USER MOD reduce.3.24.130724 H: found=0, std=0, add=685, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 683 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 35 GLN : amide:sc= -1.71 K(o=-1.8,f=-3.6!) USER MOD Set 1.2: A 49 GLN : amide:sc= -0.0584 K(o=-1.8,f=-2.5) 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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 HIS : no HE2:sc= -0.396 K(o=-0.4,f=-4.4!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= -0.332 K(o=-0.33,f=-1.8!) USER MOD Single : A 18 LYS NZ :NH3+ 151:sc= -2.8! (180deg=-3.52!) USER MOD Single : A 19 HIS : no HD1:sc= -0.399 X(o=-0.4,f=-0.4) USER MOD Single : A 22 HIS : no HE2:sc= -5.48! C(o=-5.5!,f=-6.3!) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 GLN : amide:sc=-0.000553 X(o=-0.00055,f=-0.45) USER MOD Single : A 29 SER OG : rot 49:sc= 1.24 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.422 X(o=-0.42,f=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -2.63! C(o=-2.6!,f=-10!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 146:sc= -0.5 (180deg=-2.79!) USER MOD Single : A 59 LYS NZ :NH3+ 155:sc= 0.00515 (180deg=0) USER MOD Single : A 60 SER OG : rot 47:sc= 0.371 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 MET CE :methyl -172:sc= -0.338 (180deg=-0.5) USER MOD Single : A 66 THR OG1 : rot -150:sc= -0.926 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 CYS SG : rot 146:sc= -4.79! USER MOD Single : A 80 MET CE :methyl -155:sc=-0.00475 (180deg=-1.19) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ -163:sc= -0.0347 (180deg=-0.248) USER MOD Single : A 86 ASN : amide:sc= -0.129 X(o=-0.13,f=-0.089) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.689 6.465 18.170 1.00 0.00 N ATOM 2 CA GLY A 1 7.295 6.071 18.082 1.00 0.00 C ATOM 3 C GLY A 1 6.358 7.132 18.622 1.00 0.00 C ATOM 4 O GLY A 1 5.469 6.837 19.421 1.00 0.00 O ATOM 0 H1 GLY A 1 9.289 5.706 17.788 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.839 7.335 17.620 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.939 6.637 19.165 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.044 5.864 17.042 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.147 5.144 18.636 1.00 0.00 H new ATOM 8 N SER A 2 6.556 8.372 18.185 1.00 0.00 N ATOM 9 CA SER A 2 5.724 9.482 18.634 1.00 0.00 C ATOM 10 C SER A 2 5.622 10.556 17.555 1.00 0.00 C ATOM 11 O SER A 2 6.243 10.449 16.497 1.00 0.00 O ATOM 12 CB SER A 2 6.294 10.087 19.919 1.00 0.00 C ATOM 13 OG SER A 2 7.598 10.599 19.707 1.00 0.00 O ATOM 0 H SER A 2 7.285 8.633 17.521 1.00 0.00 H new ATOM 0 HA SER A 2 4.724 9.096 18.834 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.640 10.885 20.271 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.321 9.328 20.701 1.00 0.00 H new ATOM 0 HG SER A 2 7.939 10.981 20.542 1.00 0.00 H new ATOM 19 N SER A 3 4.835 11.591 17.830 1.00 0.00 N ATOM 20 CA SER A 3 4.648 12.683 16.882 1.00 0.00 C ATOM 21 C SER A 3 5.733 13.742 17.053 1.00 0.00 C ATOM 22 O SER A 3 6.543 13.674 17.976 1.00 0.00 O ATOM 23 CB SER A 3 3.268 13.316 17.067 1.00 0.00 C ATOM 24 OG SER A 3 2.277 12.597 16.353 1.00 0.00 O ATOM 0 H SER A 3 4.316 11.696 18.702 1.00 0.00 H new ATOM 0 HA SER A 3 4.720 12.273 15.874 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.013 13.338 18.127 1.00 0.00 H new ATOM 0 HB3 SER A 3 3.290 14.350 16.723 1.00 0.00 H new ATOM 0 HG SER A 3 1.404 13.021 16.489 1.00 0.00 H new ATOM 30 N GLY A 4 5.741 14.722 16.154 1.00 0.00 N ATOM 31 CA GLY A 4 6.729 15.782 16.222 1.00 0.00 C ATOM 32 C GLY A 4 7.844 15.601 15.210 1.00 0.00 C ATOM 33 O GLY A 4 8.066 16.462 14.359 1.00 0.00 O ATOM 0 H GLY A 4 5.081 14.800 15.380 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.240 16.741 16.052 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.154 15.814 17.225 1.00 0.00 H new ATOM 37 N SER A 5 8.548 14.478 15.304 1.00 0.00 N ATOM 38 CA SER A 5 9.650 14.188 14.393 1.00 0.00 C ATOM 39 C SER A 5 9.127 13.785 13.018 1.00 0.00 C ATOM 40 O SER A 5 9.379 14.463 12.022 1.00 0.00 O ATOM 41 CB SER A 5 10.532 13.075 14.963 1.00 0.00 C ATOM 42 OG SER A 5 11.359 13.563 16.005 1.00 0.00 O ATOM 0 H SER A 5 8.375 13.754 16.001 1.00 0.00 H new ATOM 0 HA SER A 5 10.246 15.094 14.284 1.00 0.00 H new ATOM 0 HB2 SER A 5 9.905 12.267 15.340 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.151 12.655 14.170 1.00 0.00 H new ATOM 0 HG SER A 5 11.911 12.832 16.354 1.00 0.00 H new ATOM 48 N SER A 6 8.396 12.676 12.972 1.00 0.00 N ATOM 49 CA SER A 6 7.839 12.178 11.720 1.00 0.00 C ATOM 50 C SER A 6 6.679 11.223 11.982 1.00 0.00 C ATOM 51 O SER A 6 6.329 10.954 13.131 1.00 0.00 O ATOM 52 CB SER A 6 8.921 11.471 10.902 1.00 0.00 C ATOM 53 OG SER A 6 9.443 10.356 11.602 1.00 0.00 O ATOM 0 H SER A 6 8.176 12.105 13.788 1.00 0.00 H new ATOM 0 HA SER A 6 7.464 13.031 11.154 1.00 0.00 H new ATOM 0 HB2 SER A 6 8.505 11.144 9.949 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.725 12.171 10.675 1.00 0.00 H new ATOM 0 HG SER A 6 10.131 9.921 11.057 1.00 0.00 H new ATOM 59 N GLY A 7 6.085 10.713 10.907 1.00 0.00 N ATOM 60 CA GLY A 7 4.971 9.793 11.042 1.00 0.00 C ATOM 61 C GLY A 7 3.636 10.508 11.123 1.00 0.00 C ATOM 62 O GLY A 7 3.585 11.720 11.335 1.00 0.00 O ATOM 0 H GLY A 7 6.355 10.921 9.946 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.963 9.110 10.193 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.110 9.187 11.937 1.00 0.00 H new ATOM 66 N LEU A 8 2.554 9.757 10.954 1.00 0.00 N ATOM 67 CA LEU A 8 1.212 10.326 11.008 1.00 0.00 C ATOM 68 C LEU A 8 0.240 9.368 11.689 1.00 0.00 C ATOM 69 O LEU A 8 0.426 8.151 11.657 1.00 0.00 O ATOM 70 CB LEU A 8 0.718 10.654 9.597 1.00 0.00 C ATOM 71 CG LEU A 8 0.731 9.498 8.597 1.00 0.00 C ATOM 72 CD1 LEU A 8 -0.378 9.667 7.570 1.00 0.00 C ATOM 73 CD2 LEU A 8 2.086 9.403 7.909 1.00 0.00 C ATOM 0 H LEU A 8 2.579 8.753 10.778 1.00 0.00 H new ATOM 0 HA LEU A 8 1.258 11.244 11.593 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -0.301 11.034 9.669 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.332 11.461 9.197 1.00 0.00 H new ATOM 0 HG LEU A 8 0.556 8.570 9.142 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.353 8.835 6.867 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.343 9.685 8.076 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.234 10.603 7.030 1.00 0.00 H new ATOM 0 HD21 LEU A 8 2.077 8.575 7.201 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.290 10.333 7.378 1.00 0.00 H new ATOM 0 HD23 LEU A 8 2.862 9.234 8.655 1.00 0.00 H new ATOM 85 N THR A 9 -0.798 9.924 12.305 1.00 0.00 N ATOM 86 CA THR A 9 -1.799 9.119 12.993 1.00 0.00 C ATOM 87 C THR A 9 -3.059 8.967 12.148 1.00 0.00 C ATOM 88 O THR A 9 -3.904 9.862 12.108 1.00 0.00 O ATOM 89 CB THR A 9 -2.179 9.736 14.353 1.00 0.00 C ATOM 90 OG1 THR A 9 -1.008 9.897 15.161 1.00 0.00 O ATOM 91 CG2 THR A 9 -3.188 8.862 15.081 1.00 0.00 C ATOM 0 H THR A 9 -0.967 10.929 12.341 1.00 0.00 H new ATOM 0 HA THR A 9 -1.355 8.137 13.158 1.00 0.00 H new ATOM 0 HB THR A 9 -2.632 10.711 14.172 1.00 0.00 H new ATOM 0 HG1 THR A 9 -1.257 10.291 16.023 1.00 0.00 H new ATOM 0 HG21 THR A 9 -3.441 9.318 16.038 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.089 8.765 14.476 1.00 0.00 H new ATOM 0 HG23 THR A 9 -2.758 7.875 15.252 1.00 0.00 H new ATOM 99 N VAL A 10 -3.179 7.829 11.473 1.00 0.00 N ATOM 100 CA VAL A 10 -4.337 7.559 10.629 1.00 0.00 C ATOM 101 C VAL A 10 -5.006 6.245 11.017 1.00 0.00 C ATOM 102 O VAL A 10 -4.334 5.252 11.298 1.00 0.00 O ATOM 103 CB VAL A 10 -3.946 7.503 9.141 1.00 0.00 C ATOM 104 CG1 VAL A 10 -2.706 6.644 8.946 1.00 0.00 C ATOM 105 CG2 VAL A 10 -5.105 6.979 8.305 1.00 0.00 C ATOM 0 H VAL A 10 -2.488 7.079 11.494 1.00 0.00 H new ATOM 0 HA VAL A 10 -5.038 8.379 10.782 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.714 8.514 8.806 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -2.445 6.616 7.888 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.877 7.068 9.513 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -2.906 5.632 9.297 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -4.811 6.946 7.256 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -5.370 5.976 8.639 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -5.965 7.639 8.420 1.00 0.00 H new ATOM 115 N THR A 11 -6.335 6.245 11.031 1.00 0.00 N ATOM 116 CA THR A 11 -7.096 5.054 11.385 1.00 0.00 C ATOM 117 C THR A 11 -7.265 4.132 10.183 1.00 0.00 C ATOM 118 O THR A 11 -7.403 4.592 9.050 1.00 0.00 O ATOM 119 CB THR A 11 -8.487 5.419 11.937 1.00 0.00 C ATOM 120 OG1 THR A 11 -8.352 6.197 13.132 1.00 0.00 O ATOM 121 CG2 THR A 11 -9.299 4.166 12.231 1.00 0.00 C ATOM 0 H THR A 11 -6.907 7.058 10.801 1.00 0.00 H new ATOM 0 HA THR A 11 -6.530 4.537 12.160 1.00 0.00 H new ATOM 0 HB THR A 11 -9.011 6.003 11.181 1.00 0.00 H new ATOM 0 HG1 THR A 11 -9.241 6.426 13.475 1.00 0.00 H new ATOM 0 HG21 THR A 11 -10.277 4.449 12.620 1.00 0.00 H new ATOM 0 HG22 THR A 11 -9.426 3.591 11.314 1.00 0.00 H new ATOM 0 HG23 THR A 11 -8.777 3.559 12.970 1.00 0.00 H new ATOM 129 N VAL A 12 -7.254 2.827 10.438 1.00 0.00 N ATOM 130 CA VAL A 12 -7.408 1.840 9.376 1.00 0.00 C ATOM 131 C VAL A 12 -8.642 0.974 9.606 1.00 0.00 C ATOM 132 O VAL A 12 -8.686 0.171 10.539 1.00 0.00 O ATOM 133 CB VAL A 12 -6.169 0.931 9.270 1.00 0.00 C ATOM 134 CG1 VAL A 12 -6.411 -0.189 8.271 1.00 0.00 C ATOM 135 CG2 VAL A 12 -4.943 1.745 8.884 1.00 0.00 C ATOM 0 H VAL A 12 -7.140 2.429 11.370 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.524 2.393 8.444 1.00 0.00 H new ATOM 0 HB VAL A 12 -5.986 0.481 10.246 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.524 -0.820 8.210 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.262 -0.788 8.595 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -6.621 0.237 7.290 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -4.077 1.087 8.814 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.114 2.225 7.920 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -4.759 2.507 9.641 1.00 0.00 H new ATOM 145 N THR A 13 -9.643 1.140 8.747 1.00 0.00 N ATOM 146 CA THR A 13 -10.878 0.374 8.856 1.00 0.00 C ATOM 147 C THR A 13 -10.721 -1.013 8.245 1.00 0.00 C ATOM 148 O THR A 13 -10.471 -1.150 7.047 1.00 0.00 O ATOM 149 CB THR A 13 -12.050 1.097 8.166 1.00 0.00 C ATOM 150 OG1 THR A 13 -12.350 2.315 8.857 1.00 0.00 O ATOM 151 CG2 THR A 13 -13.286 0.211 8.128 1.00 0.00 C ATOM 0 H THR A 13 -9.622 1.798 7.968 1.00 0.00 H new ATOM 0 HA THR A 13 -11.096 0.276 9.919 1.00 0.00 H new ATOM 0 HB THR A 13 -11.755 1.325 7.142 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.095 2.769 8.411 1.00 0.00 H new ATOM 0 HG21 THR A 13 -14.100 0.743 7.636 1.00 0.00 H new ATOM 0 HG22 THR A 13 -13.063 -0.701 7.575 1.00 0.00 H new ATOM 0 HG23 THR A 13 -13.582 -0.044 9.145 1.00 0.00 H new ATOM 159 N HIS A 14 -10.869 -2.041 9.075 1.00 0.00 N ATOM 160 CA HIS A 14 -10.744 -3.419 8.615 1.00 0.00 C ATOM 161 C HIS A 14 -11.666 -4.342 9.407 1.00 0.00 C ATOM 162 O HIS A 14 -11.987 -4.070 10.564 1.00 0.00 O ATOM 163 CB HIS A 14 -9.296 -3.893 8.743 1.00 0.00 C ATOM 164 CG HIS A 14 -9.021 -5.179 8.027 1.00 0.00 C ATOM 165 ND1 HIS A 14 -8.985 -6.402 8.664 1.00 0.00 N ATOM 166 CD2 HIS A 14 -8.770 -5.429 6.721 1.00 0.00 C ATOM 167 CE1 HIS A 14 -8.722 -7.348 7.780 1.00 0.00 C ATOM 168 NE2 HIS A 14 -8.587 -6.784 6.594 1.00 0.00 N ATOM 0 H HIS A 14 -11.076 -1.945 10.069 1.00 0.00 H new ATOM 0 HA HIS A 14 -11.038 -3.454 7.566 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -8.634 -3.120 8.352 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -9.055 -4.016 9.799 1.00 0.00 H new ATOM 0 HD1 HIS A 14 -9.138 -6.552 9.661 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -8.722 -4.699 5.927 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -8.633 -8.403 7.992 1.00 0.00 H new ATOM 177 N SER A 15 -12.088 -5.433 8.776 1.00 0.00 N ATOM 178 CA SER A 15 -12.976 -6.393 9.421 1.00 0.00 C ATOM 179 C SER A 15 -14.142 -5.683 10.102 1.00 0.00 C ATOM 180 O SER A 15 -14.393 -5.879 11.290 1.00 0.00 O ATOM 181 CB SER A 15 -12.203 -7.227 10.445 1.00 0.00 C ATOM 182 OG SER A 15 -11.653 -8.388 9.846 1.00 0.00 O ATOM 0 H SER A 15 -11.829 -5.674 7.819 1.00 0.00 H new ATOM 0 HA SER A 15 -13.376 -7.054 8.652 1.00 0.00 H new ATOM 0 HB2 SER A 15 -11.405 -6.626 10.880 1.00 0.00 H new ATOM 0 HB3 SER A 15 -12.867 -7.514 11.260 1.00 0.00 H new ATOM 0 HG SER A 15 -11.163 -8.903 10.520 1.00 0.00 H new ATOM 188 N ASN A 16 -14.849 -4.856 9.340 1.00 0.00 N ATOM 189 CA ASN A 16 -15.989 -4.115 9.869 1.00 0.00 C ATOM 190 C ASN A 16 -15.611 -3.380 11.152 1.00 0.00 C ATOM 191 O ASN A 16 -16.463 -3.114 11.999 1.00 0.00 O ATOM 192 CB ASN A 16 -17.160 -5.062 10.136 1.00 0.00 C ATOM 193 CG ASN A 16 -18.472 -4.322 10.315 1.00 0.00 C ATOM 194 OD1 ASN A 16 -18.567 -3.127 10.036 1.00 0.00 O ATOM 195 ND2 ASN A 16 -19.492 -5.032 10.784 1.00 0.00 N ATOM 0 H ASN A 16 -14.653 -4.682 8.354 1.00 0.00 H new ATOM 0 HA ASN A 16 -16.290 -3.378 9.124 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.252 -5.764 9.308 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -16.952 -5.649 11.030 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -20.399 -4.589 10.926 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -19.368 -6.021 11.002 1.00 0.00 H new ATOM 202 N GLU A 17 -14.329 -3.055 11.286 1.00 0.00 N ATOM 203 CA GLU A 17 -13.840 -2.351 12.465 1.00 0.00 C ATOM 204 C GLU A 17 -12.753 -1.348 12.089 1.00 0.00 C ATOM 205 O GLU A 17 -12.454 -1.153 10.910 1.00 0.00 O ATOM 206 CB GLU A 17 -13.296 -3.347 13.492 1.00 0.00 C ATOM 207 CG GLU A 17 -14.381 -4.077 14.265 1.00 0.00 C ATOM 208 CD GLU A 17 -13.915 -4.532 15.635 1.00 0.00 C ATOM 209 OE1 GLU A 17 -13.861 -3.689 16.554 1.00 0.00 O ATOM 210 OE2 GLU A 17 -13.604 -5.733 15.787 1.00 0.00 O ATOM 0 H GLU A 17 -13.611 -3.268 10.593 1.00 0.00 H new ATOM 0 HA GLU A 17 -14.676 -1.807 12.904 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.671 -4.079 12.980 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -12.654 -2.817 14.196 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -15.245 -3.422 14.378 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -14.711 -4.943 13.691 1.00 0.00 H new ATOM 217 N LYS A 18 -12.165 -0.715 13.098 1.00 0.00 N ATOM 218 CA LYS A 18 -11.111 0.268 12.875 1.00 0.00 C ATOM 219 C LYS A 18 -9.953 0.052 13.844 1.00 0.00 C ATOM 220 O LYS A 18 -10.135 -0.488 14.935 1.00 0.00 O ATOM 221 CB LYS A 18 -11.665 1.686 13.035 1.00 0.00 C ATOM 222 CG LYS A 18 -12.518 1.869 14.278 1.00 0.00 C ATOM 223 CD LYS A 18 -12.418 3.286 14.818 1.00 0.00 C ATOM 224 CE LYS A 18 -11.330 3.405 15.874 1.00 0.00 C ATOM 225 NZ LYS A 18 -10.013 2.930 15.369 1.00 0.00 N ATOM 0 H LYS A 18 -12.400 -0.865 14.079 1.00 0.00 H new ATOM 0 HA LYS A 18 -10.740 0.142 11.858 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -10.834 2.390 13.068 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -12.260 1.936 12.156 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -13.558 1.640 14.044 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -12.201 1.163 15.045 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -12.209 3.974 13.999 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -13.376 3.582 15.246 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -11.244 4.444 16.191 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -11.612 2.826 16.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -9.249 3.440 15.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -9.919 1.910 15.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -9.949 3.107 14.346 1.00 0.00 H new ATOM 239 N HIS A 19 -8.761 0.478 13.438 1.00 0.00 N ATOM 240 CA HIS A 19 -7.572 0.332 14.271 1.00 0.00 C ATOM 241 C HIS A 19 -6.617 1.503 14.063 1.00 0.00 C ATOM 242 O HIS A 19 -6.070 1.685 12.975 1.00 0.00 O ATOM 243 CB HIS A 19 -6.861 -0.984 13.957 1.00 0.00 C ATOM 244 CG HIS A 19 -7.710 -2.195 14.193 1.00 0.00 C ATOM 245 ND1 HIS A 19 -7.985 -2.687 15.452 1.00 0.00 N ATOM 246 CD2 HIS A 19 -8.348 -3.013 13.324 1.00 0.00 C ATOM 247 CE1 HIS A 19 -8.754 -3.756 15.346 1.00 0.00 C ATOM 248 NE2 HIS A 19 -8.989 -3.975 14.065 1.00 0.00 N ATOM 0 H HIS A 19 -8.593 0.927 12.538 1.00 0.00 H new ATOM 0 HA HIS A 19 -7.888 0.324 15.314 1.00 0.00 H new ATOM 0 HB2 HIS A 19 -6.539 -0.974 12.916 1.00 0.00 H new ATOM 0 HB3 HIS A 19 -5.962 -1.056 14.568 1.00 0.00 H new ATOM 0 HD2 HIS A 19 -8.352 -2.925 12.248 1.00 0.00 H new ATOM 0 HE1 HIS A 19 -9.127 -4.350 16.167 1.00 0.00 H new ATOM 0 HE2 HIS A 19 -9.555 -4.735 13.687 1.00 0.00 H new ATOM 257 N ASP A 20 -6.420 2.294 15.112 1.00 0.00 N ATOM 258 CA ASP A 20 -5.530 3.447 15.045 1.00 0.00 C ATOM 259 C ASP A 20 -4.077 3.005 14.900 1.00 0.00 C ATOM 260 O ASP A 20 -3.565 2.242 15.720 1.00 0.00 O ATOM 261 CB ASP A 20 -5.690 4.315 16.294 1.00 0.00 C ATOM 262 CG ASP A 20 -5.221 3.611 17.552 1.00 0.00 C ATOM 263 OD1 ASP A 20 -5.426 2.384 17.656 1.00 0.00 O ATOM 264 OD2 ASP A 20 -4.650 4.288 18.433 1.00 0.00 O ATOM 0 H ASP A 20 -6.865 2.158 16.020 1.00 0.00 H new ATOM 0 HA ASP A 20 -5.801 4.034 14.167 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -5.125 5.238 16.166 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.737 4.595 16.407 1.00 0.00 H new ATOM 269 N LEU A 21 -3.419 3.487 13.852 1.00 0.00 N ATOM 270 CA LEU A 21 -2.025 3.141 13.598 1.00 0.00 C ATOM 271 C LEU A 21 -1.179 4.395 13.405 1.00 0.00 C ATOM 272 O LEU A 21 -1.646 5.394 12.857 1.00 0.00 O ATOM 273 CB LEU A 21 -1.918 2.244 12.364 1.00 0.00 C ATOM 274 CG LEU A 21 -2.884 1.060 12.308 1.00 0.00 C ATOM 275 CD1 LEU A 21 -2.851 0.408 10.935 1.00 0.00 C ATOM 276 CD2 LEU A 21 -2.546 0.045 13.391 1.00 0.00 C ATOM 0 H LEU A 21 -3.828 4.119 13.164 1.00 0.00 H new ATOM 0 HA LEU A 21 -1.647 2.600 14.466 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.077 2.859 11.478 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -0.900 1.859 12.307 1.00 0.00 H new ATOM 0 HG LEU A 21 -3.893 1.430 12.487 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -3.545 -0.432 10.915 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.142 1.137 10.179 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.843 0.051 10.726 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.243 -0.791 13.337 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -1.530 -0.320 13.243 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.623 0.518 14.370 1.00 0.00 H new ATOM 288 N HIS A 22 0.071 4.335 13.856 1.00 0.00 N ATOM 289 CA HIS A 22 0.984 5.466 13.729 1.00 0.00 C ATOM 290 C HIS A 22 2.008 5.216 12.627 1.00 0.00 C ATOM 291 O HIS A 22 2.998 4.513 12.833 1.00 0.00 O ATOM 292 CB HIS A 22 1.698 5.722 15.057 1.00 0.00 C ATOM 293 CG HIS A 22 2.947 6.537 14.917 1.00 0.00 C ATOM 294 ND1 HIS A 22 4.024 6.414 15.769 1.00 0.00 N ATOM 295 CD2 HIS A 22 3.287 7.488 14.017 1.00 0.00 C ATOM 296 CE1 HIS A 22 4.973 7.256 15.400 1.00 0.00 C ATOM 297 NE2 HIS A 22 4.551 7.919 14.338 1.00 0.00 N ATOM 0 H HIS A 22 0.474 3.516 14.312 1.00 0.00 H new ATOM 0 HA HIS A 22 0.399 6.347 13.463 1.00 0.00 H new ATOM 0 HB2 HIS A 22 1.015 6.233 15.735 1.00 0.00 H new ATOM 0 HB3 HIS A 22 1.947 4.766 15.517 1.00 0.00 H new ATOM 0 HD1 HIS A 22 4.079 5.773 16.561 1.00 0.00 H new ATOM 0 HD2 HIS A 22 2.678 7.842 13.199 1.00 0.00 H new ATOM 0 HE1 HIS A 22 5.930 7.381 15.884 1.00 0.00 H new ATOM 306 N VAL A 23 1.764 5.795 11.456 1.00 0.00 N ATOM 307 CA VAL A 23 2.665 5.635 10.321 1.00 0.00 C ATOM 308 C VAL A 23 4.026 6.259 10.608 1.00 0.00 C ATOM 309 O VAL A 23 4.116 7.338 11.195 1.00 0.00 O ATOM 310 CB VAL A 23 2.080 6.271 9.046 1.00 0.00 C ATOM 311 CG1 VAL A 23 2.875 5.841 7.822 1.00 0.00 C ATOM 312 CG2 VAL A 23 0.612 5.904 8.894 1.00 0.00 C ATOM 0 H VAL A 23 0.949 6.379 11.268 1.00 0.00 H new ATOM 0 HA VAL A 23 2.786 4.564 10.161 1.00 0.00 H new ATOM 0 HB VAL A 23 2.153 7.355 9.135 1.00 0.00 H new ATOM 0 HG11 VAL A 23 2.447 6.300 6.931 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.912 6.159 7.932 1.00 0.00 H new ATOM 0 HG13 VAL A 23 2.836 4.756 7.726 1.00 0.00 H new ATOM 0 HG21 VAL A 23 0.214 6.362 7.988 1.00 0.00 H new ATOM 0 HG22 VAL A 23 0.513 4.821 8.827 1.00 0.00 H new ATOM 0 HG23 VAL A 23 0.055 6.266 9.758 1.00 0.00 H new ATOM 322 N THR A 24 5.086 5.573 10.191 1.00 0.00 N ATOM 323 CA THR A 24 6.443 6.059 10.403 1.00 0.00 C ATOM 324 C THR A 24 7.372 5.603 9.284 1.00 0.00 C ATOM 325 O THR A 24 7.286 4.467 8.818 1.00 0.00 O ATOM 326 CB THR A 24 7.008 5.577 11.753 1.00 0.00 C ATOM 327 OG1 THR A 24 6.833 4.162 11.879 1.00 0.00 O ATOM 328 CG2 THR A 24 6.319 6.283 12.911 1.00 0.00 C ATOM 0 H THR A 24 5.030 4.678 9.704 1.00 0.00 H new ATOM 0 HA THR A 24 6.391 7.148 10.407 1.00 0.00 H new ATOM 0 HB THR A 24 8.071 5.816 11.783 1.00 0.00 H new ATOM 0 HG1 THR A 24 7.196 3.863 12.739 1.00 0.00 H new ATOM 0 HG21 THR A 24 6.734 5.926 13.854 1.00 0.00 H new ATOM 0 HG22 THR A 24 6.478 7.358 12.828 1.00 0.00 H new ATOM 0 HG23 THR A 24 5.250 6.071 12.882 1.00 0.00 H new ATOM 336 N SER A 25 8.261 6.494 8.858 1.00 0.00 N ATOM 337 CA SER A 25 9.205 6.183 7.791 1.00 0.00 C ATOM 338 C SER A 25 10.121 5.032 8.195 1.00 0.00 C ATOM 339 O SER A 25 10.064 4.547 9.324 1.00 0.00 O ATOM 340 CB SER A 25 10.041 7.417 7.445 1.00 0.00 C ATOM 341 OG SER A 25 10.864 7.798 8.534 1.00 0.00 O ATOM 0 H SER A 25 8.348 7.438 9.236 1.00 0.00 H new ATOM 0 HA SER A 25 8.635 5.881 6.912 1.00 0.00 H new ATOM 0 HB2 SER A 25 10.661 7.207 6.573 1.00 0.00 H new ATOM 0 HB3 SER A 25 9.382 8.243 7.177 1.00 0.00 H new ATOM 0 HG SER A 25 11.389 8.588 8.287 1.00 0.00 H new ATOM 347 N GLN A 26 10.964 4.600 7.262 1.00 0.00 N ATOM 348 CA GLN A 26 11.892 3.505 7.520 1.00 0.00 C ATOM 349 C GLN A 26 13.283 4.036 7.847 1.00 0.00 C ATOM 350 O GLN A 26 14.288 3.499 7.381 1.00 0.00 O ATOM 351 CB GLN A 26 11.960 2.571 6.311 1.00 0.00 C ATOM 352 CG GLN A 26 10.666 1.819 6.049 1.00 0.00 C ATOM 353 CD GLN A 26 10.488 0.626 6.967 1.00 0.00 C ATOM 354 OE1 GLN A 26 11.187 -0.380 6.840 1.00 0.00 O ATOM 355 NE2 GLN A 26 9.549 0.732 7.901 1.00 0.00 N ATOM 0 H GLN A 26 11.023 4.991 6.322 1.00 0.00 H new ATOM 0 HA GLN A 26 11.525 2.946 8.381 1.00 0.00 H new ATOM 0 HB2 GLN A 26 12.217 3.154 5.426 1.00 0.00 H new ATOM 0 HB3 GLN A 26 12.764 1.851 6.463 1.00 0.00 H new ATOM 0 HG2 GLN A 26 9.823 2.499 6.175 1.00 0.00 H new ATOM 0 HG3 GLN A 26 10.650 1.481 5.013 1.00 0.00 H new ATOM 0 HE21 GLN A 26 8.993 1.584 7.971 1.00 0.00 H new ATOM 0 HE22 GLN A 26 9.384 -0.039 8.549 1.00 0.00 H new ATOM 364 N GLN A 27 13.334 5.094 8.650 1.00 0.00 N ATOM 365 CA GLN A 27 14.603 5.698 9.038 1.00 0.00 C ATOM 366 C GLN A 27 15.519 5.864 7.829 1.00 0.00 C ATOM 367 O GLN A 27 16.719 5.606 7.907 1.00 0.00 O ATOM 368 CB GLN A 27 15.294 4.844 10.103 1.00 0.00 C ATOM 369 CG GLN A 27 16.167 5.647 11.054 1.00 0.00 C ATOM 370 CD GLN A 27 17.295 4.825 11.646 1.00 0.00 C ATOM 371 OE1 GLN A 27 17.214 3.598 11.716 1.00 0.00 O ATOM 372 NE2 GLN A 27 18.356 5.498 12.076 1.00 0.00 N ATOM 0 H GLN A 27 12.511 5.550 9.044 1.00 0.00 H new ATOM 0 HA GLN A 27 14.396 6.685 9.452 1.00 0.00 H new ATOM 0 HB2 GLN A 27 14.536 4.313 10.679 1.00 0.00 H new ATOM 0 HB3 GLN A 27 15.907 4.089 9.610 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.586 6.502 10.523 1.00 0.00 H new ATOM 0 HG3 GLN A 27 15.550 6.044 11.860 1.00 0.00 H new ATOM 0 HE21 GLN A 27 18.381 6.515 11.998 1.00 0.00 H new ATOM 0 HE22 GLN A 27 19.146 4.998 12.484 1.00 0.00 H new ATOM 381 N GLY A 28 14.943 6.298 6.712 1.00 0.00 N ATOM 382 CA GLY A 28 15.722 6.490 5.503 1.00 0.00 C ATOM 383 C GLY A 28 14.939 7.202 4.417 1.00 0.00 C ATOM 384 O GLY A 28 15.005 6.825 3.247 1.00 0.00 O ATOM 0 H GLY A 28 13.951 6.520 6.623 1.00 0.00 H new ATOM 0 HA2 GLY A 28 16.617 7.066 5.739 1.00 0.00 H new ATOM 0 HA3 GLY A 28 16.055 5.521 5.131 1.00 0.00 H new ATOM 388 N SER A 29 14.196 8.233 4.804 1.00 0.00 N ATOM 389 CA SER A 29 13.393 8.996 3.855 1.00 0.00 C ATOM 390 C SER A 29 12.842 10.262 4.504 1.00 0.00 C ATOM 391 O SER A 29 12.160 10.203 5.527 1.00 0.00 O ATOM 392 CB SER A 29 12.241 8.139 3.325 1.00 0.00 C ATOM 393 OG SER A 29 12.641 7.398 2.185 1.00 0.00 O ATOM 0 H SER A 29 14.133 8.560 5.768 1.00 0.00 H new ATOM 0 HA SER A 29 14.035 9.285 3.023 1.00 0.00 H new ATOM 0 HB2 SER A 29 11.901 7.458 4.105 1.00 0.00 H new ATOM 0 HB3 SER A 29 11.396 8.778 3.069 1.00 0.00 H new ATOM 0 HG SER A 29 13.489 6.944 2.371 1.00 0.00 H new ATOM 399 N SER A 30 13.145 11.408 3.901 1.00 0.00 N ATOM 400 CA SER A 30 12.684 12.690 4.421 1.00 0.00 C ATOM 401 C SER A 30 11.269 12.573 4.980 1.00 0.00 C ATOM 402 O SER A 30 10.978 13.068 6.068 1.00 0.00 O ATOM 403 CB SER A 30 12.725 13.754 3.323 1.00 0.00 C ATOM 404 OG SER A 30 12.814 15.055 3.877 1.00 0.00 O ATOM 0 H SER A 30 13.707 11.474 3.053 1.00 0.00 H new ATOM 0 HA SER A 30 13.351 12.987 5.230 1.00 0.00 H new ATOM 0 HB2 SER A 30 13.579 13.574 2.670 1.00 0.00 H new ATOM 0 HB3 SER A 30 11.830 13.679 2.706 1.00 0.00 H new ATOM 0 HG SER A 30 12.840 15.717 3.155 1.00 0.00 H new ATOM 410 N GLU A 31 10.395 11.915 4.226 1.00 0.00 N ATOM 411 CA GLU A 31 9.010 11.733 4.645 1.00 0.00 C ATOM 412 C GLU A 31 8.519 10.329 4.307 1.00 0.00 C ATOM 413 O GLU A 31 8.981 9.693 3.359 1.00 0.00 O ATOM 414 CB GLU A 31 8.111 12.775 3.975 1.00 0.00 C ATOM 415 CG GLU A 31 8.186 12.759 2.458 1.00 0.00 C ATOM 416 CD GLU A 31 7.617 14.017 1.832 1.00 0.00 C ATOM 417 OE1 GLU A 31 8.061 15.122 2.210 1.00 0.00 O ATOM 418 OE2 GLU A 31 6.728 13.897 0.963 1.00 0.00 O ATOM 0 H GLU A 31 10.621 11.499 3.322 1.00 0.00 H new ATOM 0 HA GLU A 31 8.964 11.864 5.726 1.00 0.00 H new ATOM 0 HB2 GLU A 31 7.079 12.603 4.281 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.389 13.766 4.334 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.225 12.643 2.151 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.643 11.892 2.080 1.00 0.00 H new ATOM 425 N PRO A 32 7.559 9.831 5.100 1.00 0.00 N ATOM 426 CA PRO A 32 6.983 8.497 4.906 1.00 0.00 C ATOM 427 C PRO A 32 6.123 8.414 3.649 1.00 0.00 C ATOM 428 O PRO A 32 5.625 9.427 3.158 1.00 0.00 O ATOM 429 CB PRO A 32 6.124 8.296 6.156 1.00 0.00 C ATOM 430 CG PRO A 32 5.779 9.674 6.605 1.00 0.00 C ATOM 431 CD PRO A 32 6.961 10.533 6.249 1.00 0.00 C ATOM 0 HA PRO A 32 7.752 7.736 4.774 1.00 0.00 H new ATOM 0 HB2 PRO A 32 5.228 7.717 5.932 1.00 0.00 H new ATOM 0 HB3 PRO A 32 6.669 7.753 6.928 1.00 0.00 H new ATOM 0 HG2 PRO A 32 4.875 10.030 6.112 1.00 0.00 H new ATOM 0 HG3 PRO A 32 5.588 9.699 7.678 1.00 0.00 H new ATOM 0 HD2 PRO A 32 6.657 11.546 5.987 1.00 0.00 H new ATOM 0 HD3 PRO A 32 7.663 10.615 7.079 1.00 0.00 H new ATOM 439 N VAL A 33 5.953 7.201 3.134 1.00 0.00 N ATOM 440 CA VAL A 33 5.151 6.986 1.935 1.00 0.00 C ATOM 441 C VAL A 33 4.178 5.827 2.125 1.00 0.00 C ATOM 442 O VAL A 33 4.163 5.180 3.172 1.00 0.00 O ATOM 443 CB VAL A 33 6.040 6.700 0.710 1.00 0.00 C ATOM 444 CG1 VAL A 33 7.014 7.845 0.477 1.00 0.00 C ATOM 445 CG2 VAL A 33 6.784 5.385 0.887 1.00 0.00 C ATOM 0 H VAL A 33 6.359 6.352 3.528 1.00 0.00 H new ATOM 0 HA VAL A 33 4.589 7.903 1.761 1.00 0.00 H new ATOM 0 HB VAL A 33 5.400 6.614 -0.168 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.633 7.625 -0.392 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.458 8.766 0.302 1.00 0.00 H new ATOM 0 HG13 VAL A 33 7.650 7.966 1.354 1.00 0.00 H new ATOM 0 HG21 VAL A 33 7.407 5.199 0.012 1.00 0.00 H new ATOM 0 HG22 VAL A 33 7.413 5.440 1.776 1.00 0.00 H new ATOM 0 HG23 VAL A 33 6.066 4.573 1.000 1.00 0.00 H new ATOM 455 N VAL A 34 3.366 5.571 1.104 1.00 0.00 N ATOM 456 CA VAL A 34 2.390 4.489 1.157 1.00 0.00 C ATOM 457 C VAL A 34 3.041 3.183 1.601 1.00 0.00 C ATOM 458 O VAL A 34 2.432 2.387 2.316 1.00 0.00 O ATOM 459 CB VAL A 34 1.715 4.274 -0.210 1.00 0.00 C ATOM 460 CG1 VAL A 34 0.874 3.007 -0.198 1.00 0.00 C ATOM 461 CG2 VAL A 34 0.868 5.483 -0.581 1.00 0.00 C ATOM 0 H VAL A 34 3.365 6.098 0.231 1.00 0.00 H new ATOM 0 HA VAL A 34 1.633 4.781 1.885 1.00 0.00 H new ATOM 0 HB VAL A 34 2.492 4.157 -0.965 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.405 2.872 -1.173 1.00 0.00 H new ATOM 0 HG12 VAL A 34 1.511 2.150 0.020 1.00 0.00 H new ATOM 0 HG13 VAL A 34 0.102 3.090 0.567 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.398 5.314 -1.550 1.00 0.00 H new ATOM 0 HG22 VAL A 34 0.097 5.633 0.175 1.00 0.00 H new ATOM 0 HG23 VAL A 34 1.501 6.369 -0.634 1.00 0.00 H new ATOM 471 N GLN A 35 4.281 2.971 1.172 1.00 0.00 N ATOM 472 CA GLN A 35 5.014 1.761 1.525 1.00 0.00 C ATOM 473 C GLN A 35 4.953 1.507 3.028 1.00 0.00 C ATOM 474 O GLN A 35 4.656 0.396 3.468 1.00 0.00 O ATOM 475 CB GLN A 35 6.471 1.871 1.073 1.00 0.00 C ATOM 476 CG GLN A 35 7.291 0.622 1.351 1.00 0.00 C ATOM 477 CD GLN A 35 6.635 -0.637 0.818 1.00 0.00 C ATOM 478 OE1 GLN A 35 6.434 -0.783 -0.388 1.00 0.00 O ATOM 479 NE2 GLN A 35 6.298 -1.555 1.716 1.00 0.00 N ATOM 0 H GLN A 35 4.799 3.621 0.580 1.00 0.00 H new ATOM 0 HA GLN A 35 4.545 0.920 1.013 1.00 0.00 H new ATOM 0 HB2 GLN A 35 6.496 2.081 0.004 1.00 0.00 H new ATOM 0 HB3 GLN A 35 6.935 2.720 1.576 1.00 0.00 H new ATOM 0 HG2 GLN A 35 8.277 0.732 0.901 1.00 0.00 H new ATOM 0 HG3 GLN A 35 7.441 0.522 2.426 1.00 0.00 H new ATOM 0 HE21 GLN A 35 6.483 -1.392 2.706 1.00 0.00 H new ATOM 0 HE22 GLN A 35 5.854 -2.423 1.416 1.00 0.00 H new ATOM 488 N ASP A 36 5.237 2.543 3.809 1.00 0.00 N ATOM 489 CA ASP A 36 5.215 2.432 5.263 1.00 0.00 C ATOM 490 C ASP A 36 3.816 2.082 5.760 1.00 0.00 C ATOM 491 O ASP A 36 3.656 1.285 6.685 1.00 0.00 O ATOM 492 CB ASP A 36 5.684 3.740 5.903 1.00 0.00 C ATOM 493 CG ASP A 36 6.934 4.290 5.246 1.00 0.00 C ATOM 494 OD1 ASP A 36 7.850 3.493 4.953 1.00 0.00 O ATOM 495 OD2 ASP A 36 6.998 5.518 5.025 1.00 0.00 O ATOM 0 H ASP A 36 5.485 3.469 3.460 1.00 0.00 H new ATOM 0 HA ASP A 36 5.895 1.631 5.552 1.00 0.00 H new ATOM 0 HB2 ASP A 36 4.886 4.480 5.837 1.00 0.00 H new ATOM 0 HB3 ASP A 36 5.877 3.574 6.963 1.00 0.00 H new ATOM 500 N LEU A 37 2.806 2.683 5.141 1.00 0.00 N ATOM 501 CA LEU A 37 1.419 2.435 5.520 1.00 0.00 C ATOM 502 C LEU A 37 1.084 0.950 5.421 1.00 0.00 C ATOM 503 O LEU A 37 0.586 0.351 6.373 1.00 0.00 O ATOM 504 CB LEU A 37 0.474 3.244 4.630 1.00 0.00 C ATOM 505 CG LEU A 37 -0.970 2.747 4.559 1.00 0.00 C ATOM 506 CD1 LEU A 37 -1.621 2.798 5.933 1.00 0.00 C ATOM 507 CD2 LEU A 37 -1.769 3.569 3.558 1.00 0.00 C ATOM 0 H LEU A 37 2.921 3.346 4.374 1.00 0.00 H new ATOM 0 HA LEU A 37 1.290 2.749 6.556 1.00 0.00 H new ATOM 0 HB2 LEU A 37 0.466 4.274 4.985 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.882 3.259 3.619 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.960 1.710 4.222 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.648 2.441 5.862 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.063 2.165 6.624 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.619 3.825 6.299 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.794 3.201 3.521 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.770 4.615 3.864 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -1.316 3.481 2.571 1.00 0.00 H new ATOM 519 N ALA A 38 1.364 0.362 4.262 1.00 0.00 N ATOM 520 CA ALA A 38 1.096 -1.053 4.040 1.00 0.00 C ATOM 521 C ALA A 38 1.765 -1.912 5.108 1.00 0.00 C ATOM 522 O ALA A 38 1.188 -2.892 5.578 1.00 0.00 O ATOM 523 CB ALA A 38 1.568 -1.468 2.654 1.00 0.00 C ATOM 0 H ALA A 38 1.776 0.844 3.463 1.00 0.00 H new ATOM 0 HA ALA A 38 0.019 -1.209 4.107 1.00 0.00 H new ATOM 0 HB1 ALA A 38 1.362 -2.527 2.501 1.00 0.00 H new ATOM 0 HB2 ALA A 38 1.041 -0.883 1.900 1.00 0.00 H new ATOM 0 HB3 ALA A 38 2.640 -1.291 2.567 1.00 0.00 H new ATOM 529 N GLN A 39 2.983 -1.539 5.484 1.00 0.00 N ATOM 530 CA GLN A 39 3.730 -2.278 6.495 1.00 0.00 C ATOM 531 C GLN A 39 3.084 -2.124 7.868 1.00 0.00 C ATOM 532 O GLN A 39 2.904 -3.103 8.594 1.00 0.00 O ATOM 533 CB GLN A 39 5.180 -1.794 6.544 1.00 0.00 C ATOM 534 CG GLN A 39 6.089 -2.497 5.548 1.00 0.00 C ATOM 535 CD GLN A 39 6.627 -3.812 6.077 1.00 0.00 C ATOM 536 OE1 GLN A 39 7.755 -3.883 6.566 1.00 0.00 O ATOM 537 NE2 GLN A 39 5.821 -4.863 5.982 1.00 0.00 N ATOM 0 H GLN A 39 3.474 -0.730 5.104 1.00 0.00 H new ATOM 0 HA GLN A 39 3.716 -3.333 6.222 1.00 0.00 H new ATOM 0 HB2 GLN A 39 5.203 -0.722 6.351 1.00 0.00 H new ATOM 0 HB3 GLN A 39 5.571 -1.945 7.550 1.00 0.00 H new ATOM 0 HG2 GLN A 39 5.539 -2.679 4.625 1.00 0.00 H new ATOM 0 HG3 GLN A 39 6.923 -1.842 5.298 1.00 0.00 H new ATOM 0 HE21 GLN A 39 4.894 -4.759 5.570 1.00 0.00 H new ATOM 0 HE22 GLN A 39 6.129 -5.774 6.321 1.00 0.00 H new ATOM 546 N VAL A 40 2.738 -0.890 8.220 1.00 0.00 N ATOM 547 CA VAL A 40 2.112 -0.608 9.506 1.00 0.00 C ATOM 548 C VAL A 40 0.900 -1.504 9.735 1.00 0.00 C ATOM 549 O VAL A 40 0.644 -1.946 10.855 1.00 0.00 O ATOM 550 CB VAL A 40 1.674 0.865 9.606 1.00 0.00 C ATOM 551 CG1 VAL A 40 0.864 1.096 10.873 1.00 0.00 C ATOM 552 CG2 VAL A 40 2.885 1.784 9.563 1.00 0.00 C ATOM 0 H VAL A 40 2.881 -0.069 7.632 1.00 0.00 H new ATOM 0 HA VAL A 40 2.860 -0.810 10.273 1.00 0.00 H new ATOM 0 HB VAL A 40 1.040 1.097 8.750 1.00 0.00 H new ATOM 0 HG11 VAL A 40 0.563 2.142 10.927 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.024 0.463 10.858 1.00 0.00 H new ATOM 0 HG13 VAL A 40 1.471 0.848 11.743 1.00 0.00 H new ATOM 0 HG21 VAL A 40 2.557 2.821 9.635 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.546 1.554 10.398 1.00 0.00 H new ATOM 0 HG23 VAL A 40 3.420 1.637 8.625 1.00 0.00 H new ATOM 562 N VAL A 41 0.157 -1.770 8.665 1.00 0.00 N ATOM 563 CA VAL A 41 -1.029 -2.615 8.749 1.00 0.00 C ATOM 564 C VAL A 41 -0.649 -4.070 9.002 1.00 0.00 C ATOM 565 O VAL A 41 -1.085 -4.673 9.982 1.00 0.00 O ATOM 566 CB VAL A 41 -1.869 -2.532 7.461 1.00 0.00 C ATOM 567 CG1 VAL A 41 -3.072 -3.458 7.547 1.00 0.00 C ATOM 568 CG2 VAL A 41 -2.308 -1.098 7.203 1.00 0.00 C ATOM 0 H VAL A 41 0.355 -1.413 7.730 1.00 0.00 H new ATOM 0 HA VAL A 41 -1.623 -2.246 9.585 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.251 -2.855 6.624 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -3.653 -3.386 6.628 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -2.732 -4.485 7.681 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.694 -3.168 8.394 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.901 -1.058 6.289 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -2.909 -0.745 8.041 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -1.429 -0.462 7.094 1.00 0.00 H new ATOM 578 N GLU A 42 0.166 -4.626 8.112 1.00 0.00 N ATOM 579 CA GLU A 42 0.604 -6.012 8.239 1.00 0.00 C ATOM 580 C GLU A 42 1.460 -6.199 9.488 1.00 0.00 C ATOM 581 O GLU A 42 1.613 -7.313 9.986 1.00 0.00 O ATOM 582 CB GLU A 42 1.392 -6.437 6.999 1.00 0.00 C ATOM 583 CG GLU A 42 1.770 -7.909 6.993 1.00 0.00 C ATOM 584 CD GLU A 42 2.889 -8.220 6.018 1.00 0.00 C ATOM 585 OE1 GLU A 42 2.820 -7.742 4.866 1.00 0.00 O ATOM 586 OE2 GLU A 42 3.832 -8.940 6.406 1.00 0.00 O ATOM 0 H GLU A 42 0.536 -4.139 7.296 1.00 0.00 H new ATOM 0 HA GLU A 42 -0.283 -6.640 8.329 1.00 0.00 H new ATOM 0 HB2 GLU A 42 0.800 -6.219 6.110 1.00 0.00 H new ATOM 0 HB3 GLU A 42 2.300 -5.837 6.932 1.00 0.00 H new ATOM 0 HG2 GLU A 42 2.075 -8.206 7.997 1.00 0.00 H new ATOM 0 HG3 GLU A 42 0.894 -8.504 6.736 1.00 0.00 H new ATOM 593 N GLU A 43 2.015 -5.099 9.988 1.00 0.00 N ATOM 594 CA GLU A 43 2.857 -5.143 11.178 1.00 0.00 C ATOM 595 C GLU A 43 2.017 -5.007 12.445 1.00 0.00 C ATOM 596 O GLU A 43 2.239 -5.711 13.430 1.00 0.00 O ATOM 597 CB GLU A 43 3.907 -4.031 11.128 1.00 0.00 C ATOM 598 CG GLU A 43 5.060 -4.325 10.183 1.00 0.00 C ATOM 599 CD GLU A 43 5.870 -5.534 10.609 1.00 0.00 C ATOM 600 OE1 GLU A 43 5.915 -5.819 11.824 1.00 0.00 O ATOM 601 OE2 GLU A 43 6.457 -6.196 9.728 1.00 0.00 O ATOM 0 H GLU A 43 1.897 -4.168 9.588 1.00 0.00 H new ATOM 0 HA GLU A 43 3.361 -6.109 11.199 1.00 0.00 H new ATOM 0 HB2 GLU A 43 3.426 -3.102 10.823 1.00 0.00 H new ATOM 0 HB3 GLU A 43 4.302 -3.871 12.131 1.00 0.00 H new ATOM 0 HG2 GLU A 43 4.669 -4.490 9.179 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.714 -3.454 10.131 1.00 0.00 H new ATOM 608 N VAL A 44 1.050 -4.095 12.411 1.00 0.00 N ATOM 609 CA VAL A 44 0.175 -3.866 13.555 1.00 0.00 C ATOM 610 C VAL A 44 -1.037 -4.790 13.514 1.00 0.00 C ATOM 611 O VAL A 44 -1.234 -5.611 14.411 1.00 0.00 O ATOM 612 CB VAL A 44 -0.309 -2.405 13.607 1.00 0.00 C ATOM 613 CG1 VAL A 44 -1.305 -2.212 14.741 1.00 0.00 C ATOM 614 CG2 VAL A 44 0.872 -1.458 13.757 1.00 0.00 C ATOM 0 H VAL A 44 0.853 -3.503 11.604 1.00 0.00 H new ATOM 0 HA VAL A 44 0.761 -4.079 14.449 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.814 -2.174 12.669 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.636 -1.174 14.762 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.165 -2.864 14.585 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.829 -2.460 15.690 1.00 0.00 H new ATOM 0 HG21 VAL A 44 0.512 -0.430 13.792 1.00 0.00 H new ATOM 0 HG22 VAL A 44 1.407 -1.687 14.679 1.00 0.00 H new ATOM 0 HG23 VAL A 44 1.545 -1.578 12.908 1.00 0.00 H new ATOM 624 N ILE A 45 -1.844 -4.652 12.468 1.00 0.00 N ATOM 625 CA ILE A 45 -3.036 -5.476 12.309 1.00 0.00 C ATOM 626 C ILE A 45 -2.672 -6.952 12.189 1.00 0.00 C ATOM 627 O ILE A 45 -3.148 -7.785 12.960 1.00 0.00 O ATOM 628 CB ILE A 45 -3.849 -5.058 11.070 1.00 0.00 C ATOM 629 CG1 ILE A 45 -4.233 -3.579 11.161 1.00 0.00 C ATOM 630 CG2 ILE A 45 -5.091 -5.925 10.934 1.00 0.00 C ATOM 631 CD1 ILE A 45 -5.059 -3.096 9.989 1.00 0.00 C ATOM 0 H ILE A 45 -1.694 -3.977 11.718 1.00 0.00 H new ATOM 0 HA ILE A 45 -3.644 -5.325 13.201 1.00 0.00 H new ATOM 0 HB ILE A 45 -3.231 -5.201 10.183 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.792 -3.413 12.082 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.325 -2.980 11.227 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -5.655 -5.617 10.054 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.796 -6.969 10.829 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.713 -5.811 11.822 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.294 -2.040 10.120 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -4.494 -3.230 9.066 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.984 -3.670 9.935 1.00 0.00 H new ATOM 643 N GLY A 46 -1.821 -7.269 11.217 1.00 0.00 N ATOM 644 CA GLY A 46 -1.406 -8.645 11.015 1.00 0.00 C ATOM 645 C GLY A 46 -1.893 -9.210 9.696 1.00 0.00 C ATOM 646 O GLY A 46 -1.975 -10.426 9.525 1.00 0.00 O ATOM 0 H GLY A 46 -1.412 -6.598 10.567 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -0.318 -8.702 11.052 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -1.785 -9.259 11.832 1.00 0.00 H new ATOM 650 N VAL A 47 -2.218 -8.325 8.759 1.00 0.00 N ATOM 651 CA VAL A 47 -2.701 -8.742 7.448 1.00 0.00 C ATOM 652 C VAL A 47 -1.675 -8.435 6.362 1.00 0.00 C ATOM 653 O VAL A 47 -1.163 -7.320 6.255 1.00 0.00 O ATOM 654 CB VAL A 47 -4.031 -8.050 7.093 1.00 0.00 C ATOM 655 CG1 VAL A 47 -4.550 -8.547 5.752 1.00 0.00 C ATOM 656 CG2 VAL A 47 -5.059 -8.279 8.190 1.00 0.00 C ATOM 0 H VAL A 47 -2.156 -7.315 8.884 1.00 0.00 H new ATOM 0 HA VAL A 47 -2.863 -9.819 7.498 1.00 0.00 H new ATOM 0 HB VAL A 47 -3.853 -6.978 7.012 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -5.490 -8.047 5.518 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -3.818 -8.327 4.975 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.714 -9.623 5.802 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -5.992 -7.783 7.923 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.236 -9.348 8.305 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -4.686 -7.870 9.129 1.00 0.00 H new ATOM 666 N PRO A 48 -1.368 -9.445 5.536 1.00 0.00 N ATOM 667 CA PRO A 48 -0.402 -9.308 4.442 1.00 0.00 C ATOM 668 C PRO A 48 -0.921 -8.418 3.318 1.00 0.00 C ATOM 669 O PRO A 48 -2.123 -8.371 3.057 1.00 0.00 O ATOM 670 CB PRO A 48 -0.221 -10.744 3.946 1.00 0.00 C ATOM 671 CG PRO A 48 -1.485 -11.437 4.321 1.00 0.00 C ATOM 672 CD PRO A 48 -1.940 -10.800 5.605 1.00 0.00 C ATOM 0 HA PRO A 48 0.524 -8.837 4.773 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -0.058 -10.773 2.869 1.00 0.00 H new ATOM 0 HB3 PRO A 48 0.643 -11.218 4.412 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.238 -11.325 3.541 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -1.320 -12.506 4.453 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -3.027 -10.774 5.677 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -1.576 -11.346 6.475 1.00 0.00 H new ATOM 680 N GLN A 49 -0.008 -7.713 2.657 1.00 0.00 N ATOM 681 CA GLN A 49 -0.376 -6.824 1.561 1.00 0.00 C ATOM 682 C GLN A 49 -1.117 -7.586 0.467 1.00 0.00 C ATOM 683 O GLN A 49 -1.705 -6.986 -0.432 1.00 0.00 O ATOM 684 CB GLN A 49 0.870 -6.155 0.979 1.00 0.00 C ATOM 685 CG GLN A 49 1.666 -5.358 2.000 1.00 0.00 C ATOM 686 CD GLN A 49 2.881 -4.683 1.395 1.00 0.00 C ATOM 687 OE1 GLN A 49 2.968 -4.510 0.179 1.00 0.00 O ATOM 688 NE2 GLN A 49 3.828 -4.297 2.243 1.00 0.00 N ATOM 0 H GLN A 49 0.991 -7.740 2.861 1.00 0.00 H new ATOM 0 HA GLN A 49 -1.041 -6.056 1.957 1.00 0.00 H new ATOM 0 HB2 GLN A 49 1.514 -6.920 0.546 1.00 0.00 H new ATOM 0 HB3 GLN A 49 0.571 -5.493 0.167 1.00 0.00 H new ATOM 0 HG2 GLN A 49 1.021 -4.602 2.448 1.00 0.00 H new ATOM 0 HG3 GLN A 49 1.986 -6.021 2.804 1.00 0.00 H new ATOM 0 HE21 GLN A 49 3.714 -4.460 3.243 1.00 0.00 H new ATOM 0 HE22 GLN A 49 4.669 -3.837 1.894 1.00 0.00 H new ATOM 697 N SER A 50 -1.083 -8.912 0.550 1.00 0.00 N ATOM 698 CA SER A 50 -1.748 -9.757 -0.435 1.00 0.00 C ATOM 699 C SER A 50 -3.199 -10.015 -0.040 1.00 0.00 C ATOM 700 O SER A 50 -4.025 -10.386 -0.874 1.00 0.00 O ATOM 701 CB SER A 50 -1.004 -11.086 -0.584 1.00 0.00 C ATOM 702 OG SER A 50 -1.662 -11.938 -1.506 1.00 0.00 O ATOM 0 H SER A 50 -0.602 -9.424 1.289 1.00 0.00 H new ATOM 0 HA SER A 50 -1.738 -9.234 -1.391 1.00 0.00 H new ATOM 0 HB2 SER A 50 0.016 -10.900 -0.920 1.00 0.00 H new ATOM 0 HB3 SER A 50 -0.935 -11.579 0.386 1.00 0.00 H new ATOM 0 HG SER A 50 -1.166 -12.780 -1.585 1.00 0.00 H new ATOM 708 N PHE A 51 -3.501 -9.815 1.239 1.00 0.00 N ATOM 709 CA PHE A 51 -4.852 -10.026 1.747 1.00 0.00 C ATOM 710 C PHE A 51 -5.535 -8.695 2.045 1.00 0.00 C ATOM 711 O PHE A 51 -6.756 -8.576 1.940 1.00 0.00 O ATOM 712 CB PHE A 51 -4.815 -10.887 3.011 1.00 0.00 C ATOM 713 CG PHE A 51 -4.503 -12.332 2.743 1.00 0.00 C ATOM 714 CD1 PHE A 51 -3.404 -12.687 1.977 1.00 0.00 C ATOM 715 CD2 PHE A 51 -5.308 -13.335 3.257 1.00 0.00 C ATOM 716 CE1 PHE A 51 -3.114 -14.015 1.729 1.00 0.00 C ATOM 717 CE2 PHE A 51 -5.023 -14.665 3.013 1.00 0.00 C ATOM 718 CZ PHE A 51 -3.925 -15.006 2.247 1.00 0.00 C ATOM 0 H PHE A 51 -2.829 -9.507 1.942 1.00 0.00 H new ATOM 0 HA PHE A 51 -5.426 -10.545 0.979 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -4.068 -10.483 3.694 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -5.779 -10.819 3.516 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -2.767 -11.916 1.569 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -6.168 -13.075 3.855 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -2.254 -14.278 1.131 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -5.658 -15.437 3.421 1.00 0.00 H new ATOM 0 HZ PHE A 51 -3.701 -16.045 2.054 1.00 0.00 H new ATOM 728 N GLN A 52 -4.739 -7.698 2.416 1.00 0.00 N ATOM 729 CA GLN A 52 -5.267 -6.376 2.731 1.00 0.00 C ATOM 730 C GLN A 52 -5.302 -5.493 1.487 1.00 0.00 C ATOM 731 O GLN A 52 -4.407 -5.555 0.644 1.00 0.00 O ATOM 732 CB GLN A 52 -4.423 -5.711 3.819 1.00 0.00 C ATOM 733 CG GLN A 52 -2.992 -5.427 3.390 1.00 0.00 C ATOM 734 CD GLN A 52 -2.412 -4.201 4.067 1.00 0.00 C ATOM 735 OE1 GLN A 52 -3.087 -3.181 4.214 1.00 0.00 O ATOM 736 NE2 GLN A 52 -1.155 -4.294 4.485 1.00 0.00 N ATOM 0 H GLN A 52 -3.726 -7.780 2.506 1.00 0.00 H new ATOM 0 HA GLN A 52 -6.286 -6.498 3.097 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -4.898 -4.775 4.114 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -4.409 -6.353 4.700 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.370 -6.292 3.619 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -2.961 -5.289 2.309 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -0.633 -5.159 4.342 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -0.712 -3.501 4.949 1.00 0.00 H new ATOM 745 N LYS A 53 -6.341 -4.672 1.379 1.00 0.00 N ATOM 746 CA LYS A 53 -6.492 -3.776 0.239 1.00 0.00 C ATOM 747 C LYS A 53 -6.791 -2.353 0.701 1.00 0.00 C ATOM 748 O LYS A 53 -7.823 -2.096 1.323 1.00 0.00 O ATOM 749 CB LYS A 53 -7.611 -4.271 -0.680 1.00 0.00 C ATOM 750 CG LYS A 53 -7.866 -3.363 -1.871 1.00 0.00 C ATOM 751 CD LYS A 53 -9.315 -3.432 -2.324 1.00 0.00 C ATOM 752 CE LYS A 53 -9.605 -4.723 -3.073 1.00 0.00 C ATOM 753 NZ LYS A 53 -9.106 -4.675 -4.475 1.00 0.00 N ATOM 0 H LYS A 53 -7.091 -4.609 2.067 1.00 0.00 H new ATOM 0 HA LYS A 53 -5.552 -3.770 -0.313 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -7.359 -5.268 -1.041 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -8.530 -4.365 -0.102 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -7.615 -2.336 -1.607 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -7.212 -3.649 -2.695 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -9.972 -3.358 -1.457 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -9.537 -2.580 -2.966 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -9.139 -5.559 -2.550 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -10.679 -4.908 -3.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -9.323 -5.573 -4.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -9.569 -3.894 -4.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -8.077 -4.524 -4.472 1.00 0.00 H new ATOM 767 N LEU A 54 -5.884 -1.433 0.394 1.00 0.00 N ATOM 768 CA LEU A 54 -6.052 -0.035 0.777 1.00 0.00 C ATOM 769 C LEU A 54 -6.993 0.683 -0.185 1.00 0.00 C ATOM 770 O LEU A 54 -6.940 0.470 -1.396 1.00 0.00 O ATOM 771 CB LEU A 54 -4.696 0.672 0.806 1.00 0.00 C ATOM 772 CG LEU A 54 -3.955 0.649 2.143 1.00 0.00 C ATOM 773 CD1 LEU A 54 -4.846 1.180 3.256 1.00 0.00 C ATOM 774 CD2 LEU A 54 -3.479 -0.760 2.465 1.00 0.00 C ATOM 0 H LEU A 54 -5.025 -1.629 -0.119 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.491 -0.006 1.774 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -4.055 0.217 0.051 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.845 1.712 0.514 1.00 0.00 H new ATOM 0 HG LEU A 54 -3.082 1.297 2.064 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.302 1.156 4.200 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.137 2.206 3.031 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -5.738 0.559 3.336 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -2.954 -0.757 3.420 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.337 -1.429 2.525 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -2.805 -1.104 1.681 1.00 0.00 H new ATOM 786 N ILE A 55 -7.851 1.537 0.363 1.00 0.00 N ATOM 787 CA ILE A 55 -8.801 2.289 -0.446 1.00 0.00 C ATOM 788 C ILE A 55 -9.021 3.687 0.122 1.00 0.00 C ATOM 789 O ILE A 55 -9.629 3.851 1.181 1.00 0.00 O ATOM 790 CB ILE A 55 -10.158 1.566 -0.540 1.00 0.00 C ATOM 791 CG1 ILE A 55 -9.958 0.117 -0.986 1.00 0.00 C ATOM 792 CG2 ILE A 55 -11.084 2.299 -1.500 1.00 0.00 C ATOM 793 CD1 ILE A 55 -11.164 -0.763 -0.742 1.00 0.00 C ATOM 0 H ILE A 55 -7.907 1.725 1.364 1.00 0.00 H new ATOM 0 HA ILE A 55 -8.371 2.368 -1.445 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.620 1.562 0.447 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -9.717 0.103 -2.049 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -9.100 -0.302 -0.459 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -12.039 1.776 -1.556 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -11.248 3.316 -1.143 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.630 2.331 -2.490 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.950 -1.776 -1.083 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.393 -0.779 0.324 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.019 -0.369 -1.291 1.00 0.00 H new ATOM 805 N PHE A 56 -8.525 4.694 -0.589 1.00 0.00 N ATOM 806 CA PHE A 56 -8.668 6.079 -0.157 1.00 0.00 C ATOM 807 C PHE A 56 -9.310 6.927 -1.251 1.00 0.00 C ATOM 808 O PHE A 56 -8.807 7.001 -2.372 1.00 0.00 O ATOM 809 CB PHE A 56 -7.304 6.661 0.220 1.00 0.00 C ATOM 810 CG PHE A 56 -7.393 7.894 1.074 1.00 0.00 C ATOM 811 CD1 PHE A 56 -8.013 7.851 2.313 1.00 0.00 C ATOM 812 CD2 PHE A 56 -6.857 9.095 0.639 1.00 0.00 C ATOM 813 CE1 PHE A 56 -8.098 8.983 3.100 1.00 0.00 C ATOM 814 CE2 PHE A 56 -6.938 10.231 1.423 1.00 0.00 C ATOM 815 CZ PHE A 56 -7.558 10.174 2.655 1.00 0.00 C ATOM 0 H PHE A 56 -8.020 4.577 -1.467 1.00 0.00 H new ATOM 0 HA PHE A 56 -9.317 6.095 0.718 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -6.728 5.902 0.750 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -6.755 6.899 -0.691 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -8.434 6.922 2.667 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -6.370 9.145 -0.324 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -8.586 8.937 4.062 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -6.517 11.162 1.072 1.00 0.00 H new ATOM 0 HZ PHE A 56 -7.621 11.059 3.270 1.00 0.00 H new ATOM 825 N LYS A 57 -10.426 7.566 -0.917 1.00 0.00 N ATOM 826 CA LYS A 57 -11.139 8.410 -1.868 1.00 0.00 C ATOM 827 C LYS A 57 -11.658 7.587 -3.044 1.00 0.00 C ATOM 828 O LYS A 57 -11.593 8.020 -4.193 1.00 0.00 O ATOM 829 CB LYS A 57 -10.224 9.526 -2.378 1.00 0.00 C ATOM 830 CG LYS A 57 -10.279 10.789 -1.536 1.00 0.00 C ATOM 831 CD LYS A 57 -9.394 11.882 -2.112 1.00 0.00 C ATOM 832 CE LYS A 57 -7.953 11.734 -1.649 1.00 0.00 C ATOM 833 NZ LYS A 57 -7.267 10.598 -2.325 1.00 0.00 N ATOM 0 H LYS A 57 -10.857 7.515 0.006 1.00 0.00 H new ATOM 0 HA LYS A 57 -11.991 8.854 -1.353 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -9.198 9.160 -2.403 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -10.500 9.771 -3.404 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -11.308 11.145 -1.479 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -9.963 10.563 -0.518 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -9.433 11.847 -3.201 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -9.776 12.857 -1.811 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.410 12.658 -1.850 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.932 11.581 -0.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -6.264 10.834 -2.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -7.341 9.746 -1.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -7.716 10.420 -3.246 1.00 0.00 H new ATOM 847 N GLY A 58 -12.173 6.398 -2.746 1.00 0.00 N ATOM 848 CA GLY A 58 -12.695 5.534 -3.789 1.00 0.00 C ATOM 849 C GLY A 58 -11.629 5.108 -4.778 1.00 0.00 C ATOM 850 O GLY A 58 -11.897 4.972 -5.972 1.00 0.00 O ATOM 0 H GLY A 58 -12.238 6.018 -1.802 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -13.139 4.648 -3.334 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -13.493 6.053 -4.321 1.00 0.00 H new ATOM 854 N LYS A 59 -10.414 4.898 -4.282 1.00 0.00 N ATOM 855 CA LYS A 59 -9.302 4.486 -5.130 1.00 0.00 C ATOM 856 C LYS A 59 -8.412 3.479 -4.408 1.00 0.00 C ATOM 857 O LYS A 59 -7.865 3.771 -3.344 1.00 0.00 O ATOM 858 CB LYS A 59 -8.476 5.703 -5.551 1.00 0.00 C ATOM 859 CG LYS A 59 -9.125 6.529 -6.648 1.00 0.00 C ATOM 860 CD LYS A 59 -8.913 5.904 -8.016 1.00 0.00 C ATOM 861 CE LYS A 59 -9.785 6.565 -9.072 1.00 0.00 C ATOM 862 NZ LYS A 59 -11.141 5.952 -9.134 1.00 0.00 N ATOM 0 H LYS A 59 -10.175 5.007 -3.296 1.00 0.00 H new ATOM 0 HA LYS A 59 -9.713 4.009 -6.020 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -8.310 6.337 -4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.497 5.367 -5.892 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -10.193 6.622 -6.451 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -8.710 7.537 -6.639 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -7.864 5.994 -8.300 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -9.140 4.839 -7.970 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -9.877 7.629 -8.853 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -9.303 6.480 -10.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -11.817 6.643 -9.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -11.116 5.115 -9.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -11.438 5.669 -8.178 1.00 0.00 H new ATOM 876 N SER A 60 -8.271 2.294 -4.993 1.00 0.00 N ATOM 877 CA SER A 60 -7.449 1.244 -4.404 1.00 0.00 C ATOM 878 C SER A 60 -5.971 1.622 -4.447 1.00 0.00 C ATOM 879 O SER A 60 -5.325 1.533 -5.492 1.00 0.00 O ATOM 880 CB SER A 60 -7.669 -0.079 -5.140 1.00 0.00 C ATOM 881 OG SER A 60 -7.512 0.083 -6.539 1.00 0.00 O ATOM 0 H SER A 60 -8.715 2.037 -5.874 1.00 0.00 H new ATOM 0 HA SER A 60 -7.746 1.126 -3.362 1.00 0.00 H new ATOM 0 HB2 SER A 60 -6.961 -0.824 -4.775 1.00 0.00 H new ATOM 0 HB3 SER A 60 -8.668 -0.457 -4.924 1.00 0.00 H new ATOM 0 HG SER A 60 -6.694 0.591 -6.720 1.00 0.00 H new ATOM 887 N LEU A 61 -5.442 2.045 -3.304 1.00 0.00 N ATOM 888 CA LEU A 61 -4.040 2.437 -3.209 1.00 0.00 C ATOM 889 C LEU A 61 -3.124 1.231 -3.387 1.00 0.00 C ATOM 890 O LEU A 61 -3.171 0.280 -2.605 1.00 0.00 O ATOM 891 CB LEU A 61 -3.768 3.104 -1.859 1.00 0.00 C ATOM 892 CG LEU A 61 -4.764 4.183 -1.431 1.00 0.00 C ATOM 893 CD1 LEU A 61 -4.519 4.591 0.014 1.00 0.00 C ATOM 894 CD2 LEU A 61 -4.671 5.391 -2.352 1.00 0.00 C ATOM 0 H LEU A 61 -5.962 2.125 -2.430 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.832 3.149 -4.008 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.749 2.330 -1.091 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.773 3.548 -1.889 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.771 3.772 -1.506 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.237 5.359 0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.638 3.723 0.662 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.507 4.984 0.115 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.387 6.148 -2.032 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.663 5.804 -2.310 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.896 5.087 -3.374 1.00 0.00 H new ATOM 906 N LYS A 62 -2.288 1.277 -4.418 1.00 0.00 N ATOM 907 CA LYS A 62 -1.357 0.190 -4.698 1.00 0.00 C ATOM 908 C LYS A 62 0.082 0.697 -4.714 1.00 0.00 C ATOM 909 O LYS A 62 1.010 -0.034 -4.367 1.00 0.00 O ATOM 910 CB LYS A 62 -1.693 -0.464 -6.040 1.00 0.00 C ATOM 911 CG LYS A 62 -1.589 0.484 -7.222 1.00 0.00 C ATOM 912 CD LYS A 62 -2.902 1.205 -7.477 1.00 0.00 C ATOM 913 CE LYS A 62 -3.837 0.371 -8.339 1.00 0.00 C ATOM 914 NZ LYS A 62 -3.593 0.588 -9.792 1.00 0.00 N ATOM 0 H LYS A 62 -2.236 2.056 -5.074 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.454 -0.551 -3.905 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.022 -1.308 -6.202 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.705 -0.866 -5.995 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -0.802 1.215 -7.035 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.301 -0.074 -8.113 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -3.385 1.430 -6.526 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.706 2.158 -7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -3.704 -0.685 -8.102 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.871 0.623 -8.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -4.250 0.002 -10.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.744 1.591 -10.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -2.614 0.323 -10.023 1.00 0.00 H new ATOM 928 N GLU A 63 0.258 1.951 -5.116 1.00 0.00 N ATOM 929 CA GLU A 63 1.585 2.554 -5.176 1.00 0.00 C ATOM 930 C GLU A 63 2.167 2.726 -3.776 1.00 0.00 C ATOM 931 O GLU A 63 1.598 3.423 -2.936 1.00 0.00 O ATOM 932 CB GLU A 63 1.522 3.909 -5.884 1.00 0.00 C ATOM 933 CG GLU A 63 1.280 3.803 -7.380 1.00 0.00 C ATOM 934 CD GLU A 63 1.649 5.073 -8.122 1.00 0.00 C ATOM 935 OE1 GLU A 63 2.832 5.220 -8.494 1.00 0.00 O ATOM 936 OE2 GLU A 63 0.756 5.921 -8.329 1.00 0.00 O ATOM 0 H GLU A 63 -0.500 2.569 -5.405 1.00 0.00 H new ATOM 0 HA GLU A 63 2.235 1.886 -5.742 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.727 4.506 -5.437 1.00 0.00 H new ATOM 0 HB3 GLU A 63 2.457 4.443 -5.713 1.00 0.00 H new ATOM 0 HG2 GLU A 63 1.860 2.971 -7.780 1.00 0.00 H new ATOM 0 HG3 GLU A 63 0.229 3.574 -7.559 1.00 0.00 H new ATOM 943 N MET A 64 3.306 2.085 -3.532 1.00 0.00 N ATOM 944 CA MET A 64 3.966 2.167 -2.234 1.00 0.00 C ATOM 945 C MET A 64 4.991 3.296 -2.217 1.00 0.00 C ATOM 946 O MET A 64 5.086 4.044 -1.244 1.00 0.00 O ATOM 947 CB MET A 64 4.647 0.838 -1.900 1.00 0.00 C ATOM 948 CG MET A 64 3.692 -0.343 -1.867 1.00 0.00 C ATOM 949 SD MET A 64 2.680 -0.377 -0.375 1.00 0.00 S ATOM 950 CE MET A 64 1.037 -0.256 -1.077 1.00 0.00 C ATOM 0 H MET A 64 3.791 1.504 -4.216 1.00 0.00 H new ATOM 0 HA MET A 64 3.207 2.377 -1.480 1.00 0.00 H new ATOM 0 HB2 MET A 64 5.427 0.644 -2.636 1.00 0.00 H new ATOM 0 HB3 MET A 64 5.138 0.925 -0.931 1.00 0.00 H new ATOM 0 HG2 MET A 64 3.042 -0.304 -2.741 1.00 0.00 H new ATOM 0 HG3 MET A 64 4.263 -1.269 -1.935 1.00 0.00 H new ATOM 0 HE1 MET A 64 0.309 -0.122 -0.277 1.00 0.00 H new ATOM 0 HE2 MET A 64 0.993 0.596 -1.755 1.00 0.00 H new ATOM 0 HE3 MET A 64 0.808 -1.169 -1.627 1.00 0.00 H new ATOM 960 N GLU A 65 5.756 3.412 -3.298 1.00 0.00 N ATOM 961 CA GLU A 65 6.775 4.450 -3.404 1.00 0.00 C ATOM 962 C GLU A 65 6.144 5.839 -3.355 1.00 0.00 C ATOM 963 O GLU A 65 6.806 6.824 -3.028 1.00 0.00 O ATOM 964 CB GLU A 65 7.570 4.285 -4.701 1.00 0.00 C ATOM 965 CG GLU A 65 6.762 4.584 -5.953 1.00 0.00 C ATOM 966 CD GLU A 65 7.361 3.957 -7.197 1.00 0.00 C ATOM 967 OE1 GLU A 65 8.405 4.455 -7.669 1.00 0.00 O ATOM 968 OE2 GLU A 65 6.786 2.969 -7.699 1.00 0.00 O ATOM 0 H GLU A 65 5.690 2.801 -4.112 1.00 0.00 H new ATOM 0 HA GLU A 65 7.452 4.347 -2.556 1.00 0.00 H new ATOM 0 HB2 GLU A 65 8.437 4.945 -4.672 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.948 3.264 -4.758 1.00 0.00 H new ATOM 0 HG2 GLU A 65 5.744 4.218 -5.820 1.00 0.00 H new ATOM 0 HG3 GLU A 65 6.697 5.663 -6.090 1.00 0.00 H new ATOM 975 N THR A 66 4.857 5.910 -3.684 1.00 0.00 N ATOM 976 CA THR A 66 4.136 7.177 -3.680 1.00 0.00 C ATOM 977 C THR A 66 3.966 7.708 -2.262 1.00 0.00 C ATOM 978 O THR A 66 3.555 6.991 -1.349 1.00 0.00 O ATOM 979 CB THR A 66 2.748 7.035 -4.333 1.00 0.00 C ATOM 980 OG1 THR A 66 2.889 6.644 -5.703 1.00 0.00 O ATOM 981 CG2 THR A 66 1.975 8.342 -4.250 1.00 0.00 C ATOM 0 H THR A 66 4.293 5.105 -3.956 1.00 0.00 H new ATOM 0 HA THR A 66 4.732 7.882 -4.260 1.00 0.00 H new ATOM 0 HB THR A 66 2.193 6.268 -3.792 1.00 0.00 H new ATOM 0 HG1 THR A 66 2.138 6.999 -6.223 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.998 8.217 -4.718 1.00 0.00 H new ATOM 0 HG22 THR A 66 1.844 8.621 -3.205 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.528 9.125 -4.768 1.00 0.00 H new ATOM 989 N PRO A 67 4.289 8.995 -2.068 1.00 0.00 N ATOM 990 CA PRO A 67 4.179 9.652 -0.762 1.00 0.00 C ATOM 991 C PRO A 67 2.729 9.849 -0.333 1.00 0.00 C ATOM 992 O PRO A 67 1.907 10.354 -1.100 1.00 0.00 O ATOM 993 CB PRO A 67 4.859 11.005 -0.987 1.00 0.00 C ATOM 994 CG PRO A 67 4.725 11.258 -2.448 1.00 0.00 C ATOM 995 CD PRO A 67 4.786 9.910 -3.110 1.00 0.00 C ATOM 0 HA PRO A 67 4.632 9.059 0.032 1.00 0.00 H new ATOM 0 HB2 PRO A 67 4.379 11.791 -0.404 1.00 0.00 H new ATOM 0 HB3 PRO A 67 5.906 10.977 -0.684 1.00 0.00 H new ATOM 0 HG2 PRO A 67 3.784 11.760 -2.672 1.00 0.00 H new ATOM 0 HG3 PRO A 67 5.525 11.905 -2.807 1.00 0.00 H new ATOM 0 HD2 PRO A 67 4.166 9.874 -4.006 1.00 0.00 H new ATOM 0 HD3 PRO A 67 5.802 9.658 -3.415 1.00 0.00 H new ATOM 1003 N LEU A 68 2.421 9.449 0.895 1.00 0.00 N ATOM 1004 CA LEU A 68 1.069 9.582 1.427 1.00 0.00 C ATOM 1005 C LEU A 68 0.497 10.962 1.119 1.00 0.00 C ATOM 1006 O LEU A 68 -0.716 11.128 0.991 1.00 0.00 O ATOM 1007 CB LEU A 68 1.068 9.342 2.937 1.00 0.00 C ATOM 1008 CG LEU A 68 1.564 7.971 3.399 1.00 0.00 C ATOM 1009 CD1 LEU A 68 2.205 8.071 4.775 1.00 0.00 C ATOM 1010 CD2 LEU A 68 0.420 6.967 3.414 1.00 0.00 C ATOM 0 H LEU A 68 3.089 9.030 1.542 1.00 0.00 H new ATOM 0 HA LEU A 68 0.440 8.833 0.946 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.686 10.107 3.407 1.00 0.00 H new ATOM 0 HB3 LEU A 68 0.052 9.482 3.306 1.00 0.00 H new ATOM 0 HG LEU A 68 2.318 7.622 2.693 1.00 0.00 H new ATOM 0 HD11 LEU A 68 2.552 7.086 5.087 1.00 0.00 H new ATOM 0 HD12 LEU A 68 3.051 8.757 4.733 1.00 0.00 H new ATOM 0 HD13 LEU A 68 1.472 8.442 5.492 1.00 0.00 H new ATOM 0 HD21 LEU A 68 0.791 5.997 3.745 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.357 7.311 4.097 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.005 6.873 2.410 1.00 0.00 H new ATOM 1022 N SER A 69 1.378 11.950 1.001 1.00 0.00 N ATOM 1023 CA SER A 69 0.961 13.316 0.710 1.00 0.00 C ATOM 1024 C SER A 69 0.473 13.440 -0.730 1.00 0.00 C ATOM 1025 O SER A 69 -0.488 14.156 -1.012 1.00 0.00 O ATOM 1026 CB SER A 69 2.117 14.288 0.954 1.00 0.00 C ATOM 1027 OG SER A 69 2.093 14.787 2.280 1.00 0.00 O ATOM 0 H SER A 69 2.386 11.830 1.103 1.00 0.00 H new ATOM 0 HA SER A 69 0.137 13.568 1.378 1.00 0.00 H new ATOM 0 HB2 SER A 69 3.065 13.784 0.769 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.054 15.117 0.249 1.00 0.00 H new ATOM 0 HG SER A 69 2.843 15.404 2.411 1.00 0.00 H new ATOM 1033 N ALA A 70 1.143 12.738 -1.638 1.00 0.00 N ATOM 1034 CA ALA A 70 0.777 12.767 -3.049 1.00 0.00 C ATOM 1035 C ALA A 70 -0.692 12.408 -3.243 1.00 0.00 C ATOM 1036 O ALA A 70 -1.375 12.982 -4.092 1.00 0.00 O ATOM 1037 CB ALA A 70 1.663 11.819 -3.843 1.00 0.00 C ATOM 0 H ALA A 70 1.942 12.142 -1.422 1.00 0.00 H new ATOM 0 HA ALA A 70 0.927 13.782 -3.417 1.00 0.00 H new ATOM 0 HB1 ALA A 70 1.379 11.851 -4.895 1.00 0.00 H new ATOM 0 HB2 ALA A 70 2.705 12.122 -3.739 1.00 0.00 H new ATOM 0 HB3 ALA A 70 1.541 10.804 -3.465 1.00 0.00 H new ATOM 1043 N LEU A 71 -1.173 11.456 -2.451 1.00 0.00 N ATOM 1044 CA LEU A 71 -2.563 11.020 -2.536 1.00 0.00 C ATOM 1045 C LEU A 71 -3.481 11.980 -1.785 1.00 0.00 C ATOM 1046 O LEU A 71 -4.657 12.120 -2.121 1.00 0.00 O ATOM 1047 CB LEU A 71 -2.710 9.607 -1.969 1.00 0.00 C ATOM 1048 CG LEU A 71 -1.772 8.549 -2.552 1.00 0.00 C ATOM 1049 CD1 LEU A 71 -1.495 7.459 -1.528 1.00 0.00 C ATOM 1050 CD2 LEU A 71 -2.363 7.954 -3.821 1.00 0.00 C ATOM 0 H LEU A 71 -0.622 10.971 -1.743 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.854 11.015 -3.587 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.551 9.651 -0.892 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -3.738 9.279 -2.126 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.827 9.029 -2.806 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -0.826 6.715 -1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.028 7.898 -0.646 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -2.432 6.982 -1.242 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.682 7.203 -4.222 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -3.322 7.489 -3.593 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -2.509 8.743 -4.559 1.00 0.00 H new ATOM 1062 N GLY A 72 -2.936 12.639 -0.768 1.00 0.00 N ATOM 1063 CA GLY A 72 -3.719 13.579 0.013 1.00 0.00 C ATOM 1064 C GLY A 72 -3.837 13.167 1.467 1.00 0.00 C ATOM 1065 O GLY A 72 -4.263 13.958 2.309 1.00 0.00 O ATOM 0 H GLY A 72 -1.966 12.539 -0.470 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -3.261 14.566 -0.046 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -4.716 13.664 -0.419 1.00 0.00 H new ATOM 1069 N ILE A 73 -3.461 11.928 1.762 1.00 0.00 N ATOM 1070 CA ILE A 73 -3.528 11.414 3.124 1.00 0.00 C ATOM 1071 C ILE A 73 -2.651 12.233 4.065 1.00 0.00 C ATOM 1072 O ILE A 73 -1.585 12.709 3.677 1.00 0.00 O ATOM 1073 CB ILE A 73 -3.092 9.938 3.191 1.00 0.00 C ATOM 1074 CG1 ILE A 73 -4.087 9.055 2.433 1.00 0.00 C ATOM 1075 CG2 ILE A 73 -2.971 9.486 4.638 1.00 0.00 C ATOM 1076 CD1 ILE A 73 -3.462 7.811 1.842 1.00 0.00 C ATOM 0 H ILE A 73 -3.107 11.261 1.076 1.00 0.00 H new ATOM 0 HA ILE A 73 -4.568 11.493 3.439 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.115 9.842 2.718 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -4.890 8.762 3.110 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.542 9.639 1.633 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -2.662 8.441 4.668 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -2.229 10.099 5.150 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -3.935 9.594 5.135 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.225 7.233 1.320 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -2.679 8.096 1.140 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.032 7.206 2.640 1.00 0.00 H new ATOM 1088 N GLN A 74 -3.108 12.392 5.303 1.00 0.00 N ATOM 1089 CA GLN A 74 -2.365 13.154 6.299 1.00 0.00 C ATOM 1090 C GLN A 74 -2.755 12.730 7.711 1.00 0.00 C ATOM 1091 O GLN A 74 -3.814 12.139 7.922 1.00 0.00 O ATOM 1092 CB GLN A 74 -2.613 14.652 6.117 1.00 0.00 C ATOM 1093 CG GLN A 74 -1.431 15.518 6.521 1.00 0.00 C ATOM 1094 CD GLN A 74 -1.854 16.883 7.028 1.00 0.00 C ATOM 1095 OE1 GLN A 74 -2.409 17.007 8.121 1.00 0.00 O ATOM 1096 NE2 GLN A 74 -1.595 17.916 6.235 1.00 0.00 N ATOM 0 H GLN A 74 -3.989 12.003 5.640 1.00 0.00 H new ATOM 0 HA GLN A 74 -1.304 12.949 6.158 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -2.856 14.847 5.072 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -3.483 14.942 6.706 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -0.860 15.008 7.296 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -0.767 15.642 5.665 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -1.133 17.767 5.338 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -1.858 18.859 6.523 1.00 0.00 H new ATOM 1105 N ASP A 75 -1.893 13.034 8.675 1.00 0.00 N ATOM 1106 CA ASP A 75 -2.148 12.685 10.067 1.00 0.00 C ATOM 1107 C ASP A 75 -3.509 13.207 10.518 1.00 0.00 C ATOM 1108 O ASP A 75 -3.720 14.415 10.617 1.00 0.00 O ATOM 1109 CB ASP A 75 -1.048 13.251 10.967 1.00 0.00 C ATOM 1110 CG ASP A 75 -0.763 14.713 10.684 1.00 0.00 C ATOM 1111 OD1 ASP A 75 -0.401 15.035 9.532 1.00 0.00 O ATOM 1112 OD2 ASP A 75 -0.903 15.535 11.613 1.00 0.00 O ATOM 0 H ASP A 75 -1.011 13.522 8.518 1.00 0.00 H new ATOM 0 HA ASP A 75 -2.150 11.598 10.148 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -1.342 13.137 12.010 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -0.135 12.672 10.828 1.00 0.00 H new ATOM 1117 N GLY A 76 -4.430 12.287 10.788 1.00 0.00 N ATOM 1118 CA GLY A 76 -5.759 12.674 11.224 1.00 0.00 C ATOM 1119 C GLY A 76 -6.826 12.331 10.203 1.00 0.00 C ATOM 1120 O GLY A 76 -7.870 12.982 10.144 1.00 0.00 O ATOM 0 H GLY A 76 -4.280 11.281 10.713 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.988 12.176 12.166 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -5.777 13.747 11.418 1.00 0.00 H new ATOM 1124 N CYS A 77 -6.564 11.309 9.396 1.00 0.00 N ATOM 1125 CA CYS A 77 -7.509 10.883 8.370 1.00 0.00 C ATOM 1126 C CYS A 77 -7.986 9.458 8.628 1.00 0.00 C ATOM 1127 O CYS A 77 -7.480 8.775 9.520 1.00 0.00 O ATOM 1128 CB CYS A 77 -6.867 10.976 6.985 1.00 0.00 C ATOM 1129 SG CYS A 77 -5.837 9.555 6.552 1.00 0.00 S ATOM 0 H CYS A 77 -5.705 10.760 9.432 1.00 0.00 H new ATOM 0 HA CYS A 77 -8.372 11.548 8.408 1.00 0.00 H new ATOM 0 HB2 CYS A 77 -7.654 11.082 6.238 1.00 0.00 H new ATOM 0 HB3 CYS A 77 -6.259 11.880 6.938 1.00 0.00 H new ATOM 0 HG CYS A 77 -5.928 9.326 5.276 1.00 0.00 H new ATOM 1135 N ARG A 78 -8.963 9.015 7.844 1.00 0.00 N ATOM 1136 CA ARG A 78 -9.510 7.671 7.990 1.00 0.00 C ATOM 1137 C ARG A 78 -9.435 6.908 6.671 1.00 0.00 C ATOM 1138 O ARG A 78 -10.113 7.251 5.702 1.00 0.00 O ATOM 1139 CB ARG A 78 -10.961 7.738 8.470 1.00 0.00 C ATOM 1140 CG ARG A 78 -11.102 7.731 9.984 1.00 0.00 C ATOM 1141 CD ARG A 78 -12.432 8.326 10.422 1.00 0.00 C ATOM 1142 NE ARG A 78 -12.445 9.781 10.307 1.00 0.00 N ATOM 1143 CZ ARG A 78 -13.551 10.514 10.378 1.00 0.00 C ATOM 1144 NH1 ARG A 78 -14.726 9.930 10.562 1.00 0.00 N ATOM 1145 NH2 ARG A 78 -13.481 11.834 10.265 1.00 0.00 N ATOM 0 H ARG A 78 -9.392 9.567 7.101 1.00 0.00 H new ATOM 0 HA ARG A 78 -8.913 7.141 8.732 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -11.424 8.642 8.074 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -11.511 6.892 8.058 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -11.020 6.709 10.354 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -10.284 8.298 10.429 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -13.234 7.907 9.814 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -12.633 8.042 11.455 1.00 0.00 H new ATOM 0 HE ARG A 78 -11.557 10.261 10.164 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -14.783 8.915 10.650 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -15.573 10.495 10.616 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.578 12.287 10.124 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -14.330 12.396 10.320 1.00 0.00 H new ATOM 1159 N VAL A 79 -8.605 5.870 6.640 1.00 0.00 N ATOM 1160 CA VAL A 79 -8.441 5.057 5.441 1.00 0.00 C ATOM 1161 C VAL A 79 -9.167 3.724 5.578 1.00 0.00 C ATOM 1162 O VAL A 79 -9.229 3.147 6.663 1.00 0.00 O ATOM 1163 CB VAL A 79 -6.954 4.790 5.143 1.00 0.00 C ATOM 1164 CG1 VAL A 79 -6.801 3.989 3.859 1.00 0.00 C ATOM 1165 CG2 VAL A 79 -6.185 6.100 5.058 1.00 0.00 C ATOM 0 H VAL A 79 -8.036 5.572 7.432 1.00 0.00 H new ATOM 0 HA VAL A 79 -8.874 5.621 4.615 1.00 0.00 H new ATOM 0 HB VAL A 79 -6.538 4.202 5.961 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -5.743 3.810 3.665 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -7.317 3.035 3.962 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -7.233 4.547 3.028 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -5.136 5.893 4.847 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -6.601 6.715 4.260 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -6.266 6.632 6.006 1.00 0.00 H new ATOM 1175 N MET A 80 -9.716 3.238 4.469 1.00 0.00 N ATOM 1176 CA MET A 80 -10.437 1.971 4.464 1.00 0.00 C ATOM 1177 C MET A 80 -9.527 0.829 4.023 1.00 0.00 C ATOM 1178 O MET A 80 -8.727 0.981 3.098 1.00 0.00 O ATOM 1179 CB MET A 80 -11.653 2.055 3.540 1.00 0.00 C ATOM 1180 CG MET A 80 -12.384 0.732 3.375 1.00 0.00 C ATOM 1181 SD MET A 80 -13.899 0.891 2.411 1.00 0.00 S ATOM 1182 CE MET A 80 -14.712 -0.657 2.800 1.00 0.00 C ATOM 0 H MET A 80 -9.675 3.703 3.562 1.00 0.00 H new ATOM 0 HA MET A 80 -10.775 1.771 5.481 1.00 0.00 H new ATOM 0 HB2 MET A 80 -12.347 2.798 3.933 1.00 0.00 H new ATOM 0 HB3 MET A 80 -11.331 2.407 2.560 1.00 0.00 H new ATOM 0 HG2 MET A 80 -11.723 0.014 2.890 1.00 0.00 H new ATOM 0 HG3 MET A 80 -12.625 0.329 4.359 1.00 0.00 H new ATOM 0 HE1 MET A 80 -15.397 -0.921 1.994 1.00 0.00 H new ATOM 0 HE2 MET A 80 -13.965 -1.442 2.913 1.00 0.00 H new ATOM 0 HE3 MET A 80 -15.270 -0.551 3.730 1.00 0.00 H new ATOM 1192 N LEU A 81 -9.653 -0.313 4.689 1.00 0.00 N ATOM 1193 CA LEU A 81 -8.842 -1.482 4.365 1.00 0.00 C ATOM 1194 C LEU A 81 -9.701 -2.739 4.295 1.00 0.00 C ATOM 1195 O LEU A 81 -10.476 -3.026 5.208 1.00 0.00 O ATOM 1196 CB LEU A 81 -7.736 -1.663 5.406 1.00 0.00 C ATOM 1197 CG LEU A 81 -6.682 -2.724 5.088 1.00 0.00 C ATOM 1198 CD1 LEU A 81 -5.841 -2.299 3.894 1.00 0.00 C ATOM 1199 CD2 LEU A 81 -5.798 -2.979 6.300 1.00 0.00 C ATOM 0 H LEU A 81 -10.309 -0.455 5.457 1.00 0.00 H new ATOM 0 HA LEU A 81 -8.389 -1.320 3.387 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.231 -0.707 5.540 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -8.200 -1.915 6.360 1.00 0.00 H new ATOM 0 HG LEU A 81 -7.194 -3.652 4.835 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.096 -3.066 3.682 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.484 -2.168 3.024 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.339 -1.358 4.119 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.054 -3.737 6.055 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.295 -2.055 6.584 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.411 -3.328 7.131 1.00 0.00 H new ATOM 1211 N ILE A 82 -9.558 -3.487 3.206 1.00 0.00 N ATOM 1212 CA ILE A 82 -10.319 -4.716 3.018 1.00 0.00 C ATOM 1213 C ILE A 82 -9.395 -5.923 2.897 1.00 0.00 C ATOM 1214 O ILE A 82 -8.485 -5.940 2.069 1.00 0.00 O ATOM 1215 CB ILE A 82 -11.212 -4.640 1.766 1.00 0.00 C ATOM 1216 CG1 ILE A 82 -12.211 -3.488 1.894 1.00 0.00 C ATOM 1217 CG2 ILE A 82 -11.941 -5.959 1.554 1.00 0.00 C ATOM 1218 CD1 ILE A 82 -13.023 -3.250 0.640 1.00 0.00 C ATOM 0 H ILE A 82 -8.922 -3.263 2.440 1.00 0.00 H new ATOM 0 HA ILE A 82 -10.951 -4.832 3.898 1.00 0.00 H new ATOM 0 HB ILE A 82 -10.580 -4.453 0.898 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -12.889 -3.696 2.722 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -11.671 -2.575 2.146 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -12.568 -5.889 0.665 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -11.213 -6.760 1.423 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -12.564 -6.174 2.422 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -13.710 -2.419 0.803 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -12.354 -3.011 -0.187 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -13.591 -4.148 0.398 1.00 0.00 H new ATOM 1230 N GLY A 83 -9.635 -6.932 3.728 1.00 0.00 N ATOM 1231 CA GLY A 83 -8.817 -8.130 3.697 1.00 0.00 C ATOM 1232 C GLY A 83 -9.272 -9.170 4.702 1.00 0.00 C ATOM 1233 O GLY A 83 -10.334 -9.034 5.310 1.00 0.00 O ATOM 0 H GLY A 83 -10.382 -6.941 4.423 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.846 -8.560 2.696 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.780 -7.863 3.899 1.00 0.00 H new ATOM 1237 N LYS A 84 -8.468 -10.213 4.878 1.00 0.00 N ATOM 1238 CA LYS A 84 -8.793 -11.281 5.815 1.00 0.00 C ATOM 1239 C LYS A 84 -7.664 -11.484 6.821 1.00 0.00 C ATOM 1240 O LYS A 84 -6.490 -11.525 6.453 1.00 0.00 O ATOM 1241 CB LYS A 84 -9.059 -12.586 5.061 1.00 0.00 C ATOM 1242 CG LYS A 84 -10.483 -12.713 4.549 1.00 0.00 C ATOM 1243 CD LYS A 84 -11.387 -13.379 5.573 1.00 0.00 C ATOM 1244 CE LYS A 84 -12.506 -14.161 4.903 1.00 0.00 C ATOM 1245 NZ LYS A 84 -13.727 -14.222 5.754 1.00 0.00 N ATOM 0 H LYS A 84 -7.585 -10.341 4.383 1.00 0.00 H new ATOM 0 HA LYS A 84 -9.693 -10.993 6.358 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -8.371 -12.656 4.218 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -8.842 -13.427 5.720 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -10.873 -11.724 4.307 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -10.488 -13.293 3.626 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -10.798 -14.049 6.199 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -11.814 -12.622 6.230 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -12.752 -13.697 3.948 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -12.163 -15.173 4.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -14.466 -14.763 5.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -13.499 -14.688 6.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -14.069 -13.258 5.939 1.00 0.00 H new ATOM 1259 N LYS A 85 -8.027 -11.612 8.093 1.00 0.00 N ATOM 1260 CA LYS A 85 -7.046 -11.814 9.152 1.00 0.00 C ATOM 1261 C LYS A 85 -7.426 -13.006 10.025 1.00 0.00 C ATOM 1262 O LYS A 85 -7.277 -12.966 11.246 1.00 0.00 O ATOM 1263 CB LYS A 85 -6.929 -10.555 10.014 1.00 0.00 C ATOM 1264 CG LYS A 85 -8.155 -10.287 10.869 1.00 0.00 C ATOM 1265 CD LYS A 85 -8.202 -8.842 11.339 1.00 0.00 C ATOM 1266 CE LYS A 85 -7.175 -8.576 12.428 1.00 0.00 C ATOM 1267 NZ LYS A 85 -7.508 -9.293 13.691 1.00 0.00 N ATOM 0 H LYS A 85 -8.994 -11.579 8.415 1.00 0.00 H new ATOM 0 HA LYS A 85 -6.082 -12.019 8.686 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -6.058 -10.648 10.662 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -6.754 -9.696 9.366 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.055 -10.514 10.298 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.150 -10.952 11.733 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.019 -8.178 10.495 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -9.199 -8.613 11.714 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -6.190 -8.888 12.082 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -7.120 -7.505 12.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -6.972 -8.876 14.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -8.527 -9.206 13.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -7.258 -10.298 13.596 1.00 0.00 H new ATOM 1281 N ASN A 86 -7.916 -14.066 9.391 1.00 0.00 N ATOM 1282 CA ASN A 86 -8.315 -15.270 10.110 1.00 0.00 C ATOM 1283 C ASN A 86 -7.134 -16.221 10.278 1.00 0.00 C ATOM 1284 O ASN A 86 -6.862 -16.702 11.378 1.00 0.00 O ATOM 1285 CB ASN A 86 -9.453 -15.977 9.371 1.00 0.00 C ATOM 1286 CG ASN A 86 -10.819 -15.474 9.795 1.00 0.00 C ATOM 1287 OD1 ASN A 86 -11.600 -14.997 8.971 1.00 0.00 O ATOM 1288 ND2 ASN A 86 -11.113 -15.578 11.085 1.00 0.00 N ATOM 0 H ASN A 86 -8.046 -14.116 8.381 1.00 0.00 H new ATOM 0 HA ASN A 86 -8.662 -14.973 11.100 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -9.332 -15.830 8.298 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -9.391 -17.050 9.555 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -12.017 -15.256 11.430 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -10.435 -15.980 11.732 1.00 0.00 H new ATOM 1295 N SER A 87 -6.435 -16.487 9.179 1.00 0.00 N ATOM 1296 CA SER A 87 -5.285 -17.383 9.203 1.00 0.00 C ATOM 1297 C SER A 87 -4.260 -16.924 10.236 1.00 0.00 C ATOM 1298 O SER A 87 -3.801 -17.711 11.063 1.00 0.00 O ATOM 1299 CB SER A 87 -4.635 -17.451 7.819 1.00 0.00 C ATOM 1300 OG SER A 87 -5.209 -18.484 7.037 1.00 0.00 O ATOM 0 H SER A 87 -6.645 -16.095 8.261 1.00 0.00 H new ATOM 0 HA SER A 87 -5.636 -18.377 9.481 1.00 0.00 H new ATOM 0 HB2 SER A 87 -4.756 -16.495 7.310 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.564 -17.623 7.925 1.00 0.00 H new ATOM 0 HG SER A 87 -4.778 -18.506 6.157 1.00 0.00 H new ATOM 1306 N GLY A 88 -3.907 -15.644 10.182 1.00 0.00 N ATOM 1307 CA GLY A 88 -2.940 -15.101 11.118 1.00 0.00 C ATOM 1308 C GLY A 88 -3.298 -15.399 12.560 1.00 0.00 C ATOM 1309 O GLY A 88 -4.369 -15.926 12.860 1.00 0.00 O ATOM 0 H GLY A 88 -4.273 -14.973 9.507 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -1.955 -15.514 10.899 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -2.871 -14.022 10.980 1.00 0.00 H new ATOM 1313 N PRO A 89 -2.386 -15.058 13.483 1.00 0.00 N ATOM 1314 CA PRO A 89 -2.588 -15.284 14.917 1.00 0.00 C ATOM 1315 C PRO A 89 -3.663 -14.373 15.501 1.00 0.00 C ATOM 1316 O PRO A 89 -3.399 -13.217 15.830 1.00 0.00 O ATOM 1317 CB PRO A 89 -1.222 -14.956 15.524 1.00 0.00 C ATOM 1318 CG PRO A 89 -0.594 -14.013 14.556 1.00 0.00 C ATOM 1319 CD PRO A 89 -1.087 -14.426 13.197 1.00 0.00 C ATOM 0 HA PRO A 89 -2.930 -16.298 15.126 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -1.325 -14.501 16.509 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -0.618 -15.855 15.649 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.874 -12.983 14.777 1.00 0.00 H new ATOM 0 HG3 PRO A 89 0.493 -14.066 14.609 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -1.195 -13.570 12.531 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.400 -15.121 12.714 1.00 0.00 H new ATOM 1327 N SER A 90 -4.876 -14.902 15.628 1.00 0.00 N ATOM 1328 CA SER A 90 -5.991 -14.136 16.170 1.00 0.00 C ATOM 1329 C SER A 90 -5.685 -13.658 17.586 1.00 0.00 C ATOM 1330 O SER A 90 -5.836 -12.477 17.901 1.00 0.00 O ATOM 1331 CB SER A 90 -7.267 -14.981 16.169 1.00 0.00 C ATOM 1332 OG SER A 90 -8.418 -14.167 16.307 1.00 0.00 O ATOM 0 H SER A 90 -5.111 -15.858 15.363 1.00 0.00 H new ATOM 0 HA SER A 90 -6.142 -13.263 15.535 1.00 0.00 H new ATOM 0 HB2 SER A 90 -7.329 -15.550 15.241 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.229 -15.704 16.984 1.00 0.00 H new ATOM 0 HG SER A 90 -9.220 -14.731 16.302 1.00 0.00 H new ATOM 1338 N SER A 91 -5.254 -14.584 18.436 1.00 0.00 N ATOM 1339 CA SER A 91 -4.930 -14.259 19.821 1.00 0.00 C ATOM 1340 C SER A 91 -3.803 -13.232 19.888 1.00 0.00 C ATOM 1341 O SER A 91 -2.751 -13.408 19.276 1.00 0.00 O ATOM 1342 CB SER A 91 -4.529 -15.524 20.583 1.00 0.00 C ATOM 1343 OG SER A 91 -5.587 -16.466 20.600 1.00 0.00 O ATOM 0 H SER A 91 -5.121 -15.565 18.191 1.00 0.00 H new ATOM 0 HA SER A 91 -5.818 -13.830 20.286 1.00 0.00 H new ATOM 0 HB2 SER A 91 -3.649 -15.969 20.118 1.00 0.00 H new ATOM 0 HB3 SER A 91 -4.253 -15.264 21.605 1.00 0.00 H new ATOM 0 HG SER A 91 -5.305 -17.266 21.091 1.00 0.00 H new ATOM 1349 N GLY A 92 -4.034 -12.159 20.638 1.00 0.00 N ATOM 1350 CA GLY A 92 -3.031 -11.119 20.773 1.00 0.00 C ATOM 1351 C GLY A 92 -2.286 -10.861 19.478 1.00 0.00 C ATOM 1352 O GLY A 92 -1.083 -10.597 19.488 1.00 0.00 O ATOM 0 H GLY A 92 -4.898 -11.991 21.154 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.510 -10.197 21.103 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.319 -11.403 21.548 1.00 0.00 H new TER 1356 GLY A 92