYS A 81 13.879 1.060 4.298 1.00 0.00 H new ATOM 0 HA LYS A 81 12.371 3.402 3.658 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.904 4.073 6.001 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.957 2.685 5.502 1.00 0.00 H new ATOM 0 HG2 LYS A 81 12.378 1.169 6.742 1.00 0.00 H new ATOM 0 HG3 LYS A 81 13.547 2.434 7.066 1.00 0.00 H new ATOM 0 HD2 LYS A 81 12.352 2.372 9.070 1.00 0.00 H new ATOM 0 HD3 LYS A 81 11.548 3.677 8.219 1.00 0.00 H new ATOM 0 HE2 LYS A 81 9.737 2.205 7.525 1.00 0.00 H new ATOM 0 HE3 LYS A 81 10.582 0.794 8.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 8.875 1.518 9.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 10.407 1.687 10.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 9.588 3.054 9.793 1.00 0.00 H new ATOM 1169 N ASN A 82 14.423 4.690 4.211 1.00 0.00 N ATOM 1170 CA ASN A 82 15.693 5.387 4.379 1.00 0.00 C ATOM 1171 C ASN A 82 16.817 4.652 3.655 1.00 0.00 C ATOM 1172 O ASN A 82 17.886 4.419 4.221 1.00 0.00 O ATOM 1173 CB ASN A 82 16.031 5.523 5.865 1.00 0.00 C ATOM 1174 CG ASN A 82 14.810 5.832 6.710 1.00 0.00 C ATOM 1175 OD1 ASN A 82 14.141 6.845 6.506 1.00 0.00 O ATOM 1176 ND2 ASN A 82 14.515 4.958 7.664 1.00 0.00 N ATOM 0 H ASN A 82 13.730 5.202 3.665 1.00 0.00 H new ATOM 0 HA ASN A 82 15.594 6.381 3.943 1.00 0.00 H new ATOM 0 HB2 ASN A 82 16.488 4.598 6.217 1.00 0.00 H new ATOM 0 HB3 ASN A 82 16.770 6.314 5.996 1.00 0.00 H new ATOM 0 HD21 ASN A 82 13.705 5.112 8.264 1.00 0.00 H new ATOM 0 HD22 ASN A 82 15.098 4.132 7.797 1.00 0.00 H new ATOM 1183 N LEU A 83 16.569 4.290 2.401 1.00 0.00 N ATOM 1184 CA LEU A 83 17.560 3.582 1.599 1.00 0.00 C ATOM 1185 C LEU A 83 17.601 4.130 0.176 1.00 0.00 C ATOM 1186 O LEU A 83 16.699 4.853 -0.249 1.00 0.00 O ATOM 1187 CB LEU A 83 17.248 2.084 1.572 1.00 0.00 C ATOM 1188 CG LEU A 83 15.778 1.709 1.380 1.00 0.00 C ATOM 1189 CD1 LEU A 83 15.328 2.023 -0.038 1.00 0.00 C ATOM 1190 CD2 LEU A 83 15.558 0.237 1.698 1.00 0.00 C ATOM 0 H LEU A 83 15.690 4.475 1.918 1.00 0.00 H new ATOM 0 HA LEU A 83 18.538 3.735 2.056 1.00 0.00 H new ATOM 0 HB2 LEU A 83 17.827 1.627 0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 83 17.596 1.644 2.507 1.00 0.00 H new ATOM 0 HG LEU A 83 15.178 2.303 2.069 1.00 0.00 H new ATOM 0 HD11 LEU A 83 14.279 1.749 -0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 83 15.449 3.089 -0.230 1.00 0.00 H new ATOM 0 HD13 LEU A 83 15.933 1.456 -0.746 1.00 0.00 H new ATOM 0 HD21 LEU A 83 14.507 -0.013 1.556 1.00 0.00 H new ATOM 0 HD22 LEU A 83 16.169 -0.374 1.034 1.00 0.00 H new ATOM 0 HD23 LEU A 83 15.841 0.042 2.732 1.00 0.00 H new ATOM 1202 N LEU A 84 18.652 3.780 -0.557 1.00 0.00 N ATOM 1203 CA LEU A 84 18.810 4.235 -1.934 1.00 0.00 C ATOM 1204 C LEU A 84 18.291 3.189 -2.916 1.00 0.00 C ATOM 1205 O LEU A 84 17.929 2.079 -2.524 1.00 0.00 O ATOM 1206 CB LEU A 84 20.280 4.539 -2.226 1.00 0.00 C ATOM 1207 CG LEU A 84 20.967 5.514 -1.268 1.00 0.00 C ATOM 1208 CD1 LEU A 84 22.456 5.217 -1.180 1.00 0.00 C ATOM 1209 CD2 LEU A 84 20.733 6.951 -1.711 1.00 0.00 C ATOM 0 H LEU A 84 19.407 3.183 -0.221 1.00 0.00 H new ATOM 0 HA LEU A 84 18.225 5.146 -2.059 1.00 0.00 H new ATOM 0 HB2 LEU A 84 20.833 3.600 -2.216 1.00 0.00 H new ATOM 0 HB3 LEU A 84 20.353 4.941 -3.236 1.00 0.00 H new ATOM 0 HG LEU A 84 20.533 5.385 -0.276 1.00 0.00 H new ATOM 0 HD11 LEU A 84 22.927 5.921 -0.494 1.00 0.00 H new ATOM 0 HD12 LEU A 84 22.603 4.201 -0.815 1.00 0.00 H new ATOM 0 HD13 LEU A 84 22.906 5.317 -2.168 1.00 0.00 H new ATOM 0 HD21 LEU A 84 21.229 7.631 -1.018 1.00 0.00 H new ATOM 0 HD22 LEU A 84 21.139 7.094 -2.712 1.00 0.00 H new ATOM 0 HD23 LEU A 84 19.663 7.159 -1.720 1.00 0.00 H new ATOM 1221 N HIS A 85 18.260 3.549 -4.195 1.00 0.00 N ATOM 1222 CA HIS A 85 17.788 2.641 -5.234 1.00 0.00 C ATOM 1223 C HIS A 85 18.599 1.348 -5.235 1.00 0.00 C ATOM 1224 O HIS A 85 18.041 0.256 -5.340 1.00 0.00 O ATOM 1225 CB HIS A 85 17.875 3.312 -6.605 1.00 0.00 C ATOM 1226 CG HIS A 85 17.195 2.540 -7.694 1.00 0.00 C ATOM 1227 ND1 HIS A 85 15.824 2.445 -7.806 1.00 0.00 N ATOM 1228 CD2 HIS A 85 17.705 1.824 -8.724 1.00 0.00 C ATOM 1229 CE1 HIS A 85 15.520 1.704 -8.857 1.00 0.00 C ATOM 1230 NE2 HIS A 85 16.644 1.315 -9.431 1.00 0.00 N ATOM 0 H HIS A 85 18.556 4.463 -4.537 1.00 0.00 H new ATOM 0 HA HIS A 85 16.747 2.396 -5.023 1.00 0.00 H new ATOM 0 HB2 HIS A 85 17.431 4.305 -6.543 1.00 0.00 H new ATOM 0 HB3 HIS A 85 18.924 3.448 -6.868 1.00 0.00 H new ATOM 0 HD1 HIS A 85 15.150 2.879 -7.176 1.00 0.00 H new ATOM 0 HD2 HIS A 85 18.752 1.680 -8.948 1.00 0.00 H new ATOM 0 HE1 HIS A 85 14.522 1.458 -9.190 1.00 0.00 H new ATOM 1238 N GLN A 86 19.916 1.481 -5.117 1.00 0.00 N ATOM 1239 CA GLN A 86 20.802 0.324 -5.106 1.00 0.00 C ATOM 1240 C GLN A 86 20.505 -0.578 -3.913 1.00 0.00 C ATOM 1241 O GLN A 86 20.469 -1.802 -4.041 1.00 0.00 O ATOM 1242 CB GLN A 86 22.264 0.774 -5.068 1.00 0.00 C ATOM 1243 CG GLN A 86 23.251 -0.374 -4.930 1.00 0.00 C ATOM 1244 CD GLN A 86 23.562 -1.039 -6.257 1.00 0.00 C ATOM 1245 OE1 GLN A 86 24.546 -0.704 -6.916 1.00 0.00 O ATOM 1246 NE2 GLN A 86 22.722 -1.987 -6.655 1.00 0.00 N ATOM 0 H GLN A 86 20.393 2.378 -5.028 1.00 0.00 H new ATOM 0 HA GLN A 86 20.627 -0.244 -6.020 1.00 0.00 H new ATOM 0 HB2 GLN A 86 22.489 1.328 -5.980 1.00 0.00 H new ATOM 0 HB3 GLN A 86 22.402 1.463 -4.235 1.00 0.00 H new ATOM 0 HG2 GLN A 86 24.176 -0.002 -4.489 1.00 0.00 H new ATOM 0 HG3 GLN A 86 22.846 -1.116 -4.242 1.00 0.00 H new ATOM 0 HE21 GLN A 86 21.919 -2.232 -6.076 1.00 0.00 H new ATOM 0 HE22 GLN A 86 22.880 -2.470 -7.539 1.00 0.00 H new ATOM 1255 N ASP A 87 20.292 0.034 -2.753 1.00 0.00 N ATOM 1256 CA ASP A 87 19.996 -0.713 -1.537 1.00 0.00 C ATOM 1257 C ASP A 87 18.754 -1.580 -1.719 1.00 0.00 C ATOM 1258 O ASP A 87 18.723 -2.735 -1.296 1.00 0.00 O ATOM 1259 CB ASP A 87 19.797 0.244 -0.360 1.00 0.00 C ATOM 1260 CG ASP A 87 21.108 0.649 0.285 1.00 0.00 C ATOM 1261 OD1 ASP A 87 21.760 1.581 -0.231 1.00 0.00 O ATOM 1262 OD2 ASP A 87 21.481 0.035 1.306 1.00 0.00 O ATOM 0 H ASP A 87 20.319 1.046 -2.630 1.00 0.00 H new ATOM 0 HA ASP A 87 20.844 -1.365 -1.326 1.00 0.00 H new ATOM 0 HB2 ASP A 87 19.274 1.136 -0.705 1.00 0.00 H new ATOM 0 HB3 ASP A 87 19.159 -0.230 0.386 1.00 0.00 H new ATOM 1267 N ALA A 88 17.732 -1.013 -2.352 1.00 0.00 N ATOM 1268 CA ALA A 88 16.487 -1.734 -2.591 1.00 0.00 C ATOM 1269 C ALA A 88 16.697 -2.878 -3.577 1.00 0.00 C ATOM 1270 O ALA A 88 16.334 -4.022 -3.303 1.00 0.00 O ATOM 1271 CB ALA A 88 15.416 -0.783 -3.104 1.00 0.00 C ATOM 0 H ALA A 88 17.741 -0.057 -2.708 1.00 0.00 H new ATOM 0 HA ALA A 88 16.155 -2.160 -1.644 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.492 -1.335 -3.278 1.00 0.00 H new ATOM 0 HB2 ALA A 88 15.238 -0.002 -2.365 1.00 0.00 H new ATOM 0 HB3 ALA A 88 15.749 -0.330 -4.038 1.00 0.00 H new ATOM 1277 N VAL A 89 17.284 -2.563 -4.727 1.00 0.00 N ATOM 1278 CA VAL A 89 17.543 -3.565 -5.755 1.00 0.00 C ATOM 1279 C VAL A 89 18.376 -4.715 -5.202 1.00 0.00 C ATOM 1280 O VAL A 89 18.118 -5.882 -5.501 1.00 0.00 O ATOM 1281 CB VAL A 89 18.271 -2.952 -6.965 1.00 0.00 C ATOM 1282 CG1 VAL A 89 18.583 -4.024 -7.999 1.00 0.00 C ATOM 1283 CG2 VAL A 89 17.440 -1.835 -7.577 1.00 0.00 C ATOM 0 H VAL A 89 17.590 -1.621 -4.971 1.00 0.00 H new ATOM 0 HA VAL A 89 16.574 -3.945 -6.079 1.00 0.00 H new ATOM 0 HB VAL A 89 19.214 -2.526 -6.622 1.00 0.00 H new ATOM 0 HG11 VAL A 89 19.098 -3.573 -8.847 1.00 0.00 H new ATOM 0 HG12 VAL A 89 19.221 -4.786 -7.552 1.00 0.00 H new ATOM 0 HG13 VAL A 89 17.654 -4.482 -8.340 1.00 0.00 H new ATOM 0 HG21 VAL A 89 17.970 -1.413 -8.431 1.00 0.00 H new ATOM 0 HG22 VAL A 89 16.481 -2.234 -7.906 1.00 0.00 H new ATOM 0 HG23 VAL A 89 17.273 -1.056 -6.833 1.00 0.00 H new ATOM 1293 N ASP A 90 19.377 -4.380 -4.396 1.00 0.00 N ATOM 1294 CA ASP A 90 20.249 -5.385 -3.800 1.00 0.00 C ATOM 1295 C ASP A 90 19.450 -6.348 -2.926 1.00 0.00 C ATOM 1296 O ASP A 90 19.458 -7.559 -3.150 1.00 0.00 O ATOM 1297 CB ASP A 90 21.345 -4.714 -2.971 1.00 0.00 C ATOM 1298 CG ASP A 90 22.633 -5.513 -2.958 1.00 0.00 C ATOM 1299 OD1 ASP A 90 23.399 -5.421 -3.940 1.00 0.00 O ATOM 1300 OD2 ASP A 90 22.876 -6.230 -1.965 1.00 0.00 O ATOM 0 H ASP A 90 19.605 -3.419 -4.140 1.00 0.00 H new ATOM 0 HA ASP A 90 20.712 -5.953 -4.607 1.00 0.00 H new ATOM 0 HB2 ASP A 90 21.542 -3.720 -3.372 1.00 0.00 H new ATOM 0 HB3 ASP A 90 20.993 -4.582 -1.948 1.00 0.00 H new ATOM 1305 N LEU A 91 18.764 -5.802 -1.928 1.00 0.00 N ATOM 1306 CA LEU A 91 17.960 -6.612 -1.019 1.00 0.00 C ATOM 1307 C LEU A 91 17.133 -7.636 -1.789 1.00 0.00 C ATOM 1308 O LEU A 91 17.049 -8.801 -1.400 1.00 0.00 O ATOM 1309 CB LEU A 91 17.040 -5.718 -0.186 1.00 0.00 C ATOM 1310 CG LEU A 91 16.200 -6.425 0.878 1.00 0.00 C ATOM 1311 CD1 LEU A 91 17.096 -7.048 1.938 1.00 0.00 C ATOM 1312 CD2 LEU A 91 15.215 -5.455 1.512 1.00 0.00 C ATOM 0 H LEU A 91 18.748 -4.802 -1.728 1.00 0.00 H new ATOM 0 HA LEU A 91 18.637 -7.147 -0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 91 17.650 -4.961 0.306 1.00 0.00 H new ATOM 0 HB3 LEU A 91 16.366 -5.194 -0.863 1.00 0.00 H new ATOM 0 HG LEU A 91 15.634 -7.222 0.396 1.00 0.00 H new ATOM 0 HD11 LEU A 91 16.481 -7.547 2.687 1.00 0.00 H new ATOM 0 HD12 LEU A 91 17.760 -7.775 1.471 1.00 0.00 H new ATOM 0 HD13 LEU A 91 17.690 -6.269 2.416 1.00 0.00 H new ATOM 0 HD21 LEU A 91 14.626 -5.976 2.267 1.00 0.00 H new ATOM 0 HD22 LEU A 91 15.761 -4.636 1.980 1.00 0.00 H new ATOM 0 HD23 LEU A 91 14.551 -5.057 0.745 1.00 0.00 H new ATOM 1324 N PHE A 92 16.525 -7.194 -2.885 1.00 0.00 N ATOM 1325 CA PHE A 92 15.705 -8.073 -3.711 1.00 0.00 C ATOM 1326 C PHE A 92 16.504 -9.287 -4.174 1.00 0.00 C ATOM 1327 O PHE A 92 15.998 -10.409 -4.184 1.00 0.00 O ATOM 1328 CB PHE A 92 15.166 -7.311 -4.924 1.00 0.00 C ATOM 1329 CG PHE A 92 13.993 -6.429 -4.605 1.00 0.00 C ATOM 1330 CD1 PHE A 92 14.002 -5.622 -3.478 1.00 0.00 C ATOM 1331 CD2 PHE A 92 12.881 -6.407 -5.431 1.00 0.00 C ATOM 1332 CE1 PHE A 92 12.924 -4.809 -3.182 1.00 0.00 C ATOM 1333 CE2 PHE A 92 11.800 -5.595 -5.140 1.00 0.00 C ATOM 1334 CZ PHE A 92 11.822 -4.796 -4.013 1.00 0.00 C ATOM 0 H PHE A 92 16.585 -6.233 -3.222 1.00 0.00 H new ATOM 0 HA PHE A 92 14.867 -8.421 -3.106 1.00 0.00 H new ATOM 0 HB2 PHE A 92 15.965 -6.701 -5.344 1.00 0.00 H new ATOM 0 HB3 PHE A 92 14.874 -8.027 -5.692 1.00 0.00 H new ATOM 0 HD1 PHE A 92 14.861 -5.629 -2.824 1.00 0.00 H new ATOM 0 HD2 PHE A 92 12.858 -7.031 -6.312 1.00 0.00 H new ATOM 0 HE1 PHE A 92 12.944 -4.184 -2.301 1.00 0.00 H new ATOM 0 HE2 PHE A 92 10.940 -5.585 -5.793 1.00 0.00 H new ATOM 0 HZ PHE A 92 10.978 -4.162 -3.783 1.00 0.00 H new ATOM 1344 N ARG A 93 17.756 -9.053 -4.556 1.00 0.00 N ATOM 1345 CA ARG A 93 18.625 -10.127 -5.022 1.00 0.00 C ATOM 1346 C ARG A 93 18.918 -11.116 -3.897 1.00 0.00 C ATOM 1347 O ARG A 93 19.000 -12.322 -4.124 1.00 0.00 O ATOM 1348 CB ARG A 93 19.936 -9.552 -5.563 1.00 0.00 C ATOM 1349 CG ARG A 93 19.792 -8.880 -6.919 1.00 0.00 C ATOM 1350 CD ARG A 93 21.147 -8.536 -7.516 1.00 0.00 C ATOM 1351 NE ARG A 93 21.730 -9.664 -8.237 1.00 0.00 N ATOM 1352 CZ ARG A 93 21.279 -10.100 -9.408 1.00 0.00 C ATOM 1353 NH1 ARG A 93 20.245 -9.505 -9.987 1.00 0.00 N ATOM 1354 NH2 ARG A 93 21.863 -11.133 -10.002 1.00 0.00 N ATOM 0 H ARG A 93 18.190 -8.130 -4.552 1.00 0.00 H new ATOM 0 HA ARG A 93 18.109 -10.656 -5.823 1.00 0.00 H new ATOM 0 HB2 ARG A 93 20.328 -8.829 -4.848 1.00 0.00 H new ATOM 0 HB3 ARG A 93 20.670 -10.354 -5.640 1.00 0.00 H new ATOM 0 HG2 ARG A 93 19.251 -9.539 -7.598 1.00 0.00 H new ATOM 0 HG3 ARG A 93 19.198 -7.972 -6.815 1.00 0.00 H new ATOM 0 HD2 ARG A 93 21.040 -7.689 -8.194 1.00 0.00 H new ATOM 0 HD3 ARG A 93 21.825 -8.225 -6.721 1.00 0.00 H new ATOM 0 HE ARG A 93 22.527 -10.143 -7.819 1.00 0.00 H new ATOM 0 HH11 ARG A 93 19.794 -8.711 -9.533 1.00 0.00 H new ATOM 0 HH12 ARG A 93 19.901 -9.842 -10.886 1.00 0.00 H new ATOM 0 HH21 ARG A 93 22.659 -11.593 -9.559 1.00 0.00 H new ATOM 0 HH22 ARG A 93 21.516 -11.467 -10.901 1.00 0.00 H new ATOM 1368 N ASN A 94 19.074 -10.596 -2.684 1.00 0.00 N ATOM 1369 CA ASN A 94 19.358 -11.433 -1.524 1.00 0.00 C ATOM 1370 C ASN A 94 18.212 -12.406 -1.261 1.00 0.00 C ATOM 1371 O ASN A 94 18.436 -13.569 -0.928 1.00 0.00 O ATOM 1372 CB ASN A 94 19.597 -10.564 -0.288 1.00 0.00 C ATOM 1373 CG ASN A 94 19.743 -11.386 0.978 1.00 0.00 C ATOM 1374 OD1 ASN A 94 20.299 -12.484 0.957 1.00 0.00 O ATOM 1375 ND2 ASN A 94 19.243 -10.857 2.088 1.00 0.00 N ATOM 0 H ASN A 94 19.009 -9.599 -2.479 1.00 0.00 H new ATOM 0 HA ASN A 94 20.259 -12.009 -1.735 1.00 0.00 H new ATOM 0 HB2 ASN A 94 20.497 -9.967 -0.436 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.767 -9.867 -0.172 1.00 0.00 H new ATOM 0 HD21 ASN A 94 19.312 -11.364 2.970 1.00 0.00 H new ATOM 0 HD22 ASN A 94 18.790 -9.943 2.059 1.00 0.00 H new ATOM 1382 N ALA A 95 16.985 -11.920 -1.414 1.00 0.00 N ATOM 1383 CA ALA A 95 15.804 -12.747 -1.196 1.00 0.00 C ATOM 1384 C ALA A 95 16.060 -14.191 -1.612 1.00 0.00 C ATOM 1385 O ALA A 95 16.080 -15.094 -0.777 1.00 0.00 O ATOM 1386 CB ALA A 95 14.615 -12.179 -1.957 1.00 0.00 C ATOM 0 H ALA A 95 16.782 -10.959 -1.688 1.00 0.00 H new ATOM 0 HA ALA A 95 15.577 -12.739 -0.130 1.00 0.00 H new ATOM 0 HB1 ALA A 95 13.740 -12.806 -1.785 1.00 0.00 H new ATOM 0 HB2 ALA A 95 14.410 -11.167 -1.609 1.00 0.00 H new ATOM 0 HB3 ALA A 95 14.842 -12.157 -3.023 1.00 0.00 H new ATOM 1392 N GLY A 96 16.256 -14.402 -2.910 1.00 0.00 N ATOM 1393 CA GLY A 96 16.508 -15.740 -3.415 1.00 0.00 C ATOM 1394 C GLY A 96 15.291 -16.345 -4.086 1.00 0.00 C ATOM 1395 O GLY A 96 14.385 -15.626 -4.508 1.00 0.00 O ATOM 0 H GLY A 96 16.245 -13.671 -3.621 1.00 0.00 H new ATOM 0 HA2 GLY A 96 17.333 -15.707 -4.127 1.00 0.00 H new ATOM 0 HA3 GLY A 96 16.822 -16.382 -2.592 1.00 0.00 H new ATOM 1399 N TYR A 97 15.270 -17.669 -4.187 1.00 0.00 N ATOM 1400 CA TYR A 97 14.157 -18.370 -4.816 1.00 0.00 C ATOM 1401 C TYR A 97 12.821 -17.828 -4.319 1.00 0.00 C ATOM 1402 O TYR A 97 12.069 -17.211 -5.074 1.00 0.00 O ATOM 1403 CB TYR A 97 14.248 -19.871 -4.534 1.00 0.00 C ATOM 1404 CG TYR A 97 13.318 -20.705 -5.387 1.00 0.00 C ATOM 1405 CD1 TYR A 97 13.673 -21.073 -6.679 1.00 0.00 C ATOM 1406 CD2 TYR A 97 12.086 -21.123 -4.901 1.00 0.00 C ATOM 1407 CE1 TYR A 97 12.827 -21.834 -7.462 1.00 0.00 C ATOM 1408 CE2 TYR A 97 11.234 -21.886 -5.677 1.00 0.00 C ATOM 1409 CZ TYR A 97 11.609 -22.238 -6.956 1.00 0.00 C ATOM 1410 OH TYR A 97 10.762 -22.996 -7.733 1.00 0.00 O ATOM 0 H TYR A 97 16.011 -18.279 -3.841 1.00 0.00 H new ATOM 0 HA TYR A 97 14.218 -18.205 -5.892 1.00 0.00 H new ATOM 0 HB2 TYR A 97 15.273 -20.202 -4.699 1.00 0.00 H new ATOM 0 HB3 TYR A 97 14.021 -20.049 -3.483 1.00 0.00 H new ATOM 0 HD1 TYR A 97 14.626 -20.759 -7.078 1.00 0.00 H new ATOM 0 HD2 TYR A 97 11.789 -20.847 -3.900 1.00 0.00 H new ATOM 0 HE1 TYR A 97 13.117 -22.111 -8.465 1.00 0.00 H new ATOM 0 HE2 TYR A 97 10.280 -22.205 -5.284 1.00 0.00 H new ATOM 0 HH TYR A 97 9.947 -23.197 -7.228 1.00 0.00 H new ATOM 1420 N ALA A 98 12.532 -18.062 -3.043 1.00 0.00 N ATOM 1421 CA ALA A 98 11.288 -17.595 -2.443 1.00 0.00 C ATOM 1422 C ALA A 98 11.394 -16.131 -2.030 1.00 0.00 C ATOM 1423 O ALA A 98 12.068 -15.798 -1.055 1.00 0.00 O ATOM 1424 CB ALA A 98 10.924 -18.459 -1.245 1.00 0.00 C ATOM 0 H ALA A 98 13.143 -18.572 -2.405 1.00 0.00 H new ATOM 0 HA ALA A 98 10.499 -17.678 -3.190 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.993 -18.099 -0.806 1.00 0.00 H new ATOM 0 HB2 ALA A 98 10.798 -19.493 -1.567 1.00 0.00 H new ATOM 0 HB3 ALA A 98 11.720 -18.405 -0.502 1.00 0.00 H new ATOM 1430 N VAL A 99 10.724 -15.260 -2.778 1.00 0.00 N ATOM 1431 CA VAL A 99 10.742 -13.831 -2.489 1.00 0.00 C ATOM 1432 C VAL A 99 9.374 -13.348 -2.019 1.00 0.00 C ATOM 1433 O VAL A 99 8.412 -13.336 -2.786 1.00 0.00 O ATOM 1434 CB VAL A 99 11.167 -13.014 -3.723 1.00 0.00 C ATOM 1435 CG1 VAL A 99 11.555 -11.599 -3.320 1.00 0.00 C ATOM 1436 CG2 VAL A 99 12.312 -13.703 -4.449 1.00 0.00 C ATOM 0 H VAL A 99 10.162 -15.519 -3.589 1.00 0.00 H new ATOM 0 HA VAL A 99 11.471 -13.678 -1.693 1.00 0.00 H new ATOM 0 HB VAL A 99 10.319 -12.952 -4.405 1.00 0.00 H new ATOM 0 HG11 VAL A 99 11.852 -11.037 -4.205 1.00 0.00 H new ATOM 0 HG12 VAL A 99 10.704 -11.109 -2.848 1.00 0.00 H new ATOM 0 HG13 VAL A 99 12.387 -11.636 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 99 12.600 -13.112 -5.318 1.00 0.00 H new ATOM 0 HG22 VAL A 99 13.165 -13.798 -3.777 1.00 0.00 H new ATOM 0 HG23 VAL A 99 11.994 -14.694 -4.773 1.00 0.00 H new ATOM 1446 N SER A 100 9.296 -12.949 -0.753 1.00 0.00 N ATOM 1447 CA SER A 100 8.045 -12.468 -0.180 1.00 0.00 C ATOM 1448 C SER A 100 8.013 -10.943 -0.150 1.00 0.00 C ATOM 1449 O SER A 100 8.684 -10.312 0.668 1.00 0.00 O ATOM 1450 CB SER A 100 7.862 -13.021 1.235 1.00 0.00 C ATOM 1451 OG SER A 100 7.742 -14.433 1.218 1.00 0.00 O ATOM 0 H SER A 100 10.084 -12.950 -0.105 1.00 0.00 H new ATOM 0 HA SER A 100 7.227 -12.819 -0.809 1.00 0.00 H new ATOM 0 HB2 SER A 100 8.711 -12.732 1.855 1.00 0.00 H new ATOM 0 HB3 SER A 100 6.973 -12.583 1.688 1.00 0.00 H new ATOM 0 HG SER A 100 7.628 -14.763 2.134 1.00 0.00 H new ATOM 1457 N LEU A 101 7.228 -10.356 -1.047 1.00 0.00 N ATOM 1458 CA LEU A 101 7.107 -8.904 -1.124 1.00 0.00 C ATOM 1459 C LEU A 101 5.810 -8.431 -0.476 1.00 0.00 C ATOM 1460 O LEU A 101 4.719 -8.703 -0.977 1.00 0.00 O ATOM 1461 CB LEU A 101 7.158 -8.446 -2.583 1.00 0.00 C ATOM 1462 CG LEU A 101 8.351 -8.942 -3.401 1.00 0.00 C ATOM 1463 CD1 LEU A 101 8.178 -8.585 -4.869 1.00 0.00 C ATOM 1464 CD2 LEU A 101 9.649 -8.362 -2.858 1.00 0.00 C ATOM 0 H LEU A 101 6.666 -10.863 -1.731 1.00 0.00 H new ATOM 0 HA LEU A 101 7.944 -8.464 -0.581 1.00 0.00 H new ATOM 0 HB2 LEU A 101 6.243 -8.772 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.159 -7.356 -2.601 1.00 0.00 H new ATOM 0 HG LEU A 101 8.398 -10.028 -3.316 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.037 -8.946 -5.435 1.00 0.00 H new ATOM 0 HD12 LEU A 101 7.270 -9.050 -5.252 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.104 -7.503 -4.974 1.00 0.00 H new ATOM 0 HD21 LEU A 101 10.487 -8.726 -3.453 1.00 0.00 H new ATOM 0 HD22 LEU A 101 9.612 -7.274 -2.911 1.00 0.00 H new ATOM 0 HD23 LEU A 101 9.779 -8.670 -1.821 1.00 0.00 H new ATOM 1476 N ARG A 102 5.937 -7.719 0.638 1.00 0.00 N ATOM 1477 CA ARG A 102 4.775 -7.206 1.355 1.00 0.00 C ATOM 1478 C ARG A 102 4.318 -5.875 0.766 1.00 0.00 C ATOM 1479 O ARG A 102 4.893 -4.825 1.055 1.00 0.00 O ATOM 1480 CB ARG A 102 5.099 -7.034 2.840 1.00 0.00 C ATOM 1481 CG ARG A 102 3.869 -6.983 3.730 1.00 0.00 C ATOM 1482 CD ARG A 102 4.218 -6.526 5.138 1.00 0.00 C ATOM 1483 NE ARG A 102 4.865 -7.582 5.911 1.00 0.00 N ATOM 1484 CZ ARG A 102 5.073 -7.511 7.221 1.00 0.00 C ATOM 1485 NH1 ARG A 102 4.686 -6.440 7.900 1.00 0.00 N ATOM 1486 NH2 ARG A 102 5.669 -8.514 7.855 1.00 0.00 N ATOM 0 H ARG A 102 6.833 -7.484 1.065 1.00 0.00 H new ATOM 0 HA ARG A 102 3.966 -7.929 1.249 1.00 0.00 H new ATOM 0 HB2 ARG A 102 5.736 -7.858 3.162 1.00 0.00 H new ATOM 0 HB3 ARG A 102 5.672 -6.117 2.974 1.00 0.00 H new ATOM 0 HG2 ARG A 102 3.134 -6.304 3.298 1.00 0.00 H new ATOM 0 HG3 ARG A 102 3.407 -7.969 3.771 1.00 0.00 H new ATOM 0 HD2 ARG A 102 4.877 -5.660 5.085 1.00 0.00 H new ATOM 0 HD3 ARG A 102 3.311 -6.205 5.650 1.00 0.00 H new ATOM 0 HE ARG A 102 5.174 -8.420 5.418 1.00 0.00 H new ATOM 0 HH11 ARG A 102 4.227 -5.668 7.416 1.00 0.00 H new ATOM 0 HH12 ARG A 102 4.847 -6.388 8.906 1.00 0.00 H new ATOM 0 HH21 ARG A 102 5.968 -9.340 7.336 1.00 0.00 H new ATOM 0 HH22 ARG A 102 5.828 -8.459 8.861 1.00 0.00 H new ATOM 1500 N VAL A 103 3.279 -5.925 -0.062 1.00 0.00 N ATOM 1501 CA VAL A 103 2.743 -4.724 -0.691 1.00 0.00 C ATOM 1502 C VAL A 103 1.387 -4.353 -0.102 1.00 0.00 C ATOM 1503 O VAL A 103 0.748 -5.164 0.567 1.00 0.00 O ATOM 1504 CB VAL A 103 2.597 -4.906 -2.214 1.00 0.00 C ATOM 1505 CG1 VAL A 103 3.951 -5.170 -2.853 1.00 0.00 C ATOM 1506 CG2 VAL A 103 1.623 -6.032 -2.524 1.00 0.00 C ATOM 0 H VAL A 103 2.792 -6.785 -0.313 1.00 0.00 H new ATOM 0 HA VAL A 103 3.453 -3.920 -0.495 1.00 0.00 H new ATOM 0 HB VAL A 103 2.197 -3.984 -2.636 1.00 0.00 H new ATOM 0 HG11 VAL A 103 3.827 -5.296 -3.929 1.00 0.00 H new ATOM 0 HG12 VAL A 103 4.615 -4.327 -2.660 1.00 0.00 H new ATOM 0 HG13 VAL A 103 4.383 -6.076 -2.429 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.532 -6.147 -3.604 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.991 -6.962 -2.090 1.00 0.00 H new ATOM 0 HG23 VAL A 103 0.647 -5.796 -2.100 1.00 0.00 H new ATOM 1516 N GLN A 104 0.954 -3.122 -0.356 1.00 0.00 N ATOM 1517 CA GLN A 104 -0.327 -2.644 0.150 1.00 0.00 C ATOM 1518 C GLN A 104 -1.220 -2.168 -0.991 1.00 0.00 C ATOM 1519 O GLN A 104 -0.795 -1.383 -1.840 1.00 0.00 O ATOM 1520 CB GLN A 104 -0.111 -1.508 1.152 1.00 0.00 C ATOM 1521 CG GLN A 104 -1.395 -1.017 1.801 1.00 0.00 C ATOM 1522 CD GLN A 104 -1.153 0.086 2.812 1.00 0.00 C ATOM 1523 OE1 GLN A 104 -1.076 -0.284 4.085 1.00 0.00 O flip ATOM 1524 NE2 GLN A 104 -1.037 1.258 2.453 1.00 0.00 N flip ATOM 0 H GLN A 104 1.471 -2.438 -0.909 1.00 0.00 H new ATOM 0 HA GLN A 104 -0.823 -3.474 0.653 1.00 0.00 H new ATOM 0 HB2 GLN A 104 0.573 -1.846 1.930 1.00 0.00 H new ATOM 0 HB3 GLN A 104 0.372 -0.673 0.644 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -2.072 -0.654 1.028 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -1.892 -1.853 2.293 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -1.103 1.497 1.464 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -0.875 1.990 3.145 1.00 0.00 H new ATOM 1533 N HIS A 105 -2.459 -2.649 -1.006 1.00 0.00 N ATOM 1534 CA HIS A 105 -3.412 -2.273 -2.044 1.00 0.00 C ATOM 1535 C HIS A 105 -4.255 -1.080 -1.601 1.00 0.00 C ATOM 1536 O HIS A 105 -5.114 -1.205 -0.729 1.00 0.00 O ATOM 1537 CB HIS A 105 -4.320 -3.455 -2.385 1.00 0.00 C ATOM 1538 CG HIS A 105 -3.576 -4.732 -2.625 1.00 0.00 C ATOM 1539 ND1 HIS A 105 -2.670 -4.894 -3.652 1.00 0.00 N ATOM 1540 CD2 HIS A 105 -3.605 -5.912 -1.962 1.00 0.00 C ATOM 1541 CE1 HIS A 105 -2.177 -6.118 -3.612 1.00 0.00 C ATOM 1542 NE2 HIS A 105 -2.727 -6.757 -2.595 1.00 0.00 N ATOM 0 H HIS A 105 -2.826 -3.300 -0.312 1.00 0.00 H new ATOM 0 HA HIS A 105 -2.850 -1.988 -2.933 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -5.029 -3.605 -1.571 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -4.902 -3.211 -3.274 1.00 0.00 H new ATOM 0 HD1 HIS A 105 -2.420 -4.180 -4.336 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -4.207 -6.145 -1.096 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -1.448 -6.528 -4.295 1.00 0.00 H new ATOM 1550 N ARG A 106 -4.001 0.075 -2.207 1.00 0.00 N ATOM 1551 CA ARG A 106 -4.734 1.290 -1.874 1.00 0.00 C ATOM 1552 C ARG A 106 -5.985 1.424 -2.737 1.00 0.00 C ATOM 1553 O ARG A 106 -5.926 1.926 -3.861 1.00 0.00 O ATOM 1554 CB ARG A 106 -3.840 2.518 -2.058 1.00 0.00 C ATOM 1555 CG ARG A 106 -2.732 2.624 -1.024 1.00 0.00 C ATOM 1556 CD ARG A 106 -1.597 3.510 -1.514 1.00 0.00 C ATOM 1557 NE ARG A 106 -0.554 3.672 -0.504 1.00 0.00 N ATOM 1558 CZ ARG A 106 0.292 4.696 -0.478 1.00 0.00 C ATOM 1559 NH1 ARG A 106 0.217 5.645 -1.401 1.00 0.00 N ATOM 1560 NH2 ARG A 106 1.214 4.773 0.473 1.00 0.00 N ATOM 0 H ARG A 106 -3.293 0.195 -2.931 1.00 0.00 H new ATOM 0 HA ARG A 106 -5.039 1.225 -0.830 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -3.396 2.488 -3.053 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -4.456 3.416 -2.011 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.136 3.028 -0.096 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -2.347 1.630 -0.798 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -1.164 3.078 -2.416 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -1.993 4.488 -1.787 1.00 0.00 H new ATOM 0 HE ARG A 106 -0.471 2.960 0.221 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -0.491 5.590 -2.133 1.00 0.00 H new ATOM 0 HH12 ARG A 106 0.868 6.430 -1.379 1.00 0.00 H new ATOM 0 HH21 ARG A 106 1.274 4.045 1.185 1.00 0.00 H new ATOM 0 HH22 ARG A 106 1.863 5.560 0.492 1.00 0.00 H new ATOM 1574 N LEU A 107 -7.116 0.972 -2.206 1.00 0.00 N ATOM 1575 CA LEU A 107 -8.382 1.040 -2.928 1.00 0.00 C ATOM 1576 C LEU A 107 -9.208 2.236 -2.465 1.00 0.00 C ATOM 1577 O LEU A 107 -9.196 2.591 -1.287 1.00 0.00 O ATOM 1578 CB LEU A 107 -9.176 -0.252 -2.729 1.00 0.00 C ATOM 1579 CG LEU A 107 -8.547 -1.522 -3.302 1.00 0.00 C ATOM 1580 CD1 LEU A 107 -7.655 -2.190 -2.267 1.00 0.00 C ATOM 1581 CD2 LEU A 107 -9.625 -2.483 -3.780 1.00 0.00 C ATOM 0 H LEU A 107 -7.182 0.554 -1.278 1.00 0.00 H new ATOM 0 HA LEU A 107 -8.162 1.163 -3.988 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -9.331 -0.398 -1.660 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -10.160 -0.123 -3.180 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.931 -1.245 -4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -7.216 -3.092 -2.693 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -6.861 -1.504 -1.974 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -8.248 -2.454 -1.391 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.158 -3.381 -4.185 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -10.268 -2.754 -2.943 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -10.222 -2.003 -4.556 1.00 0.00 H new ATOM 1593 N GLN A 108 -9.927 2.849 -3.400 1.00 0.00 N ATOM 1594 CA GLN A 108 -10.761 4.004 -3.086 1.00 0.00 C ATOM 1595 C GLN A 108 -12.070 3.569 -2.436 1.00 0.00 C ATOM 1596 O GLN A 108 -12.410 2.386 -2.431 1.00 0.00 O ATOM 1597 CB GLN A 108 -11.050 4.810 -4.354 1.00 0.00 C ATOM 1598 CG GLN A 108 -12.030 4.130 -5.297 1.00 0.00 C ATOM 1599 CD GLN A 108 -11.413 2.957 -6.033 1.00 0.00 C ATOM 1600 OE1 GLN A 108 -11.465 1.819 -5.565 1.00 0.00 O ATOM 1601 NE2 GLN A 108 -10.824 3.228 -7.192 1.00 0.00 N ATOM 0 H GLN A 108 -9.949 2.566 -4.380 1.00 0.00 H new ATOM 0 HA GLN A 108 -10.218 4.633 -2.380 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -11.447 5.785 -4.072 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -10.114 4.988 -4.883 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -12.894 3.784 -4.730 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -12.395 4.857 -6.022 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -10.804 4.186 -7.542 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -10.391 2.478 -7.732 1.00 0.00 H new ATOM 1610 N VAL A 109 -12.802 4.534 -1.888 1.00 0.00 N ATOM 1611 CA VAL A 109 -14.074 4.251 -1.235 1.00 0.00 C ATOM 1612 C VAL A 109 -15.207 5.050 -1.870 1.00 0.00 C ATOM 1613 O VAL A 109 -15.499 6.170 -1.451 1.00 0.00 O ATOM 1614 CB VAL A 109 -14.016 4.570 0.270 1.00 0.00 C ATOM 1615 CG1 VAL A 109 -15.380 4.368 0.912 1.00 0.00 C ATOM 1616 CG2 VAL A 109 -12.963 3.713 0.956 1.00 0.00 C ATOM 0 H VAL A 109 -12.536 5.519 -1.884 1.00 0.00 H new ATOM 0 HA VAL A 109 -14.267 3.186 -1.365 1.00 0.00 H new ATOM 0 HB VAL A 109 -13.735 5.616 0.391 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -15.319 4.598 1.976 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -16.106 5.029 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -15.693 3.332 0.782 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -12.936 3.952 2.019 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -13.211 2.659 0.827 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -11.987 3.913 0.514 1.00 0.00 H new ATOM 1626 N GLN A 110 -15.841 4.467 -2.882 1.00 0.00 N ATOM 1627 CA GLN A 110 -16.942 5.126 -3.574 1.00 0.00 C ATOM 1628 C GLN A 110 -18.059 4.135 -3.887 1.00 0.00 C ATOM 1629 O GLN A 110 -17.844 3.143 -4.582 1.00 0.00 O ATOM 1630 CB GLN A 110 -16.444 5.776 -4.866 1.00 0.00 C ATOM 1631 CG GLN A 110 -17.227 7.016 -5.265 1.00 0.00 C ATOM 1632 CD GLN A 110 -18.431 6.693 -6.128 1.00 0.00 C ATOM 1633 OE1 GLN A 110 -19.313 5.934 -5.724 1.00 0.00 O ATOM 1634 NE2 GLN A 110 -18.475 7.269 -7.323 1.00 0.00 N ATOM 0 H GLN A 110 -15.611 3.540 -3.241 1.00 0.00 H new ATOM 0 HA GLN A 110 -17.340 5.899 -2.917 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -15.394 6.042 -4.747 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -16.498 5.047 -5.674 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -17.558 7.537 -4.367 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -16.570 7.698 -5.805 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -17.722 7.891 -7.617 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -19.262 7.089 -7.947 1.00 0.00 H new ATOM 1643 N ASN A 111 -19.251 4.413 -3.370 1.00 0.00 N ATOM 1644 CA ASN A 111 -20.402 3.545 -3.594 1.00 0.00 C ATOM 1645 C ASN A 111 -21.257 4.062 -4.746 1.00 0.00 C ATOM 1646 O ASN A 111 -22.312 4.658 -4.532 1.00 0.00 O ATOM 1647 CB ASN A 111 -21.246 3.445 -2.322 1.00 0.00 C ATOM 1648 CG ASN A 111 -22.156 2.232 -2.325 1.00 0.00 C ATOM 1649 OD1 ASN A 111 -23.375 2.355 -2.205 1.00 0.00 O ATOM 1650 ND2 ASN A 111 -21.565 1.050 -2.464 1.00 0.00 N ATOM 0 H ASN A 111 -19.446 5.232 -2.794 1.00 0.00 H new ATOM 0 HA ASN A 111 -20.033 2.553 -3.856 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -20.587 3.399 -1.455 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -21.848 4.347 -2.217 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -22.125 0.198 -2.474 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -20.551 0.995 -2.560 1.00 0.00 H new ATOM 1657 N GLY A 112 -20.794 3.829 -5.971 1.00 0.00 N ATOM 1658 CA GLY A 112 -21.529 4.277 -7.139 1.00 0.00 C ATOM 1659 C GLY A 112 -20.890 3.820 -8.436 1.00 0.00 C ATOM 1660 O GLY A 112 -20.269 4.602 -9.156 1.00 0.00 O ATOM 0 H GLY A 112 -19.923 3.338 -6.175 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -22.551 3.900 -7.088 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -21.590 5.365 -7.131 1.00 0.00 H new ATOM 1664 N PRO A 113 -21.040 2.525 -8.749 1.00 0.00 N ATOM 1665 CA PRO A 113 -20.479 1.936 -9.969 1.00 0.00 C ATOM 1666 C PRO A 113 -21.188 2.423 -11.228 1.00 0.00 C ATOM 1667 O PRO A 113 -20.855 2.009 -12.339 1.00 0.00 O ATOM 1668 CB PRO A 113 -20.706 0.434 -9.774 1.00 0.00 C ATOM 1669 CG PRO A 113 -21.871 0.344 -8.850 1.00 0.00 C ATOM 1670 CD PRO A 113 -21.769 1.536 -7.938 1.00 0.00 C ATOM 0 HA PRO A 113 -19.433 2.209 -10.109 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -20.914 -0.061 -10.722 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -19.825 -0.048 -9.349 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -22.810 0.355 -9.404 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -21.847 -0.586 -8.281 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -22.753 1.903 -7.645 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -21.233 1.295 -7.020 1.00 0.00 H new ATOM 1678 N ILE A 114 -22.166 3.304 -11.046 1.00 0.00 N ATOM 1679 CA ILE A 114 -22.921 3.848 -12.168 1.00 0.00 C ATOM 1680 C ILE A 114 -22.037 4.003 -13.402 1.00 0.00 C ATOM 1681 O ILE A 114 -20.855 4.329 -13.294 1.00 0.00 O ATOM 1682 CB ILE A 114 -23.540 5.215 -11.820 1.00 0.00 C ATOM 1683 CG1 ILE A 114 -22.550 6.058 -11.014 1.00 0.00 C ATOM 1684 CG2 ILE A 114 -24.837 5.026 -11.046 1.00 0.00 C ATOM 1685 CD1 ILE A 114 -22.773 7.547 -11.152 1.00 0.00 C ATOM 0 H ILE A 114 -22.454 3.656 -10.133 1.00 0.00 H new ATOM 0 HA ILE A 114 -23.721 3.140 -12.383 1.00 0.00 H new ATOM 0 HB ILE A 114 -23.765 5.742 -12.747 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -22.624 5.784 -9.962 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -21.536 5.819 -11.335 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -25.263 6.000 -10.807 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -25.544 4.460 -11.653 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -24.634 4.482 -10.123 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -22.036 8.082 -10.554 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -22.670 7.835 -12.198 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -23.775 7.799 -10.803 1.00 0.00 H new ATOM 1697 N SER A 115 -22.620 3.768 -14.573 1.00 0.00 N ATOM 1698 CA SER A 115 -21.885 3.880 -15.828 1.00 0.00 C ATOM 1699 C SER A 115 -22.843 3.973 -17.012 1.00 0.00 C ATOM 1700 O SER A 115 -24.057 3.843 -16.855 1.00 0.00 O ATOM 1701 CB SER A 115 -20.953 2.680 -16.005 1.00 0.00 C ATOM 1702 OG SER A 115 -19.773 2.833 -15.236 1.00 0.00 O ATOM 0 H SER A 115 -23.598 3.499 -14.679 1.00 0.00 H new ATOM 0 HA SER A 115 -21.289 4.792 -15.792 1.00 0.00 H new ATOM 0 HB2 SER A 115 -21.469 1.768 -15.707 1.00 0.00 H new ATOM 0 HB3 SER A 115 -20.693 2.570 -17.058 1.00 0.00 H new ATOM 0 HG SER A 115 -19.891 3.568 -14.599 1.00 0.00 H new ATOM 1708 N GLY A 116 -22.288 4.199 -18.198 1.00 0.00 N ATOM 1709 CA GLY A 116 -23.106 4.307 -19.392 1.00 0.00 C ATOM 1710 C GLY A 116 -22.518 3.552 -20.568 1.00 0.00 C ATOM 1711 O GLY A 116 -21.384 3.074 -20.522 1.00 0.00 O ATOM 0 H GLY A 116 -21.286 4.309 -18.354 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -24.104 3.924 -19.181 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -23.218 5.358 -19.658 1.00 0.00 H new ATOM 1715 N PRO A 117 -23.300 3.433 -21.651 1.00 0.00 N ATOM 1716 CA PRO A 117 -22.871 2.731 -22.864 1.00 0.00 C ATOM 1717 C PRO A 117 -21.778 3.484 -23.614 1.00 0.00 C ATOM 1718 O PRO A 117 -21.300 3.030 -24.654 1.00 0.00 O ATOM 1719 CB PRO A 117 -24.148 2.664 -23.705 1.00 0.00 C ATOM 1720 CG PRO A 117 -24.970 3.815 -23.239 1.00 0.00 C ATOM 1721 CD PRO A 117 -24.662 3.977 -21.776 1.00 0.00 C ATOM 0 HA PRO A 117 -22.440 1.755 -22.639 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -23.926 2.742 -24.769 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -24.670 1.719 -23.557 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -24.723 4.721 -23.793 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -26.032 3.625 -23.396 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -24.707 5.022 -21.469 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -25.371 3.431 -21.153 1.00 0.00 H new ATOM 1729 N SER A 118 -21.386 4.636 -23.081 1.00 0.00 N ATOM 1730 CA SER A 118 -20.351 5.454 -23.702 1.00 0.00 C ATOM 1731 C SER A 118 -20.427 5.362 -25.223 1.00 0.00 C ATOM 1732 O SER A 118 -19.432 5.079 -25.890 1.00 0.00 O ATOM 1733 CB SER A 118 -18.967 5.013 -23.222 1.00 0.00 C ATOM 1734 OG SER A 118 -18.670 5.562 -21.950 1.00 0.00 O ATOM 0 H SER A 118 -21.770 5.025 -22.220 1.00 0.00 H new ATOM 0 HA SER A 118 -20.516 6.491 -23.409 1.00 0.00 H new ATOM 0 HB2 SER A 118 -18.926 3.925 -23.171 1.00 0.00 H new ATOM 0 HB3 SER A 118 -18.212 5.327 -23.942 1.00 0.00 H new ATOM 0 HG SER A 118 -17.781 5.264 -21.665 1.00 0.00 H new ATOM 1740 N SER A 119 -21.616 5.606 -25.766 1.00 0.00 N ATOM 1741 CA SER A 119 -21.824 5.547 -27.208 1.00 0.00 C ATOM 1742 C SER A 119 -23.116 6.259 -27.599 1.00 0.00 C ATOM 1743 O SER A 119 -24.167 6.036 -27.000 1.00 0.00 O ATOM 1744 CB SER A 119 -21.867 4.093 -27.680 1.00 0.00 C ATOM 1745 OG SER A 119 -23.064 3.457 -27.265 1.00 0.00 O ATOM 0 H SER A 119 -22.449 5.846 -25.229 1.00 0.00 H new ATOM 0 HA SER A 119 -20.989 6.053 -27.692 1.00 0.00 H new ATOM 0 HB2 SER A 119 -21.791 4.058 -28.767 1.00 0.00 H new ATOM 0 HB3 SER A 119 -21.008 3.553 -27.282 1.00 0.00 H new ATOM 0 HG SER A 119 -23.068 2.529 -27.580 1.00 0.00 H new ATOM 1751 N GLY A 120 -23.027 7.119 -28.609 1.00 0.00 N ATOM 1752 CA GLY A 120 -24.195 7.852 -29.064 1.00 0.00 C ATOM 1753 C GLY A 120 -24.307 9.221 -28.422 1.00 0.00 C ATOM 1754 O GLY A 120 -24.891 9.364 -27.348 1.00 0.00 O ATOM 0 H GLY A 120 -22.168 7.321 -29.120 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -24.150 7.965 -30.147 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -25.092 7.275 -28.840 1.00 0.00 H new TER 1758 GLY A 120