USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 743 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 7 SER OG : rot 180:sc= -1.21 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.144 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= -0.991! USER MOD Single : A 33 ASN :FLIP amide:sc= 0.28 F(o=-1.5!,f=0.28) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 38 THR OG1 : rot 42:sc= 0.0221 USER MOD Single : A 43 THR OG1 : rot 17:sc= 0.627 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.621 USER MOD Single : A 49 GLN : amide:sc= -1.14 X(o=-1.1,f=-0.82) USER MOD Single : B 7 SER OG : rot 180:sc= 0.00678 USER MOD Single : B 9 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= -0.173 USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 TYR OH : rot 136:sc= -0.657! USER MOD Single : B 33 ASN :FLIP amide:sc= 0.251 F(o=-1.6!,f=0.25) USER MOD Single : B 36 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : B 38 THR OG1 : rot 43:sc= 0.141 USER MOD Single : B 45 THR OG1 : rot 180:sc= -0.396 USER MOD Single : B 49 GLN : amide:sc= -0.683 X(o=-0.68,f=-0.87) USER MOD ----------------------------------------------------------------- ATOM 16 N ARG A 3 3.510 -2.371 0.761 1.00 0.00 N ATOM 17 CA ARG A 3 4.932 -2.567 1.017 1.00 0.00 C ATOM 18 C ARG A 3 5.524 -3.585 0.046 1.00 0.00 C ATOM 19 O ARG A 3 4.849 -4.528 -0.368 1.00 0.00 O ATOM 20 CB ARG A 3 5.154 -3.032 2.458 1.00 0.00 C ATOM 21 CG ARG A 3 6.619 -3.177 2.832 1.00 0.00 C ATOM 22 CD ARG A 3 7.042 -4.637 2.874 1.00 0.00 C ATOM 23 NE ARG A 3 6.323 -5.385 3.901 1.00 0.00 N ATOM 24 CZ ARG A 3 6.532 -5.232 5.204 1.00 0.00 C ATOM 25 NH1 ARG A 3 7.434 -4.362 5.636 1.00 0.00 N ATOM 26 NH2 ARG A 3 5.837 -5.950 6.078 1.00 0.00 N ATOM 0 HA ARG A 3 5.437 -1.612 0.869 1.00 0.00 H new ATOM 0 HB2 ARG A 3 4.683 -2.321 3.137 1.00 0.00 H new ATOM 0 HB3 ARG A 3 4.654 -3.990 2.603 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.235 -2.639 2.111 1.00 0.00 H new ATOM 0 HG3 ARG A 3 6.794 -2.718 3.805 1.00 0.00 H new ATOM 0 HD2 ARG A 3 6.864 -5.094 1.901 1.00 0.00 H new ATOM 0 HD3 ARG A 3 8.114 -4.699 3.064 1.00 0.00 H new ATOM 0 HE ARG A 3 5.622 -6.062 3.602 1.00 0.00 H new ATOM 0 HH11 ARG A 3 7.969 -3.808 4.967 1.00 0.00 H new ATOM 0 HH12 ARG A 3 7.593 -4.246 6.637 1.00 0.00 H new ATOM 0 HH21 ARG A 3 5.142 -6.620 5.749 1.00 0.00 H new ATOM 0 HH22 ARG A 3 5.998 -5.832 7.078 1.00 0.00 H new ATOM 40 N VAL A 4 6.788 -3.387 -0.312 1.00 0.00 N ATOM 41 CA VAL A 4 7.471 -4.288 -1.233 1.00 0.00 C ATOM 42 C VAL A 4 8.830 -4.710 -0.684 1.00 0.00 C ATOM 43 O VAL A 4 9.668 -3.868 -0.360 1.00 0.00 O ATOM 44 CB VAL A 4 7.669 -3.635 -2.614 1.00 0.00 C ATOM 45 CG1 VAL A 4 8.324 -4.612 -3.579 1.00 0.00 C ATOM 46 CG2 VAL A 4 6.339 -3.140 -3.164 1.00 0.00 C ATOM 0 H VAL A 4 7.360 -2.611 0.021 1.00 0.00 H new ATOM 0 HA VAL A 4 6.837 -5.168 -1.342 1.00 0.00 H new ATOM 0 HB VAL A 4 8.331 -2.777 -2.499 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.455 -4.132 -4.549 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.296 -4.913 -3.188 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.690 -5.492 -3.692 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.497 -2.681 -4.140 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.652 -3.980 -3.265 1.00 0.00 H new ATOM 0 HG23 VAL A 4 5.915 -2.404 -2.482 1.00 0.00 H new ATOM 56 N ARG A 5 9.040 -6.018 -0.582 1.00 0.00 N ATOM 57 CA ARG A 5 10.297 -6.552 -0.071 1.00 0.00 C ATOM 58 C ARG A 5 10.855 -7.619 -1.008 1.00 0.00 C ATOM 59 O ARG A 5 10.153 -8.559 -1.382 1.00 0.00 O ATOM 60 CB ARG A 5 10.095 -7.140 1.327 1.00 0.00 C ATOM 61 CG ARG A 5 11.307 -7.892 1.852 1.00 0.00 C ATOM 62 CD ARG A 5 10.994 -9.363 2.080 1.00 0.00 C ATOM 63 NE ARG A 5 10.732 -9.655 3.487 1.00 0.00 N ATOM 64 CZ ARG A 5 10.325 -10.840 3.928 1.00 0.00 C ATOM 65 NH1 ARG A 5 10.134 -11.838 3.076 1.00 0.00 N ATOM 66 NH2 ARG A 5 10.108 -11.028 5.223 1.00 0.00 N ATOM 0 H ARG A 5 8.356 -6.727 -0.846 1.00 0.00 H new ATOM 0 HA ARG A 5 11.014 -5.733 -0.013 1.00 0.00 H new ATOM 0 HB2 ARG A 5 9.850 -6.334 2.019 1.00 0.00 H new ATOM 0 HB3 ARG A 5 9.239 -7.815 1.308 1.00 0.00 H new ATOM 0 HG2 ARG A 5 12.129 -7.800 1.143 1.00 0.00 H new ATOM 0 HG3 ARG A 5 11.640 -7.441 2.787 1.00 0.00 H new ATOM 0 HD2 ARG A 5 10.127 -9.646 1.483 1.00 0.00 H new ATOM 0 HD3 ARG A 5 11.831 -9.970 1.734 1.00 0.00 H new ATOM 0 HE ARG A 5 10.869 -8.908 4.168 1.00 0.00 H new ATOM 0 HH11 ARG A 5 10.300 -11.697 2.080 1.00 0.00 H new ATOM 0 HH12 ARG A 5 9.821 -12.747 3.417 1.00 0.00 H new ATOM 0 HH21 ARG A 5 10.254 -10.262 5.881 1.00 0.00 H new ATOM 0 HH22 ARG A 5 9.795 -11.938 5.561 1.00 0.00 H new ATOM 80 N ILE A 6 12.121 -7.466 -1.383 1.00 0.00 N ATOM 81 CA ILE A 6 12.773 -8.416 -2.275 1.00 0.00 C ATOM 82 C ILE A 6 14.054 -8.964 -1.655 1.00 0.00 C ATOM 83 O ILE A 6 14.939 -8.204 -1.263 1.00 0.00 O ATOM 84 CB ILE A 6 13.108 -7.774 -3.634 1.00 0.00 C ATOM 85 CG1 ILE A 6 11.843 -7.202 -4.278 1.00 0.00 C ATOM 86 CG2 ILE A 6 13.764 -8.792 -4.554 1.00 0.00 C ATOM 87 CD1 ILE A 6 12.108 -6.443 -5.560 1.00 0.00 C ATOM 0 H ILE A 6 12.715 -6.693 -1.083 1.00 0.00 H new ATOM 0 HA ILE A 6 12.070 -9.234 -2.432 1.00 0.00 H new ATOM 0 HB ILE A 6 13.811 -6.957 -3.470 1.00 0.00 H new ATOM 0 HG12 ILE A 6 11.150 -8.017 -4.485 1.00 0.00 H new ATOM 0 HG13 ILE A 6 11.351 -6.538 -3.567 1.00 0.00 H new ATOM 0 HG21 ILE A 6 13.995 -8.323 -5.510 1.00 0.00 H new ATOM 0 HG22 ILE A 6 14.684 -9.156 -4.097 1.00 0.00 H new ATOM 0 HG23 ILE A 6 13.084 -9.628 -4.715 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.167 -6.066 -5.961 1.00 0.00 H new ATOM 0 HD12 ILE A 6 12.777 -5.607 -5.356 1.00 0.00 H new ATOM 0 HD13 ILE A 6 12.572 -7.109 -6.288 1.00 0.00 H new ATOM 99 N SER A 7 14.145 -10.287 -1.570 1.00 0.00 N ATOM 100 CA SER A 7 15.317 -10.937 -0.995 1.00 0.00 C ATOM 101 C SER A 7 16.080 -11.720 -2.059 1.00 0.00 C ATOM 102 O SER A 7 15.503 -12.537 -2.777 1.00 0.00 O ATOM 103 CB SER A 7 14.902 -11.871 0.143 1.00 0.00 C ATOM 104 OG SER A 7 13.604 -11.554 0.615 1.00 0.00 O ATOM 0 H SER A 7 13.421 -10.930 -1.892 1.00 0.00 H new ATOM 0 HA SER A 7 15.973 -10.163 -0.598 1.00 0.00 H new ATOM 0 HB2 SER A 7 14.924 -12.904 -0.204 1.00 0.00 H new ATOM 0 HB3 SER A 7 15.619 -11.794 0.961 1.00 0.00 H new ATOM 0 HG SER A 7 13.361 -12.166 1.341 1.00 0.00 H new ATOM 110 N ILE A 8 17.381 -11.465 -2.153 1.00 0.00 N ATOM 111 CA ILE A 8 18.224 -12.146 -3.128 1.00 0.00 C ATOM 112 C ILE A 8 19.200 -13.096 -2.442 1.00 0.00 C ATOM 113 O ILE A 8 19.823 -12.747 -1.439 1.00 0.00 O ATOM 114 CB ILE A 8 19.018 -11.143 -3.985 1.00 0.00 C ATOM 115 CG1 ILE A 8 20.056 -10.416 -3.127 1.00 0.00 C ATOM 116 CG2 ILE A 8 18.076 -10.147 -4.643 1.00 0.00 C ATOM 117 CD1 ILE A 8 20.721 -9.257 -3.836 1.00 0.00 C ATOM 0 H ILE A 8 17.874 -10.792 -1.566 1.00 0.00 H new ATOM 0 HA ILE A 8 17.559 -12.717 -3.776 1.00 0.00 H new ATOM 0 HB ILE A 8 19.541 -11.691 -4.769 1.00 0.00 H new ATOM 0 HG12 ILE A 8 19.574 -10.049 -2.221 1.00 0.00 H new ATOM 0 HG13 ILE A 8 20.821 -11.128 -2.815 1.00 0.00 H new ATOM 0 HG21 ILE A 8 18.652 -9.445 -5.245 1.00 0.00 H new ATOM 0 HG22 ILE A 8 17.371 -10.680 -5.282 1.00 0.00 H new ATOM 0 HG23 ILE A 8 17.528 -9.602 -3.874 1.00 0.00 H new ATOM 0 HD11 ILE A 8 21.444 -8.789 -3.168 1.00 0.00 H new ATOM 0 HD12 ILE A 8 21.232 -9.621 -4.727 1.00 0.00 H new ATOM 0 HD13 ILE A 8 19.966 -8.525 -4.124 1.00 0.00 H new ATOM 129 N THR A 9 19.329 -14.301 -2.990 1.00 0.00 N ATOM 130 CA THR A 9 20.229 -15.301 -2.432 1.00 0.00 C ATOM 131 C THR A 9 21.383 -15.595 -3.384 1.00 0.00 C ATOM 132 O THR A 9 21.259 -16.422 -4.288 1.00 0.00 O ATOM 133 CB THR A 9 19.487 -16.615 -2.122 1.00 0.00 C ATOM 134 OG1 THR A 9 18.101 -16.349 -1.881 1.00 0.00 O ATOM 135 CG2 THR A 9 20.094 -17.307 -0.911 1.00 0.00 C ATOM 0 H THR A 9 18.821 -14.607 -3.820 1.00 0.00 H new ATOM 0 HA THR A 9 20.623 -14.888 -1.504 1.00 0.00 H new ATOM 0 HB THR A 9 19.586 -17.275 -2.984 1.00 0.00 H new ATOM 0 HG1 THR A 9 17.636 -17.189 -1.686 1.00 0.00 H new ATOM 0 HG21 THR A 9 19.553 -18.232 -0.712 1.00 0.00 H new ATOM 0 HG22 THR A 9 21.142 -17.534 -1.109 1.00 0.00 H new ATOM 0 HG23 THR A 9 20.023 -16.651 -0.043 1.00 0.00 H new ATOM 143 N ALA A 10 22.505 -14.914 -3.176 1.00 0.00 N ATOM 144 CA ALA A 10 23.681 -15.104 -4.015 1.00 0.00 C ATOM 145 C ALA A 10 24.741 -15.931 -3.294 1.00 0.00 C ATOM 146 O ALA A 10 24.639 -16.177 -2.092 1.00 0.00 O ATOM 147 CB ALA A 10 24.254 -13.758 -4.434 1.00 0.00 C ATOM 0 H ALA A 10 22.624 -14.225 -2.433 1.00 0.00 H new ATOM 0 HA ALA A 10 23.376 -15.650 -4.908 1.00 0.00 H new ATOM 0 HB1 ALA A 10 25.132 -13.915 -5.060 1.00 0.00 H new ATOM 0 HB2 ALA A 10 23.503 -13.202 -4.995 1.00 0.00 H new ATOM 0 HB3 ALA A 10 24.538 -13.191 -3.547 1.00 0.00 H new ATOM 153 N ARG A 11 25.757 -16.358 -4.037 1.00 0.00 N ATOM 154 CA ARG A 11 26.834 -17.159 -3.468 1.00 0.00 C ATOM 155 C ARG A 11 27.834 -16.278 -2.725 1.00 0.00 C ATOM 156 O ARG A 11 28.385 -16.675 -1.697 1.00 0.00 O ATOM 157 CB ARG A 11 27.551 -17.944 -4.569 1.00 0.00 C ATOM 158 CG ARG A 11 28.301 -17.063 -5.555 1.00 0.00 C ATOM 159 CD ARG A 11 28.802 -17.862 -6.748 1.00 0.00 C ATOM 160 NE ARG A 11 30.021 -18.604 -6.437 1.00 0.00 N ATOM 161 CZ ARG A 11 30.739 -19.252 -7.347 1.00 0.00 C ATOM 162 NH1 ARG A 11 30.363 -19.250 -8.618 1.00 0.00 N ATOM 163 NH2 ARG A 11 31.837 -19.905 -6.986 1.00 0.00 N ATOM 0 H ARG A 11 25.857 -16.163 -5.033 1.00 0.00 H new ATOM 0 HA ARG A 11 26.395 -17.859 -2.758 1.00 0.00 H new ATOM 0 HB2 ARG A 11 28.253 -18.640 -4.109 1.00 0.00 H new ATOM 0 HB3 ARG A 11 26.819 -18.542 -5.112 1.00 0.00 H new ATOM 0 HG2 ARG A 11 27.646 -16.263 -5.901 1.00 0.00 H new ATOM 0 HG3 ARG A 11 29.145 -16.590 -5.053 1.00 0.00 H new ATOM 0 HD2 ARG A 11 28.027 -18.557 -7.070 1.00 0.00 H new ATOM 0 HD3 ARG A 11 28.991 -17.187 -7.583 1.00 0.00 H new ATOM 0 HE ARG A 11 30.338 -18.626 -5.468 1.00 0.00 H new ATOM 0 HH11 ARG A 11 29.520 -18.750 -8.900 1.00 0.00 H new ATOM 0 HH12 ARG A 11 30.917 -19.749 -9.314 1.00 0.00 H new ATOM 0 HH21 ARG A 11 32.130 -19.909 -6.009 1.00 0.00 H new ATOM 0 HH22 ARG A 11 32.388 -20.402 -7.686 1.00 0.00 H new ATOM 177 N THR A 12 28.063 -15.079 -3.251 1.00 0.00 N ATOM 178 CA THR A 12 28.997 -14.142 -2.639 1.00 0.00 C ATOM 179 C THR A 12 28.347 -12.779 -2.426 1.00 0.00 C ATOM 180 O THR A 12 27.366 -12.437 -3.086 1.00 0.00 O ATOM 181 CB THR A 12 30.262 -13.966 -3.500 1.00 0.00 C ATOM 182 OG1 THR A 12 31.023 -12.848 -3.029 1.00 0.00 O ATOM 183 CG2 THR A 12 29.897 -13.758 -4.962 1.00 0.00 C ATOM 0 H THR A 12 27.614 -14.734 -4.100 1.00 0.00 H new ATOM 0 HA THR A 12 29.280 -14.562 -1.674 1.00 0.00 H new ATOM 0 HB THR A 12 30.860 -14.873 -3.417 1.00 0.00 H new ATOM 0 HG1 THR A 12 31.826 -12.744 -3.580 1.00 0.00 H new ATOM 0 HG21 THR A 12 30.806 -13.636 -5.550 1.00 0.00 H new ATOM 0 HG22 THR A 12 29.343 -14.624 -5.325 1.00 0.00 H new ATOM 0 HG23 THR A 12 29.280 -12.865 -5.059 1.00 0.00 H new ATOM 191 N LYS A 13 28.902 -12.003 -1.501 1.00 0.00 N ATOM 192 CA LYS A 13 28.378 -10.675 -1.202 1.00 0.00 C ATOM 193 C LYS A 13 28.536 -9.745 -2.401 1.00 0.00 C ATOM 194 O LYS A 13 27.696 -8.877 -2.641 1.00 0.00 O ATOM 195 CB LYS A 13 29.096 -10.083 0.013 1.00 0.00 C ATOM 196 CG LYS A 13 30.606 -10.024 -0.141 1.00 0.00 C ATOM 197 CD LYS A 13 31.307 -10.088 1.205 1.00 0.00 C ATOM 198 CE LYS A 13 31.830 -8.723 1.626 1.00 0.00 C ATOM 199 NZ LYS A 13 30.830 -7.971 2.435 1.00 0.00 N ATOM 0 H LYS A 13 29.714 -12.271 -0.945 1.00 0.00 H new ATOM 0 HA LYS A 13 27.316 -10.773 -0.977 1.00 0.00 H new ATOM 0 HB2 LYS A 13 28.718 -9.077 0.193 1.00 0.00 H new ATOM 0 HB3 LYS A 13 28.852 -10.677 0.894 1.00 0.00 H new ATOM 0 HG2 LYS A 13 30.941 -10.851 -0.766 1.00 0.00 H new ATOM 0 HG3 LYS A 13 30.885 -9.103 -0.654 1.00 0.00 H new ATOM 0 HD2 LYS A 13 30.615 -10.462 1.959 1.00 0.00 H new ATOM 0 HD3 LYS A 13 32.134 -10.796 1.152 1.00 0.00 H new ATOM 0 HE2 LYS A 13 32.745 -8.847 2.204 1.00 0.00 H new ATOM 0 HE3 LYS A 13 32.089 -8.144 0.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 31.224 -7.046 2.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 29.965 -7.830 1.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 30.601 -8.511 3.294 1.00 0.00 H new ATOM 213 N LYS A 14 29.616 -9.933 -3.152 1.00 0.00 N ATOM 214 CA LYS A 14 29.882 -9.113 -4.328 1.00 0.00 C ATOM 215 C LYS A 14 28.732 -9.203 -5.326 1.00 0.00 C ATOM 216 O LYS A 14 28.322 -8.197 -5.904 1.00 0.00 O ATOM 217 CB LYS A 14 31.187 -9.553 -4.997 1.00 0.00 C ATOM 218 CG LYS A 14 32.302 -8.529 -4.887 1.00 0.00 C ATOM 219 CD LYS A 14 32.833 -8.432 -3.466 1.00 0.00 C ATOM 220 CE LYS A 14 32.316 -7.187 -2.762 1.00 0.00 C ATOM 221 NZ LYS A 14 33.365 -6.136 -2.652 1.00 0.00 N ATOM 0 H LYS A 14 30.321 -10.646 -2.967 1.00 0.00 H new ATOM 0 HA LYS A 14 29.978 -8.077 -4.003 1.00 0.00 H new ATOM 0 HB2 LYS A 14 31.519 -10.489 -4.547 1.00 0.00 H new ATOM 0 HB3 LYS A 14 30.995 -9.757 -6.050 1.00 0.00 H new ATOM 0 HG2 LYS A 14 33.114 -8.800 -5.562 1.00 0.00 H new ATOM 0 HG3 LYS A 14 31.934 -7.554 -5.206 1.00 0.00 H new ATOM 0 HD2 LYS A 14 32.537 -9.318 -2.905 1.00 0.00 H new ATOM 0 HD3 LYS A 14 33.923 -8.415 -3.484 1.00 0.00 H new ATOM 0 HE2 LYS A 14 31.460 -6.790 -3.308 1.00 0.00 H new ATOM 0 HE3 LYS A 14 31.963 -7.453 -1.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 32.973 -5.304 -2.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 34.171 -6.506 -2.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 33.684 -5.863 -3.603 1.00 0.00 H new ATOM 235 N GLU A 15 28.216 -10.412 -5.520 1.00 0.00 N ATOM 236 CA GLU A 15 27.112 -10.631 -6.448 1.00 0.00 C ATOM 237 C GLU A 15 25.837 -9.960 -5.944 1.00 0.00 C ATOM 238 O GLU A 15 25.161 -9.251 -6.689 1.00 0.00 O ATOM 239 CB GLU A 15 26.870 -12.129 -6.643 1.00 0.00 C ATOM 240 CG GLU A 15 27.540 -12.697 -7.883 1.00 0.00 C ATOM 241 CD GLU A 15 26.701 -12.519 -9.133 1.00 0.00 C ATOM 242 OE1 GLU A 15 25.768 -13.322 -9.340 1.00 0.00 O ATOM 243 OE2 GLU A 15 26.978 -11.576 -9.904 1.00 0.00 O ATOM 0 H GLU A 15 28.544 -11.254 -5.048 1.00 0.00 H new ATOM 0 HA GLU A 15 27.382 -10.186 -7.406 1.00 0.00 H new ATOM 0 HB2 GLU A 15 27.234 -12.664 -5.766 1.00 0.00 H new ATOM 0 HB3 GLU A 15 25.797 -12.310 -6.705 1.00 0.00 H new ATOM 0 HG2 GLU A 15 28.505 -12.210 -8.025 1.00 0.00 H new ATOM 0 HG3 GLU A 15 27.738 -13.758 -7.731 1.00 0.00 H new ATOM 250 N ALA A 16 25.517 -10.189 -4.675 1.00 0.00 N ATOM 251 CA ALA A 16 24.325 -9.607 -4.071 1.00 0.00 C ATOM 252 C ALA A 16 24.370 -8.083 -4.126 1.00 0.00 C ATOM 253 O ALA A 16 23.364 -7.433 -4.407 1.00 0.00 O ATOM 254 CB ALA A 16 24.176 -10.081 -2.633 1.00 0.00 C ATOM 0 H ALA A 16 26.067 -10.773 -4.045 1.00 0.00 H new ATOM 0 HA ALA A 16 23.459 -9.940 -4.643 1.00 0.00 H new ATOM 0 HB1 ALA A 16 23.282 -9.638 -2.195 1.00 0.00 H new ATOM 0 HB2 ALA A 16 24.089 -11.167 -2.615 1.00 0.00 H new ATOM 0 HB3 ALA A 16 25.050 -9.777 -2.057 1.00 0.00 H new ATOM 260 N GLU A 17 25.544 -7.521 -3.854 1.00 0.00 N ATOM 261 CA GLU A 17 25.719 -6.074 -3.871 1.00 0.00 C ATOM 262 C GLU A 17 25.373 -5.500 -5.242 1.00 0.00 C ATOM 263 O GLU A 17 24.760 -4.437 -5.346 1.00 0.00 O ATOM 264 CB GLU A 17 27.158 -5.707 -3.501 1.00 0.00 C ATOM 265 CG GLU A 17 27.288 -5.058 -2.134 1.00 0.00 C ATOM 266 CD GLU A 17 27.662 -3.590 -2.218 1.00 0.00 C ATOM 267 OE1 GLU A 17 28.839 -3.293 -2.510 1.00 0.00 O ATOM 268 OE2 GLU A 17 26.776 -2.740 -1.992 1.00 0.00 O ATOM 0 H GLU A 17 26.387 -8.046 -3.620 1.00 0.00 H new ATOM 0 HA GLU A 17 25.041 -5.644 -3.134 1.00 0.00 H new ATOM 0 HB2 GLU A 17 27.772 -6.608 -3.526 1.00 0.00 H new ATOM 0 HB3 GLU A 17 27.556 -5.029 -4.255 1.00 0.00 H new ATOM 0 HG2 GLU A 17 26.345 -5.159 -1.597 1.00 0.00 H new ATOM 0 HG3 GLU A 17 28.043 -5.589 -1.554 1.00 0.00 H new ATOM 275 N LYS A 18 25.770 -6.210 -6.292 1.00 0.00 N ATOM 276 CA LYS A 18 25.502 -5.774 -7.657 1.00 0.00 C ATOM 277 C LYS A 18 24.003 -5.747 -7.935 1.00 0.00 C ATOM 278 O LYS A 18 23.512 -4.885 -8.665 1.00 0.00 O ATOM 279 CB LYS A 18 26.200 -6.700 -8.656 1.00 0.00 C ATOM 280 CG LYS A 18 27.707 -6.766 -8.475 1.00 0.00 C ATOM 281 CD LYS A 18 28.421 -5.775 -9.379 1.00 0.00 C ATOM 282 CE LYS A 18 29.717 -5.283 -8.752 1.00 0.00 C ATOM 283 NZ LYS A 18 30.193 -4.021 -9.382 1.00 0.00 N ATOM 0 H LYS A 18 26.279 -7.091 -6.224 1.00 0.00 H new ATOM 0 HA LYS A 18 25.893 -4.763 -7.773 1.00 0.00 H new ATOM 0 HB2 LYS A 18 25.787 -7.704 -8.558 1.00 0.00 H new ATOM 0 HB3 LYS A 18 25.979 -6.361 -9.668 1.00 0.00 H new ATOM 0 HG2 LYS A 18 27.959 -6.558 -7.435 1.00 0.00 H new ATOM 0 HG3 LYS A 18 28.057 -7.775 -8.692 1.00 0.00 H new ATOM 0 HD2 LYS A 18 28.635 -6.245 -10.339 1.00 0.00 H new ATOM 0 HD3 LYS A 18 27.767 -4.926 -9.579 1.00 0.00 H new ATOM 0 HE2 LYS A 18 29.566 -5.122 -7.685 1.00 0.00 H new ATOM 0 HE3 LYS A 18 30.484 -6.051 -8.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 31.078 -3.718 -8.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 30.362 -4.181 -10.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 29.472 -3.281 -9.264 1.00 0.00 H new ATOM 297 N PHE A 19 23.279 -6.694 -7.348 1.00 0.00 N ATOM 298 CA PHE A 19 21.835 -6.777 -7.532 1.00 0.00 C ATOM 299 C PHE A 19 21.125 -5.651 -6.787 1.00 0.00 C ATOM 300 O PHE A 19 20.229 -5.003 -7.326 1.00 0.00 O ATOM 301 CB PHE A 19 21.315 -8.132 -7.047 1.00 0.00 C ATOM 302 CG PHE A 19 21.552 -9.249 -8.023 1.00 0.00 C ATOM 303 CD1 PHE A 19 20.826 -9.323 -9.201 1.00 0.00 C ATOM 304 CD2 PHE A 19 22.500 -10.226 -7.762 1.00 0.00 C ATOM 305 CE1 PHE A 19 21.042 -10.350 -10.101 1.00 0.00 C ATOM 306 CE2 PHE A 19 22.720 -11.254 -8.658 1.00 0.00 C ATOM 307 CZ PHE A 19 21.989 -11.317 -9.829 1.00 0.00 C ATOM 0 H PHE A 19 23.669 -7.415 -6.741 1.00 0.00 H new ATOM 0 HA PHE A 19 21.623 -6.674 -8.596 1.00 0.00 H new ATOM 0 HB2 PHE A 19 21.796 -8.379 -6.100 1.00 0.00 H new ATOM 0 HB3 PHE A 19 20.246 -8.053 -6.850 1.00 0.00 H new ATOM 0 HD1 PHE A 19 20.083 -8.570 -9.418 1.00 0.00 H new ATOM 0 HD2 PHE A 19 23.073 -10.183 -6.848 1.00 0.00 H new ATOM 0 HE1 PHE A 19 20.470 -10.396 -11.016 1.00 0.00 H new ATOM 0 HE2 PHE A 19 23.463 -12.008 -8.444 1.00 0.00 H new ATOM 0 HZ PHE A 19 22.158 -12.121 -10.530 1.00 0.00 H new ATOM 317 N ALA A 20 21.532 -5.425 -5.542 1.00 0.00 N ATOM 318 CA ALA A 20 20.938 -4.377 -4.722 1.00 0.00 C ATOM 319 C ALA A 20 21.023 -3.022 -5.416 1.00 0.00 C ATOM 320 O ALA A 20 20.055 -2.262 -5.436 1.00 0.00 O ATOM 321 CB ALA A 20 21.619 -4.320 -3.363 1.00 0.00 C ATOM 0 H ALA A 20 22.271 -5.954 -5.079 1.00 0.00 H new ATOM 0 HA ALA A 20 19.884 -4.616 -4.578 1.00 0.00 H new ATOM 0 HB1 ALA A 20 21.165 -3.533 -2.761 1.00 0.00 H new ATOM 0 HB2 ALA A 20 21.501 -5.278 -2.856 1.00 0.00 H new ATOM 0 HB3 ALA A 20 22.680 -4.109 -3.496 1.00 0.00 H new ATOM 327 N ALA A 21 22.187 -2.725 -5.983 1.00 0.00 N ATOM 328 CA ALA A 21 22.398 -1.462 -6.680 1.00 0.00 C ATOM 329 C ALA A 21 21.297 -1.210 -7.704 1.00 0.00 C ATOM 330 O ALA A 21 20.742 -0.113 -7.775 1.00 0.00 O ATOM 331 CB ALA A 21 23.762 -1.452 -7.354 1.00 0.00 C ATOM 0 H ALA A 21 22.999 -3.342 -5.974 1.00 0.00 H new ATOM 0 HA ALA A 21 22.364 -0.659 -5.944 1.00 0.00 H new ATOM 0 HB1 ALA A 21 23.906 -0.503 -7.870 1.00 0.00 H new ATOM 0 HB2 ALA A 21 24.541 -1.577 -6.602 1.00 0.00 H new ATOM 0 HB3 ALA A 21 23.818 -2.269 -8.074 1.00 0.00 H new ATOM 337 N ILE A 22 20.988 -2.231 -8.497 1.00 0.00 N ATOM 338 CA ILE A 22 19.953 -2.119 -9.517 1.00 0.00 C ATOM 339 C ILE A 22 18.573 -1.968 -8.886 1.00 0.00 C ATOM 340 O ILE A 22 17.804 -1.078 -9.253 1.00 0.00 O ATOM 341 CB ILE A 22 19.948 -3.344 -10.450 1.00 0.00 C ATOM 342 CG1 ILE A 22 21.305 -3.492 -11.141 1.00 0.00 C ATOM 343 CG2 ILE A 22 18.834 -3.221 -11.479 1.00 0.00 C ATOM 344 CD1 ILE A 22 21.682 -4.928 -11.430 1.00 0.00 C ATOM 0 H ILE A 22 21.440 -3.144 -8.452 1.00 0.00 H new ATOM 0 HA ILE A 22 20.181 -1.228 -10.102 1.00 0.00 H new ATOM 0 HB ILE A 22 19.767 -4.237 -9.852 1.00 0.00 H new ATOM 0 HG12 ILE A 22 21.290 -2.933 -12.077 1.00 0.00 H new ATOM 0 HG13 ILE A 22 22.074 -3.042 -10.513 1.00 0.00 H new ATOM 0 HG21 ILE A 22 18.843 -4.094 -12.131 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.873 -3.159 -10.969 1.00 0.00 H new ATOM 0 HG23 ILE A 22 18.987 -2.321 -12.075 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.655 -4.957 -11.920 1.00 0.00 H new ATOM 0 HD12 ILE A 22 21.730 -5.487 -10.495 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.933 -5.376 -12.083 1.00 0.00 H new ATOM 356 N LEU A 23 18.265 -2.842 -7.934 1.00 0.00 N ATOM 357 CA LEU A 23 16.977 -2.805 -7.250 1.00 0.00 C ATOM 358 C LEU A 23 16.699 -1.415 -6.687 1.00 0.00 C ATOM 359 O LEU A 23 15.573 -0.922 -6.753 1.00 0.00 O ATOM 360 CB LEU A 23 16.947 -3.839 -6.123 1.00 0.00 C ATOM 361 CG LEU A 23 16.086 -5.078 -6.372 1.00 0.00 C ATOM 362 CD1 LEU A 23 14.624 -4.690 -6.526 1.00 0.00 C ATOM 363 CD2 LEU A 23 16.573 -5.827 -7.604 1.00 0.00 C ATOM 0 H LEU A 23 18.889 -3.584 -7.618 1.00 0.00 H new ATOM 0 HA LEU A 23 16.200 -3.045 -7.976 1.00 0.00 H new ATOM 0 HB2 LEU A 23 17.969 -4.164 -5.928 1.00 0.00 H new ATOM 0 HB3 LEU A 23 16.590 -3.349 -5.217 1.00 0.00 H new ATOM 0 HG LEU A 23 16.177 -5.739 -5.510 1.00 0.00 H new ATOM 0 HD11 LEU A 23 14.027 -5.585 -6.703 1.00 0.00 H new ATOM 0 HD12 LEU A 23 14.280 -4.198 -5.616 1.00 0.00 H new ATOM 0 HD13 LEU A 23 14.515 -4.009 -7.370 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.949 -6.706 -7.766 1.00 0.00 H new ATOM 0 HD22 LEU A 23 16.513 -5.174 -8.474 1.00 0.00 H new ATOM 0 HD23 LEU A 23 17.607 -6.139 -7.455 1.00 0.00 H new ATOM 375 N ILE A 24 17.733 -0.788 -6.136 1.00 0.00 N ATOM 376 CA ILE A 24 17.600 0.547 -5.565 1.00 0.00 C ATOM 377 C ILE A 24 17.131 1.549 -6.614 1.00 0.00 C ATOM 378 O ILE A 24 16.268 2.386 -6.348 1.00 0.00 O ATOM 379 CB ILE A 24 18.930 1.036 -4.961 1.00 0.00 C ATOM 380 CG1 ILE A 24 19.376 0.104 -3.833 1.00 0.00 C ATOM 381 CG2 ILE A 24 18.787 2.463 -4.453 1.00 0.00 C ATOM 382 CD1 ILE A 24 20.877 -0.062 -3.745 1.00 0.00 C ATOM 0 H ILE A 24 18.671 -1.183 -6.073 1.00 0.00 H new ATOM 0 HA ILE A 24 16.854 0.479 -4.773 1.00 0.00 H new ATOM 0 HB ILE A 24 19.693 1.023 -5.739 1.00 0.00 H new ATOM 0 HG12 ILE A 24 19.005 0.492 -2.884 1.00 0.00 H new ATOM 0 HG13 ILE A 24 18.918 -0.874 -3.978 1.00 0.00 H new ATOM 0 HG21 ILE A 24 19.735 2.795 -4.029 1.00 0.00 H new ATOM 0 HG22 ILE A 24 18.510 3.117 -5.280 1.00 0.00 H new ATOM 0 HG23 ILE A 24 18.013 2.500 -3.686 1.00 0.00 H new ATOM 0 HD11 ILE A 24 21.121 -0.736 -2.924 1.00 0.00 H new ATOM 0 HD12 ILE A 24 21.252 -0.479 -4.680 1.00 0.00 H new ATOM 0 HD13 ILE A 24 21.341 0.909 -3.568 1.00 0.00 H new ATOM 394 N LYS A 25 17.704 1.458 -7.809 1.00 0.00 N ATOM 395 CA LYS A 25 17.344 2.354 -8.901 1.00 0.00 C ATOM 396 C LYS A 25 15.902 2.123 -9.342 1.00 0.00 C ATOM 397 O LYS A 25 15.160 3.072 -9.596 1.00 0.00 O ATOM 398 CB LYS A 25 18.290 2.152 -10.087 1.00 0.00 C ATOM 399 CG LYS A 25 19.756 2.324 -9.732 1.00 0.00 C ATOM 400 CD LYS A 25 20.250 3.722 -10.063 1.00 0.00 C ATOM 401 CE LYS A 25 19.505 4.780 -9.264 1.00 0.00 C ATOM 402 NZ LYS A 25 20.306 6.026 -9.109 1.00 0.00 N ATOM 0 H LYS A 25 18.421 0.772 -8.046 1.00 0.00 H new ATOM 0 HA LYS A 25 17.436 3.379 -8.542 1.00 0.00 H new ATOM 0 HB2 LYS A 25 18.139 1.153 -10.495 1.00 0.00 H new ATOM 0 HB3 LYS A 25 18.030 2.861 -10.873 1.00 0.00 H new ATOM 0 HG2 LYS A 25 19.899 2.129 -8.669 1.00 0.00 H new ATOM 0 HG3 LYS A 25 20.351 1.589 -10.274 1.00 0.00 H new ATOM 0 HD2 LYS A 25 21.317 3.791 -9.853 1.00 0.00 H new ATOM 0 HD3 LYS A 25 20.121 3.912 -11.129 1.00 0.00 H new ATOM 0 HE2 LYS A 25 18.563 5.013 -9.761 1.00 0.00 H new ATOM 0 HE3 LYS A 25 19.257 4.383 -8.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 19.763 6.722 -8.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 21.194 5.809 -8.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 20.522 6.419 -10.047 1.00 0.00 H new ATOM 416 N VAL A 26 15.511 0.856 -9.430 1.00 0.00 N ATOM 417 CA VAL A 26 14.157 0.500 -9.837 1.00 0.00 C ATOM 418 C VAL A 26 13.131 0.985 -8.819 1.00 0.00 C ATOM 419 O VAL A 26 12.061 1.473 -9.183 1.00 0.00 O ATOM 420 CB VAL A 26 14.006 -1.022 -10.016 1.00 0.00 C ATOM 421 CG1 VAL A 26 12.670 -1.355 -10.663 1.00 0.00 C ATOM 422 CG2 VAL A 26 15.159 -1.578 -10.839 1.00 0.00 C ATOM 0 H VAL A 26 16.113 0.059 -9.225 1.00 0.00 H new ATOM 0 HA VAL A 26 13.976 0.991 -10.793 1.00 0.00 H new ATOM 0 HB VAL A 26 14.032 -1.490 -9.032 1.00 0.00 H new ATOM 0 HG11 VAL A 26 12.582 -2.435 -10.781 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.859 -0.992 -10.031 1.00 0.00 H new ATOM 0 HG13 VAL A 26 12.610 -0.877 -11.641 1.00 0.00 H new ATOM 0 HG21 VAL A 26 15.037 -2.655 -10.956 1.00 0.00 H new ATOM 0 HG22 VAL A 26 15.166 -1.105 -11.821 1.00 0.00 H new ATOM 0 HG23 VAL A 26 16.101 -1.373 -10.330 1.00 0.00 H new ATOM 432 N PHE A 27 13.465 0.848 -7.540 1.00 0.00 N ATOM 433 CA PHE A 27 12.573 1.272 -6.467 1.00 0.00 C ATOM 434 C PHE A 27 12.444 2.792 -6.435 1.00 0.00 C ATOM 435 O PHE A 27 11.352 3.329 -6.259 1.00 0.00 O ATOM 436 CB PHE A 27 13.086 0.763 -5.118 1.00 0.00 C ATOM 437 CG PHE A 27 12.555 -0.592 -4.747 1.00 0.00 C ATOM 438 CD1 PHE A 27 11.192 -0.809 -4.635 1.00 0.00 C ATOM 439 CD2 PHE A 27 13.420 -1.648 -4.510 1.00 0.00 C ATOM 440 CE1 PHE A 27 10.701 -2.055 -4.292 1.00 0.00 C ATOM 441 CE2 PHE A 27 12.935 -2.896 -4.168 1.00 0.00 C ATOM 442 CZ PHE A 27 11.574 -3.100 -4.060 1.00 0.00 C ATOM 0 H PHE A 27 14.347 0.447 -7.221 1.00 0.00 H new ATOM 0 HA PHE A 27 11.588 0.846 -6.657 1.00 0.00 H new ATOM 0 HB2 PHE A 27 14.175 0.723 -5.144 1.00 0.00 H new ATOM 0 HB3 PHE A 27 12.812 1.477 -4.341 1.00 0.00 H new ATOM 0 HD1 PHE A 27 10.505 0.004 -4.818 1.00 0.00 H new ATOM 0 HD2 PHE A 27 14.486 -1.494 -4.594 1.00 0.00 H new ATOM 0 HE1 PHE A 27 9.636 -2.211 -4.206 1.00 0.00 H new ATOM 0 HE2 PHE A 27 13.620 -3.711 -3.985 1.00 0.00 H new ATOM 0 HZ PHE A 27 11.192 -4.075 -3.795 1.00 0.00 H new ATOM 452 N ALA A 28 13.569 3.478 -6.606 1.00 0.00 N ATOM 453 CA ALA A 28 13.583 4.936 -6.599 1.00 0.00 C ATOM 454 C ALA A 28 12.774 5.499 -7.763 1.00 0.00 C ATOM 455 O ALA A 28 11.980 6.423 -7.589 1.00 0.00 O ATOM 456 CB ALA A 28 15.014 5.450 -6.651 1.00 0.00 C ATOM 0 H ALA A 28 14.482 3.048 -6.751 1.00 0.00 H new ATOM 0 HA ALA A 28 13.120 5.275 -5.672 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.010 6.540 -6.645 1.00 0.00 H new ATOM 0 HB2 ALA A 28 15.564 5.085 -5.783 1.00 0.00 H new ATOM 0 HB3 ALA A 28 15.496 5.094 -7.562 1.00 0.00 H new ATOM 462 N GLU A 29 12.982 4.936 -8.949 1.00 0.00 N ATOM 463 CA GLU A 29 12.272 5.383 -10.141 1.00 0.00 C ATOM 464 C GLU A 29 10.791 5.024 -10.060 1.00 0.00 C ATOM 465 O GLU A 29 9.963 5.589 -10.776 1.00 0.00 O ATOM 466 CB GLU A 29 12.891 4.761 -11.394 1.00 0.00 C ATOM 467 CG GLU A 29 12.344 3.383 -11.724 1.00 0.00 C ATOM 468 CD GLU A 29 11.315 3.414 -12.836 1.00 0.00 C ATOM 469 OE1 GLU A 29 11.653 3.883 -13.943 1.00 0.00 O ATOM 470 OE2 GLU A 29 10.172 2.970 -12.601 1.00 0.00 O ATOM 0 H GLU A 29 13.636 4.170 -9.110 1.00 0.00 H new ATOM 0 HA GLU A 29 12.362 6.468 -10.200 1.00 0.00 H new ATOM 0 HB2 GLU A 29 12.718 5.424 -12.242 1.00 0.00 H new ATOM 0 HB3 GLU A 29 13.970 4.691 -11.259 1.00 0.00 H new ATOM 0 HG2 GLU A 29 13.167 2.730 -12.014 1.00 0.00 H new ATOM 0 HG3 GLU A 29 11.894 2.951 -10.830 1.00 0.00 H new ATOM 477 N LEU A 30 10.465 4.079 -9.184 1.00 0.00 N ATOM 478 CA LEU A 30 9.084 3.643 -9.009 1.00 0.00 C ATOM 479 C LEU A 30 8.388 4.459 -7.925 1.00 0.00 C ATOM 480 O LEU A 30 7.198 4.282 -7.668 1.00 0.00 O ATOM 481 CB LEU A 30 9.041 2.156 -8.651 1.00 0.00 C ATOM 482 CG LEU A 30 9.253 1.180 -9.809 1.00 0.00 C ATOM 483 CD1 LEU A 30 9.685 -0.182 -9.287 1.00 0.00 C ATOM 484 CD2 LEU A 30 7.985 1.057 -10.641 1.00 0.00 C ATOM 0 H LEU A 30 11.138 3.601 -8.585 1.00 0.00 H new ATOM 0 HA LEU A 30 8.557 3.800 -9.950 1.00 0.00 H new ATOM 0 HB2 LEU A 30 9.802 1.963 -7.895 1.00 0.00 H new ATOM 0 HB3 LEU A 30 8.076 1.941 -8.193 1.00 0.00 H new ATOM 0 HG LEU A 30 10.046 1.570 -10.447 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.831 -0.863 -10.125 1.00 0.00 H new ATOM 0 HD12 LEU A 30 10.619 -0.080 -8.735 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.915 -0.580 -8.626 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.154 0.359 -11.461 1.00 0.00 H new ATOM 0 HD22 LEU A 30 7.172 0.691 -10.014 1.00 0.00 H new ATOM 0 HD23 LEU A 30 7.719 2.034 -11.046 1.00 0.00 H new ATOM 496 N GLY A 31 9.139 5.357 -7.293 1.00 0.00 N ATOM 497 CA GLY A 31 8.577 6.189 -6.246 1.00 0.00 C ATOM 498 C GLY A 31 8.655 5.535 -4.881 1.00 0.00 C ATOM 499 O GLY A 31 8.013 5.985 -3.931 1.00 0.00 O ATOM 0 H GLY A 31 10.126 5.522 -7.488 1.00 0.00 H new ATOM 0 HA2 GLY A 31 9.106 7.142 -6.220 1.00 0.00 H new ATOM 0 HA3 GLY A 31 7.536 6.409 -6.481 1.00 0.00 H new ATOM 503 N TYR A 32 9.442 4.469 -4.781 1.00 0.00 N ATOM 504 CA TYR A 32 9.599 3.749 -3.523 1.00 0.00 C ATOM 505 C TYR A 32 10.824 4.246 -2.760 1.00 0.00 C ATOM 506 O TYR A 32 11.516 3.470 -2.103 1.00 0.00 O ATOM 507 CB TYR A 32 9.721 2.247 -3.783 1.00 0.00 C ATOM 508 CG TYR A 32 8.448 1.617 -4.301 1.00 0.00 C ATOM 509 CD1 TYR A 32 7.952 1.939 -5.559 1.00 0.00 C ATOM 510 CD2 TYR A 32 7.740 0.701 -3.533 1.00 0.00 C ATOM 511 CE1 TYR A 32 6.789 1.367 -6.036 1.00 0.00 C ATOM 512 CE2 TYR A 32 6.576 0.123 -4.003 1.00 0.00 C ATOM 513 CZ TYR A 32 6.105 0.459 -5.255 1.00 0.00 C ATOM 514 OH TYR A 32 4.946 -0.114 -5.726 1.00 0.00 O ATOM 0 H TYR A 32 9.981 4.085 -5.557 1.00 0.00 H new ATOM 0 HA TYR A 32 8.714 3.935 -2.914 1.00 0.00 H new ATOM 0 HB2 TYR A 32 10.521 2.075 -4.503 1.00 0.00 H new ATOM 0 HB3 TYR A 32 10.013 1.749 -2.858 1.00 0.00 H new ATOM 0 HD1 TYR A 32 8.485 2.649 -6.174 1.00 0.00 H new ATOM 0 HD2 TYR A 32 8.106 0.436 -2.552 1.00 0.00 H new ATOM 0 HE1 TYR A 32 6.417 1.629 -7.015 1.00 0.00 H new ATOM 0 HE2 TYR A 32 6.038 -0.588 -3.393 1.00 0.00 H new ATOM 0 HH TYR A 32 4.590 -0.731 -5.054 1.00 0.00 H new ATOM 524 N ASN A 33 11.084 5.546 -2.854 1.00 0.00 N ATOM 525 CA ASN A 33 12.225 6.148 -2.173 1.00 0.00 C ATOM 526 C ASN A 33 12.261 5.735 -0.704 1.00 0.00 C ATOM 527 O ASN A 33 11.260 5.280 -0.152 1.00 0.00 O ATOM 528 CB ASN A 33 12.165 7.672 -2.284 1.00 0.00 C ATOM 529 CG ASN A 33 10.749 8.205 -2.177 1.00 0.00 C ATOM 530 OD1 ASN A 33 10.031 8.206 -3.294 1.00 0.00 O flip ATOM 531 ND2 ASN A 33 10.307 8.611 -1.102 1.00 0.00 N flip ATOM 0 H ASN A 33 10.521 6.202 -3.395 1.00 0.00 H new ATOM 0 HA ASN A 33 13.135 5.791 -2.655 1.00 0.00 H new ATOM 0 HB2 ASN A 33 12.777 8.115 -1.498 1.00 0.00 H new ATOM 0 HB3 ASN A 33 12.596 7.981 -3.236 1.00 0.00 H new ATOM 0 HD21 ASN A 33 10.895 8.591 -0.269 1.00 0.00 H new ATOM 0 HD22 ASN A 33 9.353 8.967 -1.045 1.00 0.00 H new ATOM 538 N ASP A 34 13.422 5.898 -0.079 1.00 0.00 N ATOM 539 CA ASP A 34 13.590 5.544 1.326 1.00 0.00 C ATOM 540 C ASP A 34 13.578 4.030 1.510 1.00 0.00 C ATOM 541 O ASP A 34 12.741 3.490 2.235 1.00 0.00 O ATOM 542 CB ASP A 34 12.485 6.182 2.170 1.00 0.00 C ATOM 543 CG ASP A 34 12.948 6.514 3.574 1.00 0.00 C ATOM 544 OD1 ASP A 34 13.377 5.587 4.293 1.00 0.00 O ATOM 545 OD2 ASP A 34 12.883 7.702 3.955 1.00 0.00 O ATOM 0 H ASP A 34 14.260 6.273 -0.523 1.00 0.00 H new ATOM 0 HA ASP A 34 14.556 5.924 1.658 1.00 0.00 H new ATOM 0 HB2 ASP A 34 12.137 7.092 1.681 1.00 0.00 H new ATOM 0 HB3 ASP A 34 11.634 5.503 2.222 1.00 0.00 H new ATOM 550 N ILE A 35 14.509 3.351 0.849 1.00 0.00 N ATOM 551 CA ILE A 35 14.605 1.899 0.940 1.00 0.00 C ATOM 552 C ILE A 35 15.539 1.480 2.071 1.00 0.00 C ATOM 553 O ILE A 35 16.497 2.182 2.390 1.00 0.00 O ATOM 554 CB ILE A 35 15.107 1.284 -0.380 1.00 0.00 C ATOM 555 CG1 ILE A 35 14.060 0.325 -0.950 1.00 0.00 C ATOM 556 CG2 ILE A 35 16.429 0.565 -0.160 1.00 0.00 C ATOM 557 CD1 ILE A 35 12.990 1.014 -1.767 1.00 0.00 C ATOM 0 H ILE A 35 15.208 3.783 0.244 1.00 0.00 H new ATOM 0 HA ILE A 35 13.601 1.528 1.145 1.00 0.00 H new ATOM 0 HB ILE A 35 15.268 2.086 -1.100 1.00 0.00 H new ATOM 0 HG12 ILE A 35 14.560 -0.417 -1.573 1.00 0.00 H new ATOM 0 HG13 ILE A 35 13.588 -0.214 -0.129 1.00 0.00 H new ATOM 0 HG21 ILE A 35 16.771 0.136 -1.102 1.00 0.00 H new ATOM 0 HG22 ILE A 35 17.172 1.273 0.207 1.00 0.00 H new ATOM 0 HG23 ILE A 35 16.293 -0.230 0.573 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.283 0.273 -2.139 1.00 0.00 H new ATOM 0 HD12 ILE A 35 12.464 1.736 -1.143 1.00 0.00 H new ATOM 0 HD13 ILE A 35 13.451 1.530 -2.609 1.00 0.00 H new ATOM 569 N ASN A 36 15.253 0.330 2.671 1.00 0.00 N ATOM 570 CA ASN A 36 16.068 -0.185 3.766 1.00 0.00 C ATOM 571 C ASN A 36 16.536 -1.607 3.474 1.00 0.00 C ATOM 572 O ASN A 36 15.727 -2.499 3.219 1.00 0.00 O ATOM 573 CB ASN A 36 15.278 -0.155 5.075 1.00 0.00 C ATOM 574 CG ASN A 36 15.445 1.155 5.822 1.00 0.00 C ATOM 575 OD1 ASN A 36 15.029 2.211 5.346 1.00 0.00 O ATOM 576 ND2 ASN A 36 16.057 1.091 6.999 1.00 0.00 N ATOM 0 H ASN A 36 14.463 -0.264 2.418 1.00 0.00 H new ATOM 0 HA ASN A 36 16.945 0.454 3.864 1.00 0.00 H new ATOM 0 HB2 ASN A 36 14.221 -0.316 4.862 1.00 0.00 H new ATOM 0 HB3 ASN A 36 15.604 -0.977 5.712 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.198 1.940 7.547 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.386 0.193 7.355 1.00 0.00 H new ATOM 583 N VAL A 37 17.849 -1.812 3.513 1.00 0.00 N ATOM 584 CA VAL A 37 18.426 -3.126 3.255 1.00 0.00 C ATOM 585 C VAL A 37 18.845 -3.807 4.553 1.00 0.00 C ATOM 586 O VAL A 37 19.427 -3.179 5.437 1.00 0.00 O ATOM 587 CB VAL A 37 19.647 -3.029 2.321 1.00 0.00 C ATOM 588 CG1 VAL A 37 20.788 -2.294 3.008 1.00 0.00 C ATOM 589 CG2 VAL A 37 20.087 -4.415 1.875 1.00 0.00 C ATOM 0 H VAL A 37 18.533 -1.085 3.721 1.00 0.00 H new ATOM 0 HA VAL A 37 17.653 -3.721 2.769 1.00 0.00 H new ATOM 0 HB VAL A 37 19.362 -2.461 1.436 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.642 -2.235 2.333 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.465 -1.287 3.273 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.076 -2.832 3.911 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.951 -4.328 1.216 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.355 -5.010 2.748 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.271 -4.902 1.341 1.00 0.00 H new ATOM 599 N THR A 38 18.545 -5.098 4.661 1.00 0.00 N ATOM 600 CA THR A 38 18.890 -5.865 5.851 1.00 0.00 C ATOM 601 C THR A 38 19.521 -7.202 5.479 1.00 0.00 C ATOM 602 O THR A 38 18.934 -7.991 4.738 1.00 0.00 O ATOM 603 CB THR A 38 17.653 -6.122 6.732 1.00 0.00 C ATOM 604 OG1 THR A 38 16.538 -6.493 5.914 1.00 0.00 O ATOM 605 CG2 THR A 38 17.302 -4.885 7.545 1.00 0.00 C ATOM 0 H THR A 38 18.064 -5.634 3.939 1.00 0.00 H new ATOM 0 HA THR A 38 19.610 -5.270 6.413 1.00 0.00 H new ATOM 0 HB THR A 38 17.886 -6.935 7.419 1.00 0.00 H new ATOM 0 HG1 THR A 38 16.837 -7.110 5.214 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.425 -5.090 8.159 1.00 0.00 H new ATOM 0 HG22 THR A 38 18.142 -4.622 8.188 1.00 0.00 H new ATOM 0 HG23 THR A 38 17.087 -4.056 6.871 1.00 0.00 H new ATOM 613 N TRP A 39 20.718 -7.451 5.998 1.00 0.00 N ATOM 614 CA TRP A 39 21.428 -8.694 5.720 1.00 0.00 C ATOM 615 C TRP A 39 21.354 -9.641 6.912 1.00 0.00 C ATOM 616 O TRP A 39 21.790 -9.303 8.013 1.00 0.00 O ATOM 617 CB TRP A 39 22.889 -8.405 5.373 1.00 0.00 C ATOM 618 CG TRP A 39 23.581 -7.543 6.386 1.00 0.00 C ATOM 619 CD1 TRP A 39 23.606 -6.178 6.421 1.00 0.00 C ATOM 620 CD2 TRP A 39 24.349 -7.990 7.508 1.00 0.00 C ATOM 621 NE1 TRP A 39 24.343 -5.749 7.498 1.00 0.00 N ATOM 622 CE2 TRP A 39 24.809 -6.841 8.181 1.00 0.00 C ATOM 623 CE3 TRP A 39 24.691 -9.248 8.012 1.00 0.00 C ATOM 624 CZ2 TRP A 39 25.594 -6.915 9.329 1.00 0.00 C ATOM 625 CZ3 TRP A 39 25.471 -9.320 9.151 1.00 0.00 C ATOM 626 CH2 TRP A 39 25.914 -8.160 9.800 1.00 0.00 C ATOM 0 H TRP A 39 21.217 -6.809 6.613 1.00 0.00 H new ATOM 0 HA TRP A 39 20.948 -9.174 4.867 1.00 0.00 H new ATOM 0 HB2 TRP A 39 23.427 -9.349 5.281 1.00 0.00 H new ATOM 0 HB3 TRP A 39 22.934 -7.917 4.400 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.118 -5.531 5.707 1.00 0.00 H new ATOM 0 HE1 TRP A 39 24.515 -4.775 7.748 1.00 0.00 H new ATOM 0 HE3 TRP A 39 24.352 -10.148 7.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 25.938 -6.022 9.830 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 25.744 -10.287 9.547 1.00 0.00 H new ATOM 0 HH2 TRP A 39 26.520 -8.250 10.689 1.00 0.00 H new ATOM 668 N THR A 43 22.239 -13.487 3.693 1.00 0.00 N ATOM 669 CA THR A 43 21.181 -13.156 2.747 1.00 0.00 C ATOM 670 C THR A 43 20.769 -11.694 2.873 1.00 0.00 C ATOM 671 O THR A 43 20.452 -11.219 3.965 1.00 0.00 O ATOM 672 CB THR A 43 19.941 -14.047 2.955 1.00 0.00 C ATOM 673 OG1 THR A 43 20.319 -15.268 3.600 1.00 0.00 O ATOM 674 CG2 THR A 43 19.268 -14.356 1.627 1.00 0.00 C ATOM 0 HA THR A 43 21.583 -13.333 1.749 1.00 0.00 H new ATOM 0 HB THR A 43 19.234 -13.507 3.585 1.00 0.00 H new ATOM 0 HG1 THR A 43 21.206 -15.164 4.003 1.00 0.00 H new ATOM 0 HG21 THR A 43 18.395 -14.986 1.799 1.00 0.00 H new ATOM 0 HG22 THR A 43 18.956 -13.426 1.152 1.00 0.00 H new ATOM 0 HG23 THR A 43 19.970 -14.878 0.976 1.00 0.00 H new ATOM 682 N VAL A 44 20.773 -10.983 1.750 1.00 0.00 N ATOM 683 CA VAL A 44 20.398 -9.574 1.735 1.00 0.00 C ATOM 684 C VAL A 44 18.978 -9.389 1.213 1.00 0.00 C ATOM 685 O VAL A 44 18.603 -9.956 0.186 1.00 0.00 O ATOM 686 CB VAL A 44 21.364 -8.745 0.868 1.00 0.00 C ATOM 687 CG1 VAL A 44 21.505 -9.362 -0.514 1.00 0.00 C ATOM 688 CG2 VAL A 44 20.889 -7.303 0.772 1.00 0.00 C ATOM 0 H VAL A 44 21.032 -11.360 0.838 1.00 0.00 H new ATOM 0 HA VAL A 44 20.452 -9.221 2.765 1.00 0.00 H new ATOM 0 HB VAL A 44 22.345 -8.749 1.342 1.00 0.00 H new ATOM 0 HG11 VAL A 44 22.191 -8.762 -1.112 1.00 0.00 H new ATOM 0 HG12 VAL A 44 21.895 -10.376 -0.422 1.00 0.00 H new ATOM 0 HG13 VAL A 44 20.530 -9.391 -1.001 1.00 0.00 H new ATOM 0 HG21 VAL A 44 21.583 -6.732 0.156 1.00 0.00 H new ATOM 0 HG22 VAL A 44 19.897 -7.276 0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 44 20.846 -6.867 1.770 1.00 0.00 H new ATOM 698 N THR A 45 18.190 -8.591 1.927 1.00 0.00 N ATOM 699 CA THR A 45 16.810 -8.331 1.536 1.00 0.00 C ATOM 700 C THR A 45 16.506 -6.838 1.553 1.00 0.00 C ATOM 701 O THR A 45 16.791 -6.146 2.530 1.00 0.00 O ATOM 702 CB THR A 45 15.817 -9.056 2.465 1.00 0.00 C ATOM 703 OG1 THR A 45 16.248 -10.403 2.687 1.00 0.00 O ATOM 704 CG2 THR A 45 14.419 -9.057 1.867 1.00 0.00 C ATOM 0 H THR A 45 18.484 -8.114 2.779 1.00 0.00 H new ATOM 0 HA THR A 45 16.692 -8.712 0.521 1.00 0.00 H new ATOM 0 HB THR A 45 15.788 -8.524 3.416 1.00 0.00 H new ATOM 0 HG1 THR A 45 15.613 -10.856 3.280 1.00 0.00 H new ATOM 0 HG21 THR A 45 13.736 -9.574 2.540 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.082 -8.030 1.727 1.00 0.00 H new ATOM 0 HG23 THR A 45 14.435 -9.568 0.904 1.00 0.00 H new ATOM 712 N VAL A 46 15.924 -6.345 0.464 1.00 0.00 N ATOM 713 CA VAL A 46 15.579 -4.933 0.354 1.00 0.00 C ATOM 714 C VAL A 46 14.131 -4.687 0.764 1.00 0.00 C ATOM 715 O VAL A 46 13.239 -5.462 0.421 1.00 0.00 O ATOM 716 CB VAL A 46 15.790 -4.413 -1.081 1.00 0.00 C ATOM 717 CG1 VAL A 46 14.735 -4.985 -2.016 1.00 0.00 C ATOM 718 CG2 VAL A 46 15.768 -2.893 -1.105 1.00 0.00 C ATOM 0 H VAL A 46 15.682 -6.903 -0.355 1.00 0.00 H new ATOM 0 HA VAL A 46 16.242 -4.392 1.030 1.00 0.00 H new ATOM 0 HB VAL A 46 16.768 -4.744 -1.429 1.00 0.00 H new ATOM 0 HG11 VAL A 46 14.900 -4.607 -3.025 1.00 0.00 H new ATOM 0 HG12 VAL A 46 14.804 -6.073 -2.020 1.00 0.00 H new ATOM 0 HG13 VAL A 46 13.744 -4.686 -1.673 1.00 0.00 H new ATOM 0 HG21 VAL A 46 15.919 -2.543 -2.126 1.00 0.00 H new ATOM 0 HG22 VAL A 46 14.805 -2.537 -0.738 1.00 0.00 H new ATOM 0 HG23 VAL A 46 16.564 -2.507 -0.468 1.00 0.00 H new ATOM 728 N GLU A 47 13.906 -3.603 1.500 1.00 0.00 N ATOM 729 CA GLU A 47 12.565 -3.255 1.957 1.00 0.00 C ATOM 730 C GLU A 47 12.204 -1.830 1.548 1.00 0.00 C ATOM 731 O GLU A 47 12.869 -0.873 1.941 1.00 0.00 O ATOM 732 CB GLU A 47 12.466 -3.403 3.476 1.00 0.00 C ATOM 733 CG GLU A 47 12.369 -4.846 3.943 1.00 0.00 C ATOM 734 CD GLU A 47 12.785 -5.021 5.390 1.00 0.00 C ATOM 735 OE1 GLU A 47 12.767 -4.020 6.137 1.00 0.00 O ATOM 736 OE2 GLU A 47 13.129 -6.157 5.776 1.00 0.00 O ATOM 0 H GLU A 47 14.634 -2.951 1.792 1.00 0.00 H new ATOM 0 HA GLU A 47 11.859 -3.939 1.486 1.00 0.00 H new ATOM 0 HB2 GLU A 47 13.339 -2.939 3.935 1.00 0.00 H new ATOM 0 HB3 GLU A 47 11.592 -2.856 3.829 1.00 0.00 H new ATOM 0 HG2 GLU A 47 11.344 -5.196 3.819 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.998 -5.472 3.310 1.00 0.00 H new ATOM 743 N GLY A 48 11.144 -1.699 0.756 1.00 0.00 N ATOM 744 CA GLY A 48 10.713 -0.388 0.306 1.00 0.00 C ATOM 745 C GLY A 48 9.236 -0.148 0.552 1.00 0.00 C ATOM 746 O GLY A 48 8.490 -1.082 0.846 1.00 0.00 O ATOM 0 H GLY A 48 10.577 -2.476 0.418 1.00 0.00 H new ATOM 0 HA2 GLY A 48 11.293 0.378 0.820 1.00 0.00 H new ATOM 0 HA3 GLY A 48 10.922 -0.286 -0.759 1.00 0.00 H new ATOM 750 N GLN A 49 8.814 1.106 0.433 1.00 0.00 N ATOM 751 CA GLN A 49 7.417 1.466 0.647 1.00 0.00 C ATOM 752 C GLN A 49 6.999 2.601 -0.282 1.00 0.00 C ATOM 753 O GLN A 49 7.768 3.530 -0.530 1.00 0.00 O ATOM 754 CB GLN A 49 7.190 1.872 2.104 1.00 0.00 C ATOM 755 CG GLN A 49 7.873 3.176 2.485 1.00 0.00 C ATOM 756 CD GLN A 49 9.380 3.038 2.584 1.00 0.00 C ATOM 757 OE1 GLN A 49 9.905 2.551 3.585 1.00 0.00 O ATOM 758 NE2 GLN A 49 10.084 3.469 1.544 1.00 0.00 N ATOM 0 H GLN A 49 9.419 1.890 0.190 1.00 0.00 H new ATOM 0 HA GLN A 49 6.804 0.593 0.422 1.00 0.00 H new ATOM 0 HB2 GLN A 49 6.119 1.966 2.284 1.00 0.00 H new ATOM 0 HB3 GLN A 49 7.554 1.077 2.755 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.630 3.939 1.746 1.00 0.00 H new ATOM 0 HG3 GLN A 49 7.480 3.522 3.441 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.607 3.866 0.735 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.102 3.403 1.555 1.00 0.00 H new ATOM 767 N LEU A 50 5.775 2.520 -0.793 1.00 0.00 N ATOM 768 CA LEU A 50 5.254 3.541 -1.695 1.00 0.00 C ATOM 769 C LEU A 50 4.235 4.426 -0.984 1.00 0.00 C ATOM 770 O LEU A 50 3.419 3.943 -0.200 1.00 0.00 O ATOM 771 CB LEU A 50 4.612 2.887 -2.920 1.00 0.00 C ATOM 772 CG LEU A 50 4.941 3.524 -4.270 1.00 0.00 C ATOM 773 CD1 LEU A 50 4.077 2.925 -5.369 1.00 0.00 C ATOM 774 CD2 LEU A 50 4.757 5.034 -4.208 1.00 0.00 C ATOM 0 H LEU A 50 5.125 1.758 -0.598 1.00 0.00 H new ATOM 0 HA LEU A 50 6.087 4.165 -2.019 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.917 1.841 -2.950 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.530 2.900 -2.789 1.00 0.00 H new ATOM 0 HG LEU A 50 5.985 3.315 -4.502 1.00 0.00 H new ATOM 0 HD11 LEU A 50 4.326 3.391 -6.322 1.00 0.00 H new ATOM 0 HD12 LEU A 50 4.259 1.852 -5.431 1.00 0.00 H new ATOM 0 HD13 LEU A 50 3.026 3.102 -5.142 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.996 5.470 -5.178 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.723 5.264 -3.951 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.420 5.451 -3.450 1.00 0.00 H new ATOM 910 N ARG B 3 24.519 -19.916 -9.699 1.00 0.00 N ATOM 911 CA ARG B 3 23.091 -19.694 -9.897 1.00 0.00 C ATOM 912 C ARG B 3 22.602 -18.520 -9.054 1.00 0.00 C ATOM 913 O ARG B 3 23.104 -18.279 -7.956 1.00 0.00 O ATOM 914 CB ARG B 3 22.303 -20.956 -9.541 1.00 0.00 C ATOM 915 CG ARG B 3 20.796 -20.757 -9.559 1.00 0.00 C ATOM 916 CD ARG B 3 20.253 -20.490 -8.164 1.00 0.00 C ATOM 917 NE ARG B 3 19.766 -21.709 -7.524 1.00 0.00 N ATOM 918 CZ ARG B 3 19.533 -21.812 -6.220 1.00 0.00 C ATOM 919 NH1 ARG B 3 19.741 -20.773 -5.422 1.00 0.00 N ATOM 920 NH2 ARG B 3 19.091 -22.955 -5.712 1.00 0.00 N ATOM 0 HA ARG B 3 22.927 -19.457 -10.948 1.00 0.00 H new ATOM 0 HB2 ARG B 3 22.565 -21.748 -10.243 1.00 0.00 H new ATOM 0 HB3 ARG B 3 22.605 -21.295 -8.550 1.00 0.00 H new ATOM 0 HG2 ARG B 3 20.546 -19.922 -10.214 1.00 0.00 H new ATOM 0 HG3 ARG B 3 20.316 -21.643 -9.974 1.00 0.00 H new ATOM 0 HD2 ARG B 3 21.036 -20.046 -7.549 1.00 0.00 H new ATOM 0 HD3 ARG B 3 19.443 -19.763 -8.223 1.00 0.00 H new ATOM 0 HE ARG B 3 19.595 -22.526 -8.110 1.00 0.00 H new ATOM 0 HH11 ARG B 3 20.081 -19.893 -5.809 1.00 0.00 H new ATOM 0 HH12 ARG B 3 19.561 -20.855 -4.421 1.00 0.00 H new ATOM 0 HH21 ARG B 3 18.930 -23.756 -6.323 1.00 0.00 H new ATOM 0 HH22 ARG B 3 18.913 -23.033 -4.711 1.00 0.00 H new ATOM 934 N VAL B 4 21.618 -17.793 -9.575 1.00 0.00 N ATOM 935 CA VAL B 4 21.060 -16.646 -8.871 1.00 0.00 C ATOM 936 C VAL B 4 19.540 -16.736 -8.790 1.00 0.00 C ATOM 937 O VAL B 4 18.863 -16.900 -9.805 1.00 0.00 O ATOM 938 CB VAL B 4 21.449 -15.322 -9.557 1.00 0.00 C ATOM 939 CG1 VAL B 4 20.932 -14.135 -8.759 1.00 0.00 C ATOM 940 CG2 VAL B 4 22.957 -15.239 -9.737 1.00 0.00 C ATOM 0 H VAL B 4 21.191 -17.979 -10.483 1.00 0.00 H new ATOM 0 HA VAL B 4 21.476 -16.661 -7.864 1.00 0.00 H new ATOM 0 HB VAL B 4 20.987 -15.294 -10.544 1.00 0.00 H new ATOM 0 HG11 VAL B 4 21.216 -13.209 -9.259 1.00 0.00 H new ATOM 0 HG12 VAL B 4 19.846 -14.190 -8.687 1.00 0.00 H new ATOM 0 HG13 VAL B 4 21.363 -14.154 -7.758 1.00 0.00 H new ATOM 0 HG21 VAL B 4 23.214 -14.298 -10.223 1.00 0.00 H new ATOM 0 HG22 VAL B 4 23.443 -15.289 -8.763 1.00 0.00 H new ATOM 0 HG23 VAL B 4 23.296 -16.071 -10.355 1.00 0.00 H new ATOM 950 N ARG B 5 19.010 -16.628 -7.576 1.00 0.00 N ATOM 951 CA ARG B 5 17.570 -16.698 -7.362 1.00 0.00 C ATOM 952 C ARG B 5 17.090 -15.533 -6.502 1.00 0.00 C ATOM 953 O ARG B 5 17.607 -15.302 -5.408 1.00 0.00 O ATOM 954 CB ARG B 5 17.196 -18.025 -6.698 1.00 0.00 C ATOM 955 CG ARG B 5 15.719 -18.139 -6.356 1.00 0.00 C ATOM 956 CD ARG B 5 15.424 -19.412 -5.578 1.00 0.00 C ATOM 957 NE ARG B 5 14.135 -19.992 -5.945 1.00 0.00 N ATOM 958 CZ ARG B 5 13.609 -21.054 -5.345 1.00 0.00 C ATOM 959 NH1 ARG B 5 14.259 -21.649 -4.354 1.00 0.00 N ATOM 960 NH2 ARG B 5 12.431 -21.522 -5.735 1.00 0.00 N ATOM 0 H ARG B 5 19.557 -16.492 -6.726 1.00 0.00 H new ATOM 0 HA ARG B 5 17.080 -16.635 -8.334 1.00 0.00 H new ATOM 0 HB2 ARG B 5 17.471 -18.844 -7.362 1.00 0.00 H new ATOM 0 HB3 ARG B 5 17.782 -18.143 -5.786 1.00 0.00 H new ATOM 0 HG2 ARG B 5 15.412 -17.273 -5.769 1.00 0.00 H new ATOM 0 HG3 ARG B 5 15.130 -18.127 -7.273 1.00 0.00 H new ATOM 0 HD2 ARG B 5 16.214 -20.140 -5.761 1.00 0.00 H new ATOM 0 HD3 ARG B 5 15.433 -19.194 -4.510 1.00 0.00 H new ATOM 0 HE ARG B 5 13.610 -19.558 -6.704 1.00 0.00 H new ATOM 0 HH11 ARG B 5 15.165 -21.291 -4.051 1.00 0.00 H new ATOM 0 HH12 ARG B 5 13.853 -22.464 -3.895 1.00 0.00 H new ATOM 0 HH21 ARG B 5 11.928 -21.066 -6.496 1.00 0.00 H new ATOM 0 HH22 ARG B 5 12.028 -22.338 -5.274 1.00 0.00 H new ATOM 974 N ILE B 6 16.100 -14.802 -7.004 1.00 0.00 N ATOM 975 CA ILE B 6 15.551 -13.662 -6.281 1.00 0.00 C ATOM 976 C ILE B 6 14.057 -13.836 -6.032 1.00 0.00 C ATOM 977 O ILE B 6 13.284 -14.058 -6.964 1.00 0.00 O ATOM 978 CB ILE B 6 15.783 -12.346 -7.047 1.00 0.00 C ATOM 979 CG1 ILE B 6 17.276 -12.139 -7.311 1.00 0.00 C ATOM 980 CG2 ILE B 6 15.210 -11.171 -6.267 1.00 0.00 C ATOM 981 CD1 ILE B 6 17.578 -10.916 -8.148 1.00 0.00 C ATOM 0 H ILE B 6 15.662 -14.979 -7.908 1.00 0.00 H new ATOM 0 HA ILE B 6 16.072 -13.614 -5.325 1.00 0.00 H new ATOM 0 HB ILE B 6 15.269 -12.406 -8.006 1.00 0.00 H new ATOM 0 HG12 ILE B 6 17.797 -12.054 -6.357 1.00 0.00 H new ATOM 0 HG13 ILE B 6 17.673 -13.021 -7.814 1.00 0.00 H new ATOM 0 HG21 ILE B 6 15.382 -10.248 -6.821 1.00 0.00 H new ATOM 0 HG22 ILE B 6 14.139 -11.316 -6.126 1.00 0.00 H new ATOM 0 HG23 ILE B 6 15.699 -11.107 -5.295 1.00 0.00 H new ATOM 0 HD11 ILE B 6 18.655 -10.832 -8.295 1.00 0.00 H new ATOM 0 HD12 ILE B 6 17.086 -11.007 -9.116 1.00 0.00 H new ATOM 0 HD13 ILE B 6 17.211 -10.026 -7.637 1.00 0.00 H new ATOM 993 N SER B 7 13.657 -13.733 -4.769 1.00 0.00 N ATOM 994 CA SER B 7 12.255 -13.881 -4.396 1.00 0.00 C ATOM 995 C SER B 7 11.657 -12.539 -3.985 1.00 0.00 C ATOM 996 O SER B 7 12.163 -11.873 -3.081 1.00 0.00 O ATOM 997 CB SER B 7 12.113 -14.887 -3.253 1.00 0.00 C ATOM 998 OG SER B 7 13.376 -15.213 -2.700 1.00 0.00 O ATOM 0 H SER B 7 14.284 -13.548 -3.986 1.00 0.00 H new ATOM 0 HA SER B 7 11.711 -14.250 -5.265 1.00 0.00 H new ATOM 0 HB2 SER B 7 11.469 -14.472 -2.477 1.00 0.00 H new ATOM 0 HB3 SER B 7 11.628 -15.792 -3.619 1.00 0.00 H new ATOM 0 HG SER B 7 13.257 -15.856 -1.970 1.00 0.00 H new ATOM 1004 N ILE B 8 10.578 -12.149 -4.655 1.00 0.00 N ATOM 1005 CA ILE B 8 9.910 -10.887 -4.359 1.00 0.00 C ATOM 1006 C ILE B 8 8.544 -11.124 -3.723 1.00 0.00 C ATOM 1007 O ILE B 8 7.775 -11.973 -4.176 1.00 0.00 O ATOM 1008 CB ILE B 8 9.733 -10.033 -5.628 1.00 0.00 C ATOM 1009 CG1 ILE B 8 8.722 -10.688 -6.572 1.00 0.00 C ATOM 1010 CG2 ILE B 8 11.070 -9.838 -6.327 1.00 0.00 C ATOM 1011 CD1 ILE B 8 8.635 -10.015 -7.924 1.00 0.00 C ATOM 0 H ILE B 8 10.148 -12.688 -5.406 1.00 0.00 H new ATOM 0 HA ILE B 8 10.547 -10.350 -3.656 1.00 0.00 H new ATOM 0 HB ILE B 8 9.351 -9.054 -5.339 1.00 0.00 H new ATOM 0 HG12 ILE B 8 8.993 -11.734 -6.713 1.00 0.00 H new ATOM 0 HG13 ILE B 8 7.738 -10.674 -6.104 1.00 0.00 H new ATOM 0 HG21 ILE B 8 10.928 -9.232 -7.222 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.762 -9.333 -5.653 1.00 0.00 H new ATOM 0 HG23 ILE B 8 11.479 -10.809 -6.607 1.00 0.00 H new ATOM 0 HD11 ILE B 8 7.900 -10.532 -8.541 1.00 0.00 H new ATOM 0 HD12 ILE B 8 8.334 -8.975 -7.794 1.00 0.00 H new ATOM 0 HD13 ILE B 8 9.609 -10.052 -8.412 1.00 0.00 H new ATOM 1023 N THR B 9 8.248 -10.367 -2.671 1.00 0.00 N ATOM 1024 CA THR B 9 6.974 -10.493 -1.974 1.00 0.00 C ATOM 1025 C THR B 9 6.083 -9.284 -2.233 1.00 0.00 C ATOM 1026 O THR B 9 6.323 -8.200 -1.703 1.00 0.00 O ATOM 1027 CB THR B 9 7.179 -10.650 -0.455 1.00 0.00 C ATOM 1028 OG1 THR B 9 8.509 -11.105 -0.184 1.00 0.00 O ATOM 1029 CG2 THR B 9 6.173 -11.631 0.128 1.00 0.00 C ATOM 0 H THR B 9 8.873 -9.660 -2.283 1.00 0.00 H new ATOM 0 HA THR B 9 6.488 -11.388 -2.363 1.00 0.00 H new ATOM 0 HB THR B 9 7.027 -9.677 0.012 1.00 0.00 H new ATOM 0 HG1 THR B 9 8.631 -11.200 0.784 1.00 0.00 H new ATOM 0 HG21 THR B 9 6.337 -11.726 1.201 1.00 0.00 H new ATOM 0 HG22 THR B 9 5.162 -11.266 -0.054 1.00 0.00 H new ATOM 0 HG23 THR B 9 6.298 -12.605 -0.345 1.00 0.00 H new ATOM 1037 N ALA B 10 5.054 -9.478 -3.051 1.00 0.00 N ATOM 1038 CA ALA B 10 4.125 -8.403 -3.378 1.00 0.00 C ATOM 1039 C ALA B 10 2.760 -8.645 -2.743 1.00 0.00 C ATOM 1040 O ALA B 10 2.488 -9.730 -2.229 1.00 0.00 O ATOM 1041 CB ALA B 10 3.990 -8.264 -4.887 1.00 0.00 C ATOM 0 H ALA B 10 4.842 -10.369 -3.499 1.00 0.00 H new ATOM 0 HA ALA B 10 4.525 -7.474 -2.973 1.00 0.00 H new ATOM 0 HB1 ALA B 10 3.293 -7.458 -5.117 1.00 0.00 H new ATOM 0 HB2 ALA B 10 4.964 -8.037 -5.320 1.00 0.00 H new ATOM 0 HB3 ALA B 10 3.616 -9.198 -5.306 1.00 0.00 H new ATOM 1047 N ARG B 11 1.906 -7.628 -2.781 1.00 0.00 N ATOM 1048 CA ARG B 11 0.570 -7.730 -2.207 1.00 0.00 C ATOM 1049 C ARG B 11 -0.386 -8.422 -3.174 1.00 0.00 C ATOM 1050 O ARG B 11 -1.219 -9.234 -2.768 1.00 0.00 O ATOM 1051 CB ARG B 11 0.036 -6.341 -1.852 1.00 0.00 C ATOM 1052 CG ARG B 11 -0.054 -5.401 -3.043 1.00 0.00 C ATOM 1053 CD ARG B 11 -0.477 -4.003 -2.619 1.00 0.00 C ATOM 1054 NE ARG B 11 -1.909 -3.923 -2.347 1.00 0.00 N ATOM 1055 CZ ARG B 11 -2.830 -3.784 -3.294 1.00 0.00 C ATOM 1056 NH1 ARG B 11 -2.470 -3.709 -4.568 1.00 0.00 N ATOM 1057 NH2 ARG B 11 -4.115 -3.719 -2.968 1.00 0.00 N ATOM 0 H ARG B 11 2.116 -6.724 -3.203 1.00 0.00 H new ATOM 0 HA ARG B 11 0.637 -8.329 -1.299 1.00 0.00 H new ATOM 0 HB2 ARG B 11 -0.953 -6.444 -1.406 1.00 0.00 H new ATOM 0 HB3 ARG B 11 0.682 -5.895 -1.096 1.00 0.00 H new ATOM 0 HG2 ARG B 11 0.913 -5.353 -3.544 1.00 0.00 H new ATOM 0 HG3 ARG B 11 -0.769 -5.795 -3.766 1.00 0.00 H new ATOM 0 HD2 ARG B 11 0.078 -3.711 -1.727 1.00 0.00 H new ATOM 0 HD3 ARG B 11 -0.217 -3.292 -3.403 1.00 0.00 H new ATOM 0 HE ARG B 11 -2.219 -3.977 -1.377 1.00 0.00 H new ATOM 0 HH11 ARG B 11 -1.484 -3.758 -4.823 1.00 0.00 H new ATOM 0 HH12 ARG B 11 -3.179 -3.602 -5.293 1.00 0.00 H new ATOM 0 HH21 ARG B 11 -4.396 -3.776 -1.989 1.00 0.00 H new ATOM 0 HH22 ARG B 11 -4.821 -3.612 -3.696 1.00 0.00 H new ATOM 1071 N THR B 12 -0.261 -8.095 -4.457 1.00 0.00 N ATOM 1072 CA THR B 12 -1.114 -8.683 -5.482 1.00 0.00 C ATOM 1073 C THR B 12 -0.284 -9.339 -6.579 1.00 0.00 C ATOM 1074 O THR B 12 0.887 -9.008 -6.767 1.00 0.00 O ATOM 1075 CB THR B 12 -2.039 -7.627 -6.116 1.00 0.00 C ATOM 1076 OG1 THR B 12 -2.659 -8.161 -7.292 1.00 0.00 O ATOM 1077 CG2 THR B 12 -1.261 -6.370 -6.474 1.00 0.00 C ATOM 0 H THR B 12 0.423 -7.426 -4.810 1.00 0.00 H new ATOM 0 HA THR B 12 -1.723 -9.441 -4.989 1.00 0.00 H new ATOM 0 HB THR B 12 -2.806 -7.365 -5.388 1.00 0.00 H new ATOM 0 HG1 THR B 12 -3.247 -7.484 -7.688 1.00 0.00 H new ATOM 0 HG21 THR B 12 -1.936 -5.639 -6.920 1.00 0.00 H new ATOM 0 HG22 THR B 12 -0.815 -5.949 -5.573 1.00 0.00 H new ATOM 0 HG23 THR B 12 -0.474 -6.619 -7.186 1.00 0.00 H new ATOM 1085 N LYS B 13 -0.896 -10.271 -7.301 1.00 0.00 N ATOM 1086 CA LYS B 13 -0.214 -10.973 -8.381 1.00 0.00 C ATOM 1087 C LYS B 13 0.345 -9.988 -9.403 1.00 0.00 C ATOM 1088 O LYS B 13 1.423 -10.199 -9.959 1.00 0.00 O ATOM 1089 CB LYS B 13 -1.173 -11.948 -9.069 1.00 0.00 C ATOM 1090 CG LYS B 13 -2.462 -11.300 -9.543 1.00 0.00 C ATOM 1091 CD LYS B 13 -3.539 -12.336 -9.819 1.00 0.00 C ATOM 1092 CE LYS B 13 -4.597 -12.344 -8.726 1.00 0.00 C ATOM 1093 NZ LYS B 13 -5.626 -11.289 -8.943 1.00 0.00 N ATOM 0 H LYS B 13 -1.864 -10.558 -7.157 1.00 0.00 H new ATOM 0 HA LYS B 13 0.616 -11.532 -7.950 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -0.668 -12.400 -9.923 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -1.415 -12.755 -8.378 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -2.816 -10.598 -8.788 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -2.269 -10.724 -10.448 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -4.009 -12.127 -10.780 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -3.085 -13.324 -9.894 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -5.079 -13.321 -8.695 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -4.120 -12.193 -7.758 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -6.329 -11.327 -8.177 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -5.169 -10.355 -8.948 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -6.099 -11.448 -9.855 1.00 0.00 H new ATOM 1107 N LYS B 14 -0.393 -8.910 -9.645 1.00 0.00 N ATOM 1108 CA LYS B 14 0.030 -7.890 -10.597 1.00 0.00 C ATOM 1109 C LYS B 14 1.299 -7.192 -10.118 1.00 0.00 C ATOM 1110 O LYS B 14 2.166 -6.845 -10.919 1.00 0.00 O ATOM 1111 CB LYS B 14 -1.085 -6.862 -10.803 1.00 0.00 C ATOM 1112 CG LYS B 14 -2.009 -7.190 -11.963 1.00 0.00 C ATOM 1113 CD LYS B 14 -2.866 -8.409 -11.665 1.00 0.00 C ATOM 1114 CE LYS B 14 -2.655 -9.504 -12.699 1.00 0.00 C ATOM 1115 NZ LYS B 14 -3.251 -9.146 -14.016 1.00 0.00 N ATOM 0 H LYS B 14 -1.288 -8.720 -9.194 1.00 0.00 H new ATOM 0 HA LYS B 14 0.243 -8.380 -11.547 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -1.675 -6.790 -9.889 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -0.638 -5.882 -10.972 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -2.651 -6.334 -12.171 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -1.418 -7.370 -12.861 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -2.624 -8.792 -10.673 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -3.917 -8.121 -11.648 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -1.587 -9.687 -12.821 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -3.099 -10.433 -12.340 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -3.086 -9.918 -14.693 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -4.274 -8.996 -13.905 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -2.810 -8.274 -14.371 1.00 0.00 H new ATOM 1129 N GLU B 15 1.400 -6.991 -8.808 1.00 0.00 N ATOM 1130 CA GLU B 15 2.564 -6.334 -8.225 1.00 0.00 C ATOM 1131 C GLU B 15 3.827 -7.157 -8.459 1.00 0.00 C ATOM 1132 O GLU B 15 4.910 -6.608 -8.659 1.00 0.00 O ATOM 1133 CB GLU B 15 2.355 -6.116 -6.725 1.00 0.00 C ATOM 1134 CG GLU B 15 1.689 -4.792 -6.389 1.00 0.00 C ATOM 1135 CD GLU B 15 2.515 -3.596 -6.824 1.00 0.00 C ATOM 1136 OE1 GLU B 15 3.627 -3.416 -6.285 1.00 0.00 O ATOM 1137 OE2 GLU B 15 2.048 -2.842 -7.703 1.00 0.00 O ATOM 0 H GLU B 15 0.691 -7.273 -8.131 1.00 0.00 H new ATOM 0 HA GLU B 15 2.686 -5.367 -8.712 1.00 0.00 H new ATOM 0 HB2 GLU B 15 1.747 -6.930 -6.329 1.00 0.00 H new ATOM 0 HB3 GLU B 15 3.320 -6.166 -6.221 1.00 0.00 H new ATOM 0 HG2 GLU B 15 0.712 -4.749 -6.870 1.00 0.00 H new ATOM 0 HG3 GLU B 15 1.517 -4.739 -5.314 1.00 0.00 H new ATOM 1144 N ALA B 16 3.679 -8.478 -8.431 1.00 0.00 N ATOM 1145 CA ALA B 16 4.807 -9.377 -8.642 1.00 0.00 C ATOM 1146 C ALA B 16 5.307 -9.303 -10.081 1.00 0.00 C ATOM 1147 O ALA B 16 6.510 -9.358 -10.332 1.00 0.00 O ATOM 1148 CB ALA B 16 4.416 -10.805 -8.290 1.00 0.00 C ATOM 0 H ALA B 16 2.790 -8.949 -8.264 1.00 0.00 H new ATOM 0 HA ALA B 16 5.619 -9.062 -7.987 1.00 0.00 H new ATOM 0 HB1 ALA B 16 5.268 -11.466 -8.452 1.00 0.00 H new ATOM 0 HB2 ALA B 16 4.114 -10.852 -7.244 1.00 0.00 H new ATOM 0 HB3 ALA B 16 3.586 -11.121 -8.922 1.00 0.00 H new ATOM 1154 N GLU B 17 4.375 -9.178 -11.021 1.00 0.00 N ATOM 1155 CA GLU B 17 4.724 -9.098 -12.434 1.00 0.00 C ATOM 1156 C GLU B 17 5.407 -7.772 -12.752 1.00 0.00 C ATOM 1157 O GLU B 17 6.324 -7.713 -13.572 1.00 0.00 O ATOM 1158 CB GLU B 17 3.473 -9.260 -13.301 1.00 0.00 C ATOM 1159 CG GLU B 17 2.955 -7.951 -13.873 1.00 0.00 C ATOM 1160 CD GLU B 17 1.650 -8.120 -14.627 1.00 0.00 C ATOM 1161 OE1 GLU B 17 1.294 -9.273 -14.947 1.00 0.00 O ATOM 1162 OE2 GLU B 17 0.985 -7.098 -14.896 1.00 0.00 O ATOM 0 H GLU B 17 3.374 -9.130 -10.830 1.00 0.00 H new ATOM 0 HA GLU B 17 5.419 -9.907 -12.656 1.00 0.00 H new ATOM 0 HB2 GLU B 17 3.696 -9.942 -14.121 1.00 0.00 H new ATOM 0 HB3 GLU B 17 2.686 -9.723 -12.706 1.00 0.00 H new ATOM 0 HG2 GLU B 17 2.812 -7.236 -13.063 1.00 0.00 H new ATOM 0 HG3 GLU B 17 3.705 -7.529 -14.542 1.00 0.00 H new ATOM 1169 N LYS B 18 4.954 -6.708 -12.098 1.00 0.00 N ATOM 1170 CA LYS B 18 5.520 -5.381 -12.309 1.00 0.00 C ATOM 1171 C LYS B 18 7.008 -5.365 -11.973 1.00 0.00 C ATOM 1172 O LYS B 18 7.784 -4.624 -12.578 1.00 0.00 O ATOM 1173 CB LYS B 18 4.783 -4.348 -11.454 1.00 0.00 C ATOM 1174 CG LYS B 18 3.303 -4.236 -11.776 1.00 0.00 C ATOM 1175 CD LYS B 18 3.024 -3.076 -12.718 1.00 0.00 C ATOM 1176 CE LYS B 18 1.571 -2.631 -12.638 1.00 0.00 C ATOM 1177 NZ LYS B 18 1.414 -1.190 -12.976 1.00 0.00 N ATOM 0 H LYS B 18 4.196 -6.739 -11.417 1.00 0.00 H new ATOM 0 HA LYS B 18 5.400 -5.125 -13.362 1.00 0.00 H new ATOM 0 HB2 LYS B 18 4.899 -4.610 -10.402 1.00 0.00 H new ATOM 0 HB3 LYS B 18 5.251 -3.373 -11.593 1.00 0.00 H new ATOM 0 HG2 LYS B 18 2.957 -5.165 -12.229 1.00 0.00 H new ATOM 0 HG3 LYS B 18 2.738 -4.101 -10.854 1.00 0.00 H new ATOM 0 HD2 LYS B 18 3.676 -2.239 -12.470 1.00 0.00 H new ATOM 0 HD3 LYS B 18 3.260 -3.371 -13.740 1.00 0.00 H new ATOM 0 HE2 LYS B 18 0.969 -3.232 -13.320 1.00 0.00 H new ATOM 0 HE3 LYS B 18 1.190 -2.812 -11.633 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 0.410 -0.925 -12.910 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 1.968 -0.615 -12.310 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 1.754 -1.022 -13.944 1.00 0.00 H new ATOM 1191 N PHE B 19 7.401 -6.188 -11.006 1.00 0.00 N ATOM 1192 CA PHE B 19 8.797 -6.269 -10.591 1.00 0.00 C ATOM 1193 C PHE B 19 9.542 -7.331 -11.394 1.00 0.00 C ATOM 1194 O PHE B 19 10.687 -7.129 -11.798 1.00 0.00 O ATOM 1195 CB PHE B 19 8.889 -6.584 -9.097 1.00 0.00 C ATOM 1196 CG PHE B 19 8.840 -5.364 -8.222 1.00 0.00 C ATOM 1197 CD1 PHE B 19 7.626 -4.808 -7.853 1.00 0.00 C ATOM 1198 CD2 PHE B 19 10.009 -4.773 -7.769 1.00 0.00 C ATOM 1199 CE1 PHE B 19 7.579 -3.685 -7.049 1.00 0.00 C ATOM 1200 CE2 PHE B 19 9.968 -3.650 -6.965 1.00 0.00 C ATOM 1201 CZ PHE B 19 8.751 -3.106 -6.604 1.00 0.00 C ATOM 0 H PHE B 19 6.773 -6.808 -10.495 1.00 0.00 H new ATOM 0 HA PHE B 19 9.264 -5.302 -10.780 1.00 0.00 H new ATOM 0 HB2 PHE B 19 8.071 -7.250 -8.823 1.00 0.00 H new ATOM 0 HB3 PHE B 19 9.817 -7.122 -8.904 1.00 0.00 H new ATOM 0 HD1 PHE B 19 6.706 -5.257 -8.197 1.00 0.00 H new ATOM 0 HD2 PHE B 19 10.963 -5.195 -8.048 1.00 0.00 H new ATOM 0 HE1 PHE B 19 6.626 -3.260 -6.769 1.00 0.00 H new ATOM 0 HE2 PHE B 19 10.886 -3.198 -6.619 1.00 0.00 H new ATOM 0 HZ PHE B 19 8.716 -2.229 -5.975 1.00 0.00 H new ATOM 1211 N ALA B 20 8.885 -8.464 -11.620 1.00 0.00 N ATOM 1212 CA ALA B 20 9.483 -9.557 -12.374 1.00 0.00 C ATOM 1213 C ALA B 20 9.944 -9.087 -13.750 1.00 0.00 C ATOM 1214 O ALA B 20 11.033 -9.439 -14.204 1.00 0.00 O ATOM 1215 CB ALA B 20 8.496 -10.707 -12.511 1.00 0.00 C ATOM 0 H ALA B 20 7.937 -8.648 -11.291 1.00 0.00 H new ATOM 0 HA ALA B 20 10.358 -9.907 -11.826 1.00 0.00 H new ATOM 0 HB1 ALA B 20 8.957 -11.517 -13.077 1.00 0.00 H new ATOM 0 HB2 ALA B 20 8.219 -11.068 -11.521 1.00 0.00 H new ATOM 0 HB3 ALA B 20 7.604 -10.361 -13.034 1.00 0.00 H new ATOM 1221 N ALA B 21 9.108 -8.292 -14.409 1.00 0.00 N ATOM 1222 CA ALA B 21 9.431 -7.773 -15.732 1.00 0.00 C ATOM 1223 C ALA B 21 10.778 -7.057 -15.728 1.00 0.00 C ATOM 1224 O ALA B 21 11.577 -7.213 -16.652 1.00 0.00 O ATOM 1225 CB ALA B 21 8.334 -6.834 -16.213 1.00 0.00 C ATOM 0 H ALA B 21 8.202 -7.993 -14.048 1.00 0.00 H new ATOM 0 HA ALA B 21 9.500 -8.617 -16.419 1.00 0.00 H new ATOM 0 HB1 ALA B 21 8.588 -6.454 -17.202 1.00 0.00 H new ATOM 0 HB2 ALA B 21 7.389 -7.375 -16.264 1.00 0.00 H new ATOM 0 HB3 ALA B 21 8.238 -6.000 -15.518 1.00 0.00 H new ATOM 1231 N ILE B 22 11.023 -6.273 -14.683 1.00 0.00 N ATOM 1232 CA ILE B 22 12.273 -5.535 -14.560 1.00 0.00 C ATOM 1233 C ILE B 22 13.444 -6.476 -14.300 1.00 0.00 C ATOM 1234 O ILE B 22 14.479 -6.396 -14.963 1.00 0.00 O ATOM 1235 CB ILE B 22 12.203 -4.495 -13.426 1.00 0.00 C ATOM 1236 CG1 ILE B 22 11.073 -3.498 -13.688 1.00 0.00 C ATOM 1237 CG2 ILE B 22 13.534 -3.771 -13.288 1.00 0.00 C ATOM 1238 CD1 ILE B 22 10.492 -2.898 -12.427 1.00 0.00 C ATOM 0 H ILE B 22 10.372 -6.133 -13.910 1.00 0.00 H new ATOM 0 HA ILE B 22 12.429 -5.018 -15.507 1.00 0.00 H new ATOM 0 HB ILE B 22 11.995 -5.013 -12.490 1.00 0.00 H new ATOM 0 HG12 ILE B 22 11.448 -2.695 -14.323 1.00 0.00 H new ATOM 0 HG13 ILE B 22 10.279 -3.999 -14.242 1.00 0.00 H new ATOM 0 HG21 ILE B 22 13.468 -3.039 -12.483 1.00 0.00 H new ATOM 0 HG22 ILE B 22 14.319 -4.492 -13.060 1.00 0.00 H new ATOM 0 HG23 ILE B 22 13.770 -3.262 -14.222 1.00 0.00 H new ATOM 0 HD11 ILE B 22 9.696 -2.201 -12.689 1.00 0.00 H new ATOM 0 HD12 ILE B 22 10.087 -3.692 -11.800 1.00 0.00 H new ATOM 0 HD13 ILE B 22 11.274 -2.368 -11.882 1.00 0.00 H new ATOM 1250 N LEU B 23 13.274 -7.369 -13.331 1.00 0.00 N ATOM 1251 CA LEU B 23 14.317 -8.329 -12.983 1.00 0.00 C ATOM 1252 C LEU B 23 14.772 -9.108 -14.213 1.00 0.00 C ATOM 1253 O LEU B 23 15.961 -9.380 -14.382 1.00 0.00 O ATOM 1254 CB LEU B 23 13.810 -9.296 -11.912 1.00 0.00 C ATOM 1255 CG LEU B 23 14.459 -9.170 -10.533 1.00 0.00 C ATOM 1256 CD1 LEU B 23 15.945 -9.480 -10.612 1.00 0.00 C ATOM 1257 CD2 LEU B 23 14.231 -7.777 -9.963 1.00 0.00 C ATOM 0 H LEU B 23 12.424 -7.449 -12.772 1.00 0.00 H new ATOM 0 HA LEU B 23 15.170 -7.776 -12.590 1.00 0.00 H new ATOM 0 HB2 LEU B 23 12.735 -9.152 -11.800 1.00 0.00 H new ATOM 0 HB3 LEU B 23 13.960 -10.315 -12.270 1.00 0.00 H new ATOM 0 HG LEU B 23 13.994 -9.895 -9.865 1.00 0.00 H new ATOM 0 HD11 LEU B 23 16.390 -9.385 -9.621 1.00 0.00 H new ATOM 0 HD12 LEU B 23 16.086 -10.497 -10.977 1.00 0.00 H new ATOM 0 HD13 LEU B 23 16.427 -8.780 -11.294 1.00 0.00 H new ATOM 0 HD21 LEU B 23 14.699 -7.704 -8.981 1.00 0.00 H new ATOM 0 HD22 LEU B 23 14.669 -7.035 -10.630 1.00 0.00 H new ATOM 0 HD23 LEU B 23 13.161 -7.593 -9.869 1.00 0.00 H new ATOM 1269 N ILE B 24 13.819 -9.461 -15.070 1.00 0.00 N ATOM 1270 CA ILE B 24 14.123 -10.205 -16.286 1.00 0.00 C ATOM 1271 C ILE B 24 15.058 -9.414 -17.195 1.00 0.00 C ATOM 1272 O ILE B 24 16.002 -9.964 -17.763 1.00 0.00 O ATOM 1273 CB ILE B 24 12.843 -10.557 -17.066 1.00 0.00 C ATOM 1274 CG1 ILE B 24 11.917 -11.421 -16.206 1.00 0.00 C ATOM 1275 CG2 ILE B 24 13.192 -11.272 -18.362 1.00 0.00 C ATOM 1276 CD1 ILE B 24 10.448 -11.165 -16.456 1.00 0.00 C ATOM 0 H ILE B 24 12.830 -9.244 -14.944 1.00 0.00 H new ATOM 0 HA ILE B 24 14.615 -11.127 -15.977 1.00 0.00 H new ATOM 0 HB ILE B 24 12.320 -9.633 -17.314 1.00 0.00 H new ATOM 0 HG12 ILE B 24 12.132 -12.472 -16.398 1.00 0.00 H new ATOM 0 HG13 ILE B 24 12.136 -11.238 -15.154 1.00 0.00 H new ATOM 0 HG21 ILE B 24 12.277 -11.514 -18.902 1.00 0.00 H new ATOM 0 HG22 ILE B 24 13.816 -10.625 -18.978 1.00 0.00 H new ATOM 0 HG23 ILE B 24 13.734 -12.190 -18.136 1.00 0.00 H new ATOM 0 HD11 ILE B 24 9.851 -11.812 -15.813 1.00 0.00 H new ATOM 0 HD12 ILE B 24 10.218 -10.122 -16.236 1.00 0.00 H new ATOM 0 HD13 ILE B 24 10.214 -11.376 -17.500 1.00 0.00 H new ATOM 1288 N LYS B 25 14.790 -8.119 -17.327 1.00 0.00 N ATOM 1289 CA LYS B 25 15.608 -7.250 -18.165 1.00 0.00 C ATOM 1290 C LYS B 25 17.016 -7.114 -17.596 1.00 0.00 C ATOM 1291 O LYS B 25 18.001 -7.146 -18.334 1.00 0.00 O ATOM 1292 CB LYS B 25 14.960 -5.869 -18.287 1.00 0.00 C ATOM 1293 CG LYS B 25 13.536 -5.909 -18.815 1.00 0.00 C ATOM 1294 CD LYS B 25 13.490 -5.665 -20.314 1.00 0.00 C ATOM 1295 CE LYS B 25 14.207 -6.766 -21.080 1.00 0.00 C ATOM 1296 NZ LYS B 25 13.963 -6.671 -22.546 1.00 0.00 N ATOM 0 H LYS B 25 14.012 -7.648 -16.864 1.00 0.00 H new ATOM 0 HA LYS B 25 15.677 -7.701 -19.155 1.00 0.00 H new ATOM 0 HB2 LYS B 25 14.962 -5.388 -17.309 1.00 0.00 H new ATOM 0 HB3 LYS B 25 15.566 -5.250 -18.948 1.00 0.00 H new ATOM 0 HG2 LYS B 25 13.090 -6.878 -18.589 1.00 0.00 H new ATOM 0 HG3 LYS B 25 12.936 -5.156 -18.304 1.00 0.00 H new ATOM 0 HD2 LYS B 25 12.452 -5.608 -20.643 1.00 0.00 H new ATOM 0 HD3 LYS B 25 13.950 -4.703 -20.541 1.00 0.00 H new ATOM 0 HE2 LYS B 25 15.278 -6.706 -20.885 1.00 0.00 H new ATOM 0 HE3 LYS B 25 13.871 -7.738 -20.718 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 14.469 -7.439 -23.033 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 12.944 -6.754 -22.734 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 14.306 -5.754 -22.896 1.00 0.00 H new ATOM 1310 N VAL B 26 17.105 -6.964 -16.278 1.00 0.00 N ATOM 1311 CA VAL B 26 18.394 -6.826 -15.609 1.00 0.00 C ATOM 1312 C VAL B 26 19.229 -8.093 -15.760 1.00 0.00 C ATOM 1313 O VAL B 26 20.438 -8.029 -15.985 1.00 0.00 O ATOM 1314 CB VAL B 26 18.218 -6.515 -14.111 1.00 0.00 C ATOM 1315 CG1 VAL B 26 19.551 -6.134 -13.485 1.00 0.00 C ATOM 1316 CG2 VAL B 26 17.192 -5.409 -13.914 1.00 0.00 C ATOM 0 H VAL B 26 16.300 -6.935 -15.652 1.00 0.00 H new ATOM 0 HA VAL B 26 18.912 -5.994 -16.086 1.00 0.00 H new ATOM 0 HB VAL B 26 17.852 -7.412 -13.612 1.00 0.00 H new ATOM 0 HG11 VAL B 26 19.407 -5.918 -12.426 1.00 0.00 H new ATOM 0 HG12 VAL B 26 20.254 -6.960 -13.594 1.00 0.00 H new ATOM 0 HG13 VAL B 26 19.949 -5.251 -13.985 1.00 0.00 H new ATOM 0 HG21 VAL B 26 17.080 -5.202 -12.850 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.527 -4.507 -14.426 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.233 -5.725 -14.325 1.00 0.00 H new ATOM 1326 N PHE B 27 18.576 -9.244 -15.634 1.00 0.00 N ATOM 1327 CA PHE B 27 19.259 -10.527 -15.755 1.00 0.00 C ATOM 1328 C PHE B 27 19.748 -10.749 -17.183 1.00 0.00 C ATOM 1329 O PHE B 27 20.855 -11.242 -17.402 1.00 0.00 O ATOM 1330 CB PHE B 27 18.326 -11.666 -15.341 1.00 0.00 C ATOM 1331 CG PHE B 27 18.414 -12.013 -13.882 1.00 0.00 C ATOM 1332 CD1 PHE B 27 19.627 -12.367 -13.313 1.00 0.00 C ATOM 1333 CD2 PHE B 27 17.285 -11.985 -13.080 1.00 0.00 C ATOM 1334 CE1 PHE B 27 19.712 -12.686 -11.971 1.00 0.00 C ATOM 1335 CE2 PHE B 27 17.364 -12.303 -11.737 1.00 0.00 C ATOM 1336 CZ PHE B 27 18.579 -12.655 -11.182 1.00 0.00 C ATOM 0 H PHE B 27 17.576 -9.314 -15.448 1.00 0.00 H new ATOM 0 HA PHE B 27 20.123 -10.515 -15.091 1.00 0.00 H new ATOM 0 HB2 PHE B 27 17.299 -11.388 -15.579 1.00 0.00 H new ATOM 0 HB3 PHE B 27 18.562 -12.551 -15.932 1.00 0.00 H new ATOM 0 HD1 PHE B 27 20.516 -12.394 -13.925 1.00 0.00 H new ATOM 0 HD2 PHE B 27 16.332 -11.712 -13.509 1.00 0.00 H new ATOM 0 HE1 PHE B 27 20.664 -12.959 -11.540 1.00 0.00 H new ATOM 0 HE2 PHE B 27 16.476 -12.276 -11.122 1.00 0.00 H new ATOM 0 HZ PHE B 27 18.643 -12.905 -10.133 1.00 0.00 H new ATOM 1346 N ALA B 28 18.915 -10.383 -18.152 1.00 0.00 N ATOM 1347 CA ALA B 28 19.263 -10.541 -19.559 1.00 0.00 C ATOM 1348 C ALA B 28 20.492 -9.713 -19.917 1.00 0.00 C ATOM 1349 O ALA B 28 21.403 -10.197 -20.589 1.00 0.00 O ATOM 1350 CB ALA B 28 18.086 -10.151 -20.440 1.00 0.00 C ATOM 0 H ALA B 28 17.995 -9.975 -17.988 1.00 0.00 H new ATOM 0 HA ALA B 28 19.501 -11.590 -19.733 1.00 0.00 H new ATOM 0 HB1 ALA B 28 18.360 -10.274 -21.488 1.00 0.00 H new ATOM 0 HB2 ALA B 28 17.233 -10.789 -20.211 1.00 0.00 H new ATOM 0 HB3 ALA B 28 17.821 -9.110 -20.254 1.00 0.00 H new ATOM 1356 N GLU B 29 20.511 -8.463 -19.464 1.00 0.00 N ATOM 1357 CA GLU B 29 21.629 -7.569 -19.739 1.00 0.00 C ATOM 1358 C GLU B 29 22.880 -8.015 -18.989 1.00 0.00 C ATOM 1359 O GLU B 29 23.996 -7.624 -19.333 1.00 0.00 O ATOM 1360 CB GLU B 29 21.270 -6.133 -19.348 1.00 0.00 C ATOM 1361 CG GLU B 29 21.102 -5.935 -17.851 1.00 0.00 C ATOM 1362 CD GLU B 29 21.084 -4.471 -17.454 1.00 0.00 C ATOM 1363 OE1 GLU B 29 21.277 -3.614 -18.341 1.00 0.00 O ATOM 1364 OE2 GLU B 29 20.877 -4.184 -16.257 1.00 0.00 O ATOM 0 H GLU B 29 19.765 -8.047 -18.906 1.00 0.00 H new ATOM 0 HA GLU B 29 21.836 -7.606 -20.808 1.00 0.00 H new ATOM 0 HB2 GLU B 29 22.048 -5.461 -19.710 1.00 0.00 H new ATOM 0 HB3 GLU B 29 20.345 -5.849 -19.850 1.00 0.00 H new ATOM 0 HG2 GLU B 29 20.174 -6.407 -17.528 1.00 0.00 H new ATOM 0 HG3 GLU B 29 21.915 -6.439 -17.328 1.00 0.00 H new ATOM 1371 N LEU B 30 22.686 -8.835 -17.962 1.00 0.00 N ATOM 1372 CA LEU B 30 23.798 -9.335 -17.162 1.00 0.00 C ATOM 1373 C LEU B 30 24.316 -10.659 -17.716 1.00 0.00 C ATOM 1374 O LEU B 30 25.275 -11.228 -17.196 1.00 0.00 O ATOM 1375 CB LEU B 30 23.365 -9.513 -15.706 1.00 0.00 C ATOM 1376 CG LEU B 30 23.290 -8.237 -14.866 1.00 0.00 C ATOM 1377 CD1 LEU B 30 22.828 -8.555 -13.453 1.00 0.00 C ATOM 1378 CD2 LEU B 30 24.639 -7.534 -14.844 1.00 0.00 C ATOM 0 H LEU B 30 21.769 -9.168 -17.664 1.00 0.00 H new ATOM 0 HA LEU B 30 24.604 -8.603 -17.208 1.00 0.00 H new ATOM 0 HB2 LEU B 30 22.384 -9.989 -15.695 1.00 0.00 H new ATOM 0 HB3 LEU B 30 24.059 -10.201 -15.223 1.00 0.00 H new ATOM 0 HG LEU B 30 22.561 -7.566 -15.321 1.00 0.00 H new ATOM 0 HD11 LEU B 30 22.781 -7.635 -12.870 1.00 0.00 H new ATOM 0 HD12 LEU B 30 21.840 -9.014 -13.488 1.00 0.00 H new ATOM 0 HD13 LEU B 30 23.532 -9.244 -12.987 1.00 0.00 H new ATOM 0 HD21 LEU B 30 24.567 -6.628 -14.242 1.00 0.00 H new ATOM 0 HD22 LEU B 30 25.388 -8.198 -14.413 1.00 0.00 H new ATOM 0 HD23 LEU B 30 24.929 -7.271 -15.861 1.00 0.00 H new ATOM 1390 N GLY B 31 23.676 -11.142 -18.776 1.00 0.00 N ATOM 1391 CA GLY B 31 24.087 -12.393 -19.384 1.00 0.00 C ATOM 1392 C GLY B 31 23.421 -13.596 -18.745 1.00 0.00 C ATOM 1393 O GLY B 31 23.815 -14.736 -18.990 1.00 0.00 O ATOM 0 H GLY B 31 22.880 -10.689 -19.225 1.00 0.00 H new ATOM 0 HA2 GLY B 31 23.848 -12.372 -20.447 1.00 0.00 H new ATOM 0 HA3 GLY B 31 25.169 -12.495 -19.302 1.00 0.00 H new ATOM 1397 N TYR B 32 22.410 -13.341 -17.922 1.00 0.00 N ATOM 1398 CA TYR B 32 21.690 -14.411 -17.242 1.00 0.00 C ATOM 1399 C TYR B 32 20.446 -14.815 -18.027 1.00 0.00 C ATOM 1400 O TYR B 32 19.422 -15.175 -17.447 1.00 0.00 O ATOM 1401 CB TYR B 32 21.296 -13.973 -15.830 1.00 0.00 C ATOM 1402 CG TYR B 32 22.476 -13.783 -14.904 1.00 0.00 C ATOM 1403 CD1 TYR B 32 23.387 -12.753 -15.110 1.00 0.00 C ATOM 1404 CD2 TYR B 32 22.681 -14.633 -13.824 1.00 0.00 C ATOM 1405 CE1 TYR B 32 24.467 -12.576 -14.267 1.00 0.00 C ATOM 1406 CE2 TYR B 32 23.757 -14.462 -12.975 1.00 0.00 C ATOM 1407 CZ TYR B 32 24.647 -13.432 -13.201 1.00 0.00 C ATOM 1408 OH TYR B 32 25.721 -13.260 -12.358 1.00 0.00 O ATOM 0 H TYR B 32 22.071 -12.403 -17.710 1.00 0.00 H new ATOM 0 HA TYR B 32 22.352 -15.274 -17.176 1.00 0.00 H new ATOM 0 HB2 TYR B 32 20.738 -13.038 -15.891 1.00 0.00 H new ATOM 0 HB3 TYR B 32 20.625 -14.717 -15.402 1.00 0.00 H new ATOM 0 HD1 TYR B 32 23.248 -12.080 -15.943 1.00 0.00 H new ATOM 0 HD2 TYR B 32 21.987 -15.441 -13.645 1.00 0.00 H new ATOM 0 HE1 TYR B 32 25.166 -11.772 -14.442 1.00 0.00 H new ATOM 0 HE2 TYR B 32 23.901 -15.131 -12.139 1.00 0.00 H new ATOM 0 HH TYR B 32 25.425 -13.350 -11.428 1.00 0.00 H new ATOM 1418 N ASN B 33 20.544 -14.754 -19.351 1.00 0.00 N ATOM 1419 CA ASN B 33 19.427 -15.113 -20.217 1.00 0.00 C ATOM 1420 C ASN B 33 18.852 -16.472 -19.829 1.00 0.00 C ATOM 1421 O ASN B 33 19.503 -17.259 -19.141 1.00 0.00 O ATOM 1422 CB ASN B 33 19.876 -15.136 -21.680 1.00 0.00 C ATOM 1423 CG ASN B 33 21.275 -15.696 -21.846 1.00 0.00 C ATOM 1424 OD1 ASN B 33 22.278 -14.844 -21.667 1.00 0.00 O flip ATOM 1425 ND2 ASN B 33 21.452 -16.880 -22.133 1.00 0.00 N flip ATOM 0 H ASN B 33 21.385 -14.460 -19.847 1.00 0.00 H new ATOM 0 HA ASN B 33 18.648 -14.360 -20.094 1.00 0.00 H new ATOM 0 HB2 ASN B 33 19.176 -15.735 -22.263 1.00 0.00 H new ATOM 0 HB3 ASN B 33 19.842 -14.124 -22.084 1.00 0.00 H new ATOM 0 HD21 ASN B 33 20.651 -17.499 -22.261 1.00 0.00 H new ATOM 0 HD22 ASN B 33 22.399 -17.242 -22.243 1.00 0.00 H new ATOM 1432 N ASP B 34 17.630 -16.741 -20.275 1.00 0.00 N ATOM 1433 CA ASP B 34 16.968 -18.005 -19.976 1.00 0.00 C ATOM 1434 C ASP B 34 16.565 -18.073 -18.506 1.00 0.00 C ATOM 1435 O ASP B 34 16.975 -18.981 -17.781 1.00 0.00 O ATOM 1436 CB ASP B 34 17.884 -19.180 -20.321 1.00 0.00 C ATOM 1437 CG ASP B 34 17.112 -20.401 -20.781 1.00 0.00 C ATOM 1438 OD1 ASP B 34 16.606 -20.388 -21.923 1.00 0.00 O ATOM 1439 OD2 ASP B 34 17.015 -21.370 -20.000 1.00 0.00 O ATOM 0 H ASP B 34 17.078 -16.100 -20.845 1.00 0.00 H new ATOM 0 HA ASP B 34 16.066 -18.067 -20.585 1.00 0.00 H new ATOM 0 HB2 ASP B 34 18.579 -18.877 -21.104 1.00 0.00 H new ATOM 0 HB3 ASP B 34 18.482 -19.440 -19.447 1.00 0.00 H new ATOM 1444 N ILE B 35 15.761 -17.108 -18.073 1.00 0.00 N ATOM 1445 CA ILE B 35 15.304 -17.059 -16.690 1.00 0.00 C ATOM 1446 C ILE B 35 14.014 -17.851 -16.509 1.00 0.00 C ATOM 1447 O ILE B 35 13.168 -17.892 -17.402 1.00 0.00 O ATOM 1448 CB ILE B 35 15.072 -15.609 -16.224 1.00 0.00 C ATOM 1449 CG1 ILE B 35 15.977 -15.282 -15.034 1.00 0.00 C ATOM 1450 CG2 ILE B 35 13.610 -15.397 -15.860 1.00 0.00 C ATOM 1451 CD1 ILE B 35 17.373 -14.861 -15.435 1.00 0.00 C ATOM 0 H ILE B 35 15.413 -16.350 -18.660 1.00 0.00 H new ATOM 0 HA ILE B 35 16.091 -17.506 -16.082 1.00 0.00 H new ATOM 0 HB ILE B 35 15.323 -14.935 -17.043 1.00 0.00 H new ATOM 0 HG12 ILE B 35 15.520 -14.484 -14.448 1.00 0.00 H new ATOM 0 HG13 ILE B 35 16.042 -16.156 -14.386 1.00 0.00 H new ATOM 0 HG21 ILE B 35 13.462 -14.368 -15.533 1.00 0.00 H new ATOM 0 HG22 ILE B 35 12.986 -15.594 -16.732 1.00 0.00 H new ATOM 0 HG23 ILE B 35 13.333 -16.077 -15.054 1.00 0.00 H new ATOM 0 HD11 ILE B 35 17.959 -14.645 -14.541 1.00 0.00 H new ATOM 0 HD12 ILE B 35 17.849 -15.666 -15.995 1.00 0.00 H new ATOM 0 HD13 ILE B 35 17.319 -13.968 -16.058 1.00 0.00 H new ATOM 1463 N ASN B 36 13.869 -18.479 -15.346 1.00 0.00 N ATOM 1464 CA ASN B 36 12.680 -19.270 -15.047 1.00 0.00 C ATOM 1465 C ASN B 36 12.027 -18.800 -13.751 1.00 0.00 C ATOM 1466 O ASN B 36 12.670 -18.748 -12.702 1.00 0.00 O ATOM 1467 CB ASN B 36 13.042 -20.752 -14.942 1.00 0.00 C ATOM 1468 CG ASN B 36 12.898 -21.478 -16.265 1.00 0.00 C ATOM 1469 OD1 ASN B 36 13.593 -21.170 -17.234 1.00 0.00 O ATOM 1470 ND2 ASN B 36 11.993 -22.449 -16.312 1.00 0.00 N ATOM 0 H ASN B 36 14.560 -18.456 -14.596 1.00 0.00 H new ATOM 0 HA ASN B 36 11.968 -19.134 -15.861 1.00 0.00 H new ATOM 0 HB2 ASN B 36 14.068 -20.848 -14.588 1.00 0.00 H new ATOM 0 HB3 ASN B 36 12.402 -21.228 -14.198 1.00 0.00 H new ATOM 0 HD21 ASN B 36 11.852 -22.973 -17.175 1.00 0.00 H new ATOM 0 HD22 ASN B 36 11.439 -22.670 -15.485 1.00 0.00 H new ATOM 1477 N VAL B 37 10.744 -18.461 -13.830 1.00 0.00 N ATOM 1478 CA VAL B 37 10.002 -17.998 -12.664 1.00 0.00 C ATOM 1479 C VAL B 37 9.160 -19.120 -12.067 1.00 0.00 C ATOM 1480 O VAL B 37 8.502 -19.870 -12.790 1.00 0.00 O ATOM 1481 CB VAL B 37 9.084 -16.813 -13.017 1.00 0.00 C ATOM 1482 CG1 VAL B 37 7.966 -17.262 -13.946 1.00 0.00 C ATOM 1483 CG2 VAL B 37 8.517 -16.184 -11.753 1.00 0.00 C ATOM 0 H VAL B 37 10.197 -18.499 -14.690 1.00 0.00 H new ATOM 0 HA VAL B 37 10.738 -17.671 -11.930 1.00 0.00 H new ATOM 0 HB VAL B 37 9.676 -16.060 -13.537 1.00 0.00 H new ATOM 0 HG11 VAL B 37 7.327 -16.411 -14.185 1.00 0.00 H new ATOM 0 HG12 VAL B 37 8.395 -17.663 -14.864 1.00 0.00 H new ATOM 0 HG13 VAL B 37 7.373 -18.034 -13.455 1.00 0.00 H new ATOM 0 HG21 VAL B 37 7.871 -15.348 -12.021 1.00 0.00 H new ATOM 0 HG22 VAL B 37 7.940 -16.928 -11.204 1.00 0.00 H new ATOM 0 HG23 VAL B 37 9.334 -15.825 -11.127 1.00 0.00 H new ATOM 1493 N THR B 38 9.183 -19.230 -10.743 1.00 0.00 N ATOM 1494 CA THR B 38 8.422 -20.261 -10.048 1.00 0.00 C ATOM 1495 C THR B 38 7.606 -19.667 -8.906 1.00 0.00 C ATOM 1496 O THR B 38 8.162 -19.155 -7.934 1.00 0.00 O ATOM 1497 CB THR B 38 9.346 -21.359 -9.487 1.00 0.00 C ATOM 1498 OG1 THR B 38 10.465 -20.764 -8.820 1.00 0.00 O ATOM 1499 CG2 THR B 38 9.838 -22.273 -10.599 1.00 0.00 C ATOM 0 H THR B 38 9.721 -18.617 -10.130 1.00 0.00 H new ATOM 0 HA THR B 38 7.747 -20.703 -10.781 1.00 0.00 H new ATOM 0 HB THR B 38 8.775 -21.955 -8.775 1.00 0.00 H new ATOM 0 HG1 THR B 38 10.158 -20.010 -8.274 1.00 0.00 H new ATOM 0 HG21 THR B 38 10.488 -23.040 -10.179 1.00 0.00 H new ATOM 0 HG22 THR B 38 8.985 -22.747 -11.085 1.00 0.00 H new ATOM 0 HG23 THR B 38 10.394 -21.688 -11.332 1.00 0.00 H new ATOM 1576 N VAL B 44 6.397 -15.184 -5.567 1.00 0.00 N ATOM 1577 CA VAL B 44 7.060 -15.362 -6.853 1.00 0.00 C ATOM 1578 C VAL B 44 8.575 -15.259 -6.709 1.00 0.00 C ATOM 1579 O VAL B 44 9.091 -14.299 -6.135 1.00 0.00 O ATOM 1580 CB VAL B 44 6.581 -14.320 -7.881 1.00 0.00 C ATOM 1581 CG1 VAL B 44 5.202 -14.686 -8.409 1.00 0.00 C ATOM 1582 CG2 VAL B 44 6.573 -12.929 -7.265 1.00 0.00 C ATOM 0 HA VAL B 44 6.798 -16.359 -7.209 1.00 0.00 H new ATOM 0 HB VAL B 44 7.276 -14.317 -8.720 1.00 0.00 H new ATOM 0 HG11 VAL B 44 4.880 -13.939 -9.134 1.00 0.00 H new ATOM 0 HG12 VAL B 44 5.244 -15.663 -8.890 1.00 0.00 H new ATOM 0 HG13 VAL B 44 4.493 -14.719 -7.582 1.00 0.00 H new ATOM 0 HG21 VAL B 44 6.232 -12.205 -8.005 1.00 0.00 H new ATOM 0 HG22 VAL B 44 5.901 -12.915 -6.407 1.00 0.00 H new ATOM 0 HG23 VAL B 44 7.581 -12.669 -6.941 1.00 0.00 H new ATOM 1592 N THR B 45 9.283 -16.253 -7.235 1.00 0.00 N ATOM 1593 CA THR B 45 10.738 -16.275 -7.165 1.00 0.00 C ATOM 1594 C THR B 45 11.351 -16.515 -8.540 1.00 0.00 C ATOM 1595 O THR B 45 11.004 -17.476 -9.227 1.00 0.00 O ATOM 1596 CB THR B 45 11.238 -17.363 -6.196 1.00 0.00 C ATOM 1597 OG1 THR B 45 10.473 -17.331 -4.986 1.00 0.00 O ATOM 1598 CG2 THR B 45 12.712 -17.167 -5.876 1.00 0.00 C ATOM 0 H THR B 45 8.872 -17.054 -7.714 1.00 0.00 H new ATOM 0 HA THR B 45 11.051 -15.298 -6.796 1.00 0.00 H new ATOM 0 HB THR B 45 11.113 -18.333 -6.678 1.00 0.00 H new ATOM 0 HG1 THR B 45 10.796 -18.027 -4.376 1.00 0.00 H new ATOM 0 HG21 THR B 45 13.042 -17.947 -5.190 1.00 0.00 H new ATOM 0 HG22 THR B 45 13.294 -17.222 -6.796 1.00 0.00 H new ATOM 0 HG23 THR B 45 12.857 -16.191 -5.413 1.00 0.00 H new ATOM 1606 N VAL B 46 12.265 -15.635 -8.937 1.00 0.00 N ATOM 1607 CA VAL B 46 12.928 -15.753 -10.231 1.00 0.00 C ATOM 1608 C VAL B 46 14.215 -16.562 -10.117 1.00 0.00 C ATOM 1609 O VAL B 46 14.972 -16.411 -9.159 1.00 0.00 O ATOM 1610 CB VAL B 46 13.256 -14.368 -10.821 1.00 0.00 C ATOM 1611 CG1 VAL B 46 14.393 -13.715 -10.051 1.00 0.00 C ATOM 1612 CG2 VAL B 46 13.601 -14.488 -12.298 1.00 0.00 C ATOM 0 H VAL B 46 12.563 -14.833 -8.382 1.00 0.00 H new ATOM 0 HA VAL B 46 12.236 -16.269 -10.896 1.00 0.00 H new ATOM 0 HB VAL B 46 12.375 -13.734 -10.727 1.00 0.00 H new ATOM 0 HG11 VAL B 46 14.610 -12.738 -10.482 1.00 0.00 H new ATOM 0 HG12 VAL B 46 14.103 -13.595 -9.007 1.00 0.00 H new ATOM 0 HG13 VAL B 46 15.281 -14.344 -10.111 1.00 0.00 H new ATOM 0 HG21 VAL B 46 13.830 -13.501 -12.699 1.00 0.00 H new ATOM 0 HG22 VAL B 46 14.467 -15.138 -12.418 1.00 0.00 H new ATOM 0 HG23 VAL B 46 12.753 -14.911 -12.837 1.00 0.00 H new ATOM 1622 N GLU B 47 14.456 -17.422 -11.102 1.00 0.00 N ATOM 1623 CA GLU B 47 15.653 -18.255 -11.112 1.00 0.00 C ATOM 1624 C GLU B 47 16.446 -18.054 -12.400 1.00 0.00 C ATOM 1625 O GLU B 47 15.931 -18.262 -13.498 1.00 0.00 O ATOM 1626 CB GLU B 47 15.275 -19.730 -10.958 1.00 0.00 C ATOM 1627 CG GLU B 47 15.051 -20.154 -9.516 1.00 0.00 C ATOM 1628 CD GLU B 47 15.203 -21.650 -9.318 1.00 0.00 C ATOM 1629 OE1 GLU B 47 14.194 -22.372 -9.454 1.00 0.00 O ATOM 1630 OE2 GLU B 47 16.332 -22.097 -9.026 1.00 0.00 O ATOM 0 H GLU B 47 13.839 -17.560 -11.902 1.00 0.00 H new ATOM 0 HA GLU B 47 16.279 -17.957 -10.271 1.00 0.00 H new ATOM 0 HB2 GLU B 47 14.368 -19.926 -11.530 1.00 0.00 H new ATOM 0 HB3 GLU B 47 16.064 -20.346 -11.390 1.00 0.00 H new ATOM 0 HG2 GLU B 47 15.760 -19.632 -8.873 1.00 0.00 H new ATOM 0 HG3 GLU B 47 14.053 -19.849 -9.202 1.00 0.00 H new ATOM 1637 N GLY B 48 17.704 -17.646 -12.256 1.00 0.00 N ATOM 1638 CA GLY B 48 18.548 -17.423 -13.415 1.00 0.00 C ATOM 1639 C GLY B 48 19.888 -18.121 -13.299 1.00 0.00 C ATOM 1640 O GLY B 48 20.262 -18.584 -12.222 1.00 0.00 O ATOM 0 H GLY B 48 18.153 -17.466 -11.358 1.00 0.00 H new ATOM 0 HA2 GLY B 48 18.034 -17.777 -14.309 1.00 0.00 H new ATOM 0 HA3 GLY B 48 18.709 -16.353 -13.543 1.00 0.00 H new ATOM 1644 N GLN B 49 20.611 -18.199 -14.411 1.00 0.00 N ATOM 1645 CA GLN B 49 21.917 -18.848 -14.430 1.00 0.00 C ATOM 1646 C GLN B 49 22.849 -18.169 -15.428 1.00 0.00 C ATOM 1647 O GLN B 49 22.426 -17.766 -16.513 1.00 0.00 O ATOM 1648 CB GLN B 49 21.768 -20.330 -14.779 1.00 0.00 C ATOM 1649 CG GLN B 49 21.315 -20.575 -16.210 1.00 0.00 C ATOM 1650 CD GLN B 49 19.861 -20.209 -16.433 1.00 0.00 C ATOM 1651 OE1 GLN B 49 18.956 -20.933 -16.017 1.00 0.00 O ATOM 1652 NE2 GLN B 49 19.629 -19.080 -17.092 1.00 0.00 N ATOM 0 H GLN B 49 20.315 -17.821 -15.311 1.00 0.00 H new ATOM 0 HA GLN B 49 22.354 -18.758 -13.435 1.00 0.00 H new ATOM 0 HB2 GLN B 49 22.723 -20.831 -14.618 1.00 0.00 H new ATOM 0 HB3 GLN B 49 21.050 -20.785 -14.096 1.00 0.00 H new ATOM 0 HG2 GLN B 49 21.940 -19.995 -16.889 1.00 0.00 H new ATOM 0 HG3 GLN B 49 21.463 -21.626 -16.459 1.00 0.00 H new ATOM 0 HE21 GLN B 49 20.410 -18.511 -17.419 1.00 0.00 H new ATOM 0 HE22 GLN B 49 18.670 -18.782 -17.271 1.00 0.00 H new ATOM 1661 N LEU B 50 24.118 -18.046 -15.056 1.00 0.00 N ATOM 1662 CA LEU B 50 25.111 -17.415 -15.919 1.00 0.00 C ATOM 1663 C LEU B 50 26.072 -18.452 -16.491 1.00 0.00 C ATOM 1664 O LEU B 50 26.493 -19.374 -15.793 1.00 0.00 O ATOM 1665 CB LEU B 50 25.891 -16.355 -15.141 1.00 0.00 C ATOM 1666 CG LEU B 50 26.141 -15.035 -15.871 1.00 0.00 C ATOM 1667 CD1 LEU B 50 27.115 -14.168 -15.089 1.00 0.00 C ATOM 1668 CD2 LEU B 50 26.664 -15.294 -17.277 1.00 0.00 C ATOM 0 H LEU B 50 24.484 -18.375 -14.163 1.00 0.00 H new ATOM 0 HA LEU B 50 24.587 -16.937 -16.746 1.00 0.00 H new ATOM 0 HB2 LEU B 50 25.352 -16.140 -14.218 1.00 0.00 H new ATOM 0 HB3 LEU B 50 26.854 -16.778 -14.856 1.00 0.00 H new ATOM 0 HG LEU B 50 25.194 -14.501 -15.950 1.00 0.00 H new ATOM 0 HD11 LEU B 50 27.280 -13.233 -15.624 1.00 0.00 H new ATOM 0 HD12 LEU B 50 26.701 -13.954 -14.104 1.00 0.00 H new ATOM 0 HD13 LEU B 50 28.063 -14.695 -14.978 1.00 0.00 H new ATOM 0 HD21 LEU B 50 26.836 -14.344 -17.782 1.00 0.00 H new ATOM 0 HD22 LEU B 50 27.600 -15.850 -17.220 1.00 0.00 H new ATOM 0 HD23 LEU B 50 25.931 -15.874 -17.837 1.00 0.00 H new