USER MOD reduce.3.24.130724 H: found=0, std=0, add=524, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 524 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 13 THR OG1 : rot -29:sc= -0.285 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.117 X(o=-0.12,f=0.049) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 139:sc= 0.0269 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 96:sc= 1.16 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 66:sc= 1.23 USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= -1.88 K(o=-1.9,f=-2.7!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot 101:sc= 1.02 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -77:sc= 1.31 USER MOD Single : A 57 THR OG1 : rot -114:sc= 1.18 USER MOD Single : A 60 MET CE :methyl -139:sc= 0 (180deg=-0.0181) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 103:sc= 1.16 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot 87:sc= -1.02 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0.123 USER MOD Single : A 70 GLN : amide:sc= -0.0463 X(o=-0.046,f=-0.21) USER MOD Single : A 73 SER OG : rot -41:sc= 0.0132 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 13 95.008 12.935 15.561 1.00 0.00 N ATOM 2 CA THR A 13 94.061 13.896 14.937 1.00 0.00 C ATOM 3 C THR A 13 92.652 13.723 15.494 1.00 0.00 C ATOM 4 O THR A 13 92.387 12.798 16.261 1.00 0.00 O ATOM 5 CB THR A 13 94.059 13.665 13.424 1.00 0.00 C ATOM 6 OG1 THR A 13 94.025 12.281 13.128 1.00 0.00 O ATOM 7 CG2 THR A 13 95.265 14.256 12.726 1.00 0.00 C ATOM 0 HA THR A 13 94.383 14.912 15.164 1.00 0.00 H new ATOM 0 HB THR A 13 93.165 14.169 13.056 1.00 0.00 H new ATOM 0 HG1 THR A 13 94.453 11.781 13.854 1.00 0.00 H new ATOM 0 HG21 THR A 13 95.200 14.056 11.656 1.00 0.00 H new ATOM 0 HG22 THR A 13 95.291 15.333 12.893 1.00 0.00 H new ATOM 0 HG23 THR A 13 96.174 13.805 13.125 1.00 0.00 H new ATOM 15 N PHE A 14 91.750 14.615 15.096 1.00 0.00 N ATOM 16 CA PHE A 14 90.364 14.560 15.550 1.00 0.00 C ATOM 17 C PHE A 14 89.461 13.994 14.458 1.00 0.00 C ATOM 18 O PHE A 14 89.017 12.849 14.536 1.00 0.00 O ATOM 19 CB PHE A 14 89.883 15.956 15.959 1.00 0.00 C ATOM 20 CG PHE A 14 89.289 15.998 17.336 1.00 0.00 C ATOM 21 CD1 PHE A 14 88.020 15.495 17.570 1.00 0.00 C ATOM 22 CD2 PHE A 14 90.002 16.531 18.397 1.00 0.00 C ATOM 23 CE1 PHE A 14 87.472 15.526 18.838 1.00 0.00 C ATOM 24 CE2 PHE A 14 89.459 16.563 19.667 1.00 0.00 C ATOM 25 CZ PHE A 14 88.192 16.060 19.888 1.00 0.00 C ATOM 0 H PHE A 14 91.954 15.385 14.459 1.00 0.00 H new ATOM 0 HA PHE A 14 90.314 13.901 16.417 1.00 0.00 H new ATOM 0 HB2 PHE A 14 90.722 16.650 15.911 1.00 0.00 H new ATOM 0 HB3 PHE A 14 89.141 16.302 15.240 1.00 0.00 H new ATOM 0 HD1 PHE A 14 87.453 15.074 16.753 1.00 0.00 H new ATOM 0 HD2 PHE A 14 90.993 16.926 18.230 1.00 0.00 H new ATOM 0 HE1 PHE A 14 86.481 15.133 19.008 1.00 0.00 H new ATOM 0 HE2 PHE A 14 90.025 16.981 20.486 1.00 0.00 H new ATOM 0 HZ PHE A 14 87.765 16.084 20.880 1.00 0.00 H new ATOM 35 N LEU A 15 89.196 14.803 13.437 1.00 0.00 N ATOM 36 CA LEU A 15 88.348 14.385 12.326 1.00 0.00 C ATOM 37 C LEU A 15 88.983 13.221 11.571 1.00 0.00 C ATOM 38 O LEU A 15 88.328 12.218 11.289 1.00 0.00 O ATOM 39 CB LEU A 15 88.109 15.556 11.371 1.00 0.00 C ATOM 40 CG LEU A 15 87.460 16.788 12.004 1.00 0.00 C ATOM 41 CD1 LEU A 15 87.502 17.967 11.043 1.00 0.00 C ATOM 42 CD2 LEU A 15 86.028 16.483 12.415 1.00 0.00 C ATOM 0 H LEU A 15 89.557 15.754 13.356 1.00 0.00 H new ATOM 0 HA LEU A 15 87.392 14.056 12.732 1.00 0.00 H new ATOM 0 HB2 LEU A 15 89.064 15.851 10.936 1.00 0.00 H new ATOM 0 HB3 LEU A 15 87.478 15.213 10.551 1.00 0.00 H new ATOM 0 HG LEU A 15 88.025 17.054 12.898 1.00 0.00 H new ATOM 0 HD11 LEU A 15 87.036 18.834 11.511 1.00 0.00 H new ATOM 0 HD12 LEU A 15 88.538 18.200 10.798 1.00 0.00 H new ATOM 0 HD13 LEU A 15 86.962 17.712 10.131 1.00 0.00 H new ATOM 0 HD21 LEU A 15 85.581 17.370 12.864 1.00 0.00 H new ATOM 0 HD22 LEU A 15 85.452 16.191 11.537 1.00 0.00 H new ATOM 0 HD23 LEU A 15 86.023 15.669 13.139 1.00 0.00 H new ATOM 54 N THR A 16 90.265 13.364 11.251 1.00 0.00 N ATOM 55 CA THR A 16 90.997 12.330 10.527 1.00 0.00 C ATOM 56 C THR A 16 90.977 11.009 11.289 1.00 0.00 C ATOM 57 O THR A 16 90.997 9.936 10.687 1.00 0.00 O ATOM 58 CB THR A 16 92.442 12.772 10.291 1.00 0.00 C ATOM 59 OG1 THR A 16 92.482 13.999 9.585 1.00 0.00 O ATOM 60 CG2 THR A 16 93.256 11.764 9.507 1.00 0.00 C ATOM 0 H THR A 16 90.820 14.188 11.482 1.00 0.00 H new ATOM 0 HA THR A 16 90.506 12.180 9.566 1.00 0.00 H new ATOM 0 HB THR A 16 92.879 12.874 11.284 1.00 0.00 H new ATOM 0 HG1 THR A 16 93.415 14.266 9.445 1.00 0.00 H new ATOM 0 HG21 THR A 16 94.271 12.140 9.375 1.00 0.00 H new ATOM 0 HG22 THR A 16 93.286 10.819 10.050 1.00 0.00 H new ATOM 0 HG23 THR A 16 92.798 11.606 8.531 1.00 0.00 H new ATOM 68 N GLN A 17 90.940 11.095 12.614 1.00 0.00 N ATOM 69 CA GLN A 17 90.919 9.904 13.455 1.00 0.00 C ATOM 70 C GLN A 17 89.554 9.221 13.424 1.00 0.00 C ATOM 71 O GLN A 17 89.391 8.126 13.960 1.00 0.00 O ATOM 72 CB GLN A 17 91.294 10.262 14.894 1.00 0.00 C ATOM 73 CG GLN A 17 92.589 9.620 15.364 1.00 0.00 C ATOM 74 CD GLN A 17 92.723 9.616 16.874 1.00 0.00 C ATOM 75 OE1 GLN A 17 93.260 10.553 17.464 1.00 0.00 O ATOM 76 NE2 GLN A 17 92.231 8.558 17.507 1.00 0.00 N ATOM 0 H GLN A 17 90.924 11.976 13.128 1.00 0.00 H new ATOM 0 HA GLN A 17 91.654 9.205 13.057 1.00 0.00 H new ATOM 0 HB2 GLN A 17 91.384 11.345 14.978 1.00 0.00 H new ATOM 0 HB3 GLN A 17 90.485 9.957 15.558 1.00 0.00 H new ATOM 0 HG2 GLN A 17 92.637 8.595 14.996 1.00 0.00 H new ATOM 0 HG3 GLN A 17 93.434 10.154 14.929 1.00 0.00 H new ATOM 0 HE21 GLN A 17 91.794 7.804 16.977 1.00 0.00 H new ATOM 0 HE22 GLN A 17 92.290 8.499 18.524 1.00 0.00 H new ATOM 85 N VAL A 18 88.579 9.869 12.793 1.00 0.00 N ATOM 86 CA VAL A 18 87.230 9.318 12.689 1.00 0.00 C ATOM 87 C VAL A 18 86.855 9.087 11.233 1.00 0.00 C ATOM 88 O VAL A 18 86.176 8.116 10.901 1.00 0.00 O ATOM 89 CB VAL A 18 86.190 10.253 13.331 1.00 0.00 C ATOM 90 CG1 VAL A 18 84.820 9.590 13.363 1.00 0.00 C ATOM 91 CG2 VAL A 18 86.628 10.663 14.731 1.00 0.00 C ATOM 0 H VAL A 18 88.698 10.778 12.345 1.00 0.00 H new ATOM 0 HA VAL A 18 87.229 8.368 13.224 1.00 0.00 H new ATOM 0 HB VAL A 18 86.116 11.154 12.722 1.00 0.00 H new ATOM 0 HG11 VAL A 18 84.099 10.267 13.821 1.00 0.00 H new ATOM 0 HG12 VAL A 18 84.505 9.357 12.346 1.00 0.00 H new ATOM 0 HG13 VAL A 18 84.874 8.670 13.945 1.00 0.00 H new ATOM 0 HG21 VAL A 18 85.879 11.324 15.168 1.00 0.00 H new ATOM 0 HG22 VAL A 18 86.735 9.775 15.353 1.00 0.00 H new ATOM 0 HG23 VAL A 18 87.584 11.184 14.675 1.00 0.00 H new ATOM 101 N LYS A 19 87.316 9.980 10.365 1.00 0.00 N ATOM 102 CA LYS A 19 87.040 9.870 8.940 1.00 0.00 C ATOM 103 C LYS A 19 87.813 8.702 8.355 1.00 0.00 C ATOM 104 O LYS A 19 87.230 7.706 7.928 1.00 0.00 O ATOM 105 CB LYS A 19 87.432 11.162 8.226 1.00 0.00 C ATOM 106 CG LYS A 19 86.246 11.941 7.679 1.00 0.00 C ATOM 107 CD LYS A 19 85.748 12.974 8.679 1.00 0.00 C ATOM 108 CE LYS A 19 84.234 12.936 8.819 1.00 0.00 C ATOM 109 NZ LYS A 19 83.605 14.221 8.407 1.00 0.00 N ATOM 0 H LYS A 19 87.882 10.788 10.624 1.00 0.00 H new ATOM 0 HA LYS A 19 85.973 9.700 8.799 1.00 0.00 H new ATOM 0 HB2 LYS A 19 87.984 11.797 8.919 1.00 0.00 H new ATOM 0 HB3 LYS A 19 88.108 10.923 7.405 1.00 0.00 H new ATOM 0 HG2 LYS A 19 86.532 12.439 6.752 1.00 0.00 H new ATOM 0 HG3 LYS A 19 85.438 11.251 7.434 1.00 0.00 H new ATOM 0 HD2 LYS A 19 86.208 12.792 9.650 1.00 0.00 H new ATOM 0 HD3 LYS A 19 86.059 13.969 8.360 1.00 0.00 H new ATOM 0 HE2 LYS A 19 83.834 12.125 8.211 1.00 0.00 H new ATOM 0 HE3 LYS A 19 83.971 12.719 9.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 82.573 14.154 8.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 83.967 14.992 9.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 83.835 14.416 7.412 1.00 0.00 H new ATOM 123 N GLU A 20 89.134 8.827 8.363 1.00 0.00 N ATOM 124 CA GLU A 20 89.997 7.772 7.855 1.00 0.00 C ATOM 125 C GLU A 20 89.764 6.485 8.636 1.00 0.00 C ATOM 126 O GLU A 20 90.062 5.392 8.157 1.00 0.00 O ATOM 127 CB GLU A 20 91.466 8.189 7.948 1.00 0.00 C ATOM 128 CG GLU A 20 91.902 9.126 6.832 1.00 0.00 C ATOM 129 CD GLU A 20 93.035 8.556 5.999 1.00 0.00 C ATOM 130 OE1 GLU A 20 92.891 7.420 5.499 1.00 0.00 O ATOM 131 OE2 GLU A 20 94.065 9.246 5.846 1.00 0.00 O ATOM 0 H GLU A 20 89.629 9.647 8.715 1.00 0.00 H new ATOM 0 HA GLU A 20 89.754 7.598 6.807 1.00 0.00 H new ATOM 0 HB2 GLU A 20 91.637 8.676 8.908 1.00 0.00 H new ATOM 0 HB3 GLU A 20 92.091 7.296 7.927 1.00 0.00 H new ATOM 0 HG2 GLU A 20 91.050 9.335 6.185 1.00 0.00 H new ATOM 0 HG3 GLU A 20 92.216 10.077 7.263 1.00 0.00 H new ATOM 138 N SER A 21 89.217 6.623 9.843 1.00 0.00 N ATOM 139 CA SER A 21 88.930 5.480 10.685 1.00 0.00 C ATOM 140 C SER A 21 87.741 4.704 10.137 1.00 0.00 C ATOM 141 O SER A 21 87.838 3.509 9.860 1.00 0.00 O ATOM 142 CB SER A 21 88.642 5.960 12.101 1.00 0.00 C ATOM 143 OG SER A 21 89.398 5.236 13.055 1.00 0.00 O ATOM 0 H SER A 21 88.966 7.522 10.254 1.00 0.00 H new ATOM 0 HA SER A 21 89.794 4.815 10.698 1.00 0.00 H new ATOM 0 HB2 SER A 21 88.873 7.022 12.181 1.00 0.00 H new ATOM 0 HB3 SER A 21 87.579 5.848 12.316 1.00 0.00 H new ATOM 0 HG SER A 21 89.733 5.850 13.741 1.00 0.00 H new ATOM 149 N LEU A 22 86.621 5.398 9.970 1.00 0.00 N ATOM 150 CA LEU A 22 85.417 4.777 9.441 1.00 0.00 C ATOM 151 C LEU A 22 85.639 4.358 7.996 1.00 0.00 C ATOM 152 O LEU A 22 85.176 3.303 7.566 1.00 0.00 O ATOM 153 CB LEU A 22 84.230 5.737 9.536 1.00 0.00 C ATOM 154 CG LEU A 22 82.881 5.133 9.143 1.00 0.00 C ATOM 155 CD1 LEU A 22 82.204 4.506 10.351 1.00 0.00 C ATOM 156 CD2 LEU A 22 81.986 6.193 8.517 1.00 0.00 C ATOM 0 H LEU A 22 86.524 6.388 10.193 1.00 0.00 H new ATOM 0 HA LEU A 22 85.192 3.892 10.036 1.00 0.00 H new ATOM 0 HB2 LEU A 22 84.162 6.107 10.559 1.00 0.00 H new ATOM 0 HB3 LEU A 22 84.426 6.598 8.898 1.00 0.00 H new ATOM 0 HG LEU A 22 83.056 4.350 8.405 1.00 0.00 H new ATOM 0 HD11 LEU A 22 81.246 4.082 10.052 1.00 0.00 H new ATOM 0 HD12 LEU A 22 82.839 3.718 10.756 1.00 0.00 H new ATOM 0 HD13 LEU A 22 82.041 5.268 11.113 1.00 0.00 H new ATOM 0 HD21 LEU A 22 81.030 5.747 8.243 1.00 0.00 H new ATOM 0 HD22 LEU A 22 81.819 6.997 9.233 1.00 0.00 H new ATOM 0 HD23 LEU A 22 82.467 6.595 7.626 1.00 0.00 H new ATOM 168 N SER A 23 86.362 5.188 7.254 1.00 0.00 N ATOM 169 CA SER A 23 86.659 4.898 5.859 1.00 0.00 C ATOM 170 C SER A 23 87.605 3.711 5.759 1.00 0.00 C ATOM 171 O SER A 23 87.506 2.902 4.839 1.00 0.00 O ATOM 172 CB SER A 23 87.272 6.121 5.174 1.00 0.00 C ATOM 173 OG SER A 23 86.511 6.506 4.042 1.00 0.00 O ATOM 0 H SER A 23 86.753 6.066 7.596 1.00 0.00 H new ATOM 0 HA SER A 23 85.727 4.649 5.352 1.00 0.00 H new ATOM 0 HB2 SER A 23 87.324 6.950 5.880 1.00 0.00 H new ATOM 0 HB3 SER A 23 88.294 5.897 4.870 1.00 0.00 H new ATOM 0 HG SER A 23 86.922 7.291 3.623 1.00 0.00 H new ATOM 178 N SER A 24 88.514 3.609 6.722 1.00 0.00 N ATOM 179 CA SER A 24 89.475 2.516 6.751 1.00 0.00 C ATOM 180 C SER A 24 88.761 1.178 6.862 1.00 0.00 C ATOM 181 O SER A 24 89.184 0.185 6.268 1.00 0.00 O ATOM 182 CB SER A 24 90.439 2.679 7.920 1.00 0.00 C ATOM 183 OG SER A 24 91.539 3.500 7.567 1.00 0.00 O ATOM 0 H SER A 24 88.605 4.271 7.493 1.00 0.00 H new ATOM 0 HA SER A 24 90.040 2.541 5.819 1.00 0.00 H new ATOM 0 HB2 SER A 24 89.914 3.116 8.770 1.00 0.00 H new ATOM 0 HB3 SER A 24 90.799 1.700 8.237 1.00 0.00 H new ATOM 0 HG SER A 24 91.363 4.422 7.849 1.00 0.00 H new ATOM 189 N TYR A 25 87.666 1.157 7.618 1.00 0.00 N ATOM 190 CA TYR A 25 86.885 -0.049 7.797 1.00 0.00 C ATOM 191 C TYR A 25 86.514 -0.630 6.442 1.00 0.00 C ATOM 192 O TYR A 25 86.514 -1.845 6.245 1.00 0.00 O ATOM 193 CB TYR A 25 85.636 0.293 8.595 1.00 0.00 C ATOM 194 CG TYR A 25 85.314 -0.701 9.689 1.00 0.00 C ATOM 195 CD1 TYR A 25 85.206 -2.058 9.412 1.00 0.00 C ATOM 196 CD2 TYR A 25 85.117 -0.280 10.997 1.00 0.00 C ATOM 197 CE1 TYR A 25 84.911 -2.968 10.410 1.00 0.00 C ATOM 198 CE2 TYR A 25 84.823 -1.184 12.000 1.00 0.00 C ATOM 199 CZ TYR A 25 84.721 -2.526 11.701 1.00 0.00 C ATOM 200 OH TYR A 25 84.428 -3.428 12.698 1.00 0.00 O ATOM 0 H TYR A 25 87.304 1.970 8.116 1.00 0.00 H new ATOM 0 HA TYR A 25 87.466 -0.795 8.339 1.00 0.00 H new ATOM 0 HB2 TYR A 25 85.761 1.280 9.040 1.00 0.00 H new ATOM 0 HB3 TYR A 25 84.788 0.355 7.914 1.00 0.00 H new ATOM 0 HD1 TYR A 25 85.355 -2.408 8.401 1.00 0.00 H new ATOM 0 HD2 TYR A 25 85.195 0.771 11.235 1.00 0.00 H new ATOM 0 HE1 TYR A 25 84.830 -4.020 10.179 1.00 0.00 H new ATOM 0 HE2 TYR A 25 84.674 -0.841 13.013 1.00 0.00 H new ATOM 0 HH TYR A 25 84.326 -2.953 13.549 1.00 0.00 H new ATOM 210 N TRP A 26 86.212 0.263 5.507 1.00 0.00 N ATOM 211 CA TRP A 26 85.848 -0.131 4.152 1.00 0.00 C ATOM 212 C TRP A 26 87.041 0.007 3.206 1.00 0.00 C ATOM 213 O TRP A 26 87.037 -0.549 2.108 1.00 0.00 O ATOM 214 CB TRP A 26 84.686 0.726 3.646 1.00 0.00 C ATOM 215 CG TRP A 26 83.346 0.222 4.086 1.00 0.00 C ATOM 216 CD1 TRP A 26 82.544 -0.660 3.422 1.00 0.00 C ATOM 217 CD2 TRP A 26 82.654 0.567 5.291 1.00 0.00 C ATOM 218 NE1 TRP A 26 81.395 -0.887 4.141 1.00 0.00 N ATOM 219 CE2 TRP A 26 81.439 -0.145 5.293 1.00 0.00 C ATOM 220 CE3 TRP A 26 82.944 1.406 6.369 1.00 0.00 C ATOM 221 CZ2 TRP A 26 80.517 -0.040 6.331 1.00 0.00 C ATOM 222 CZ3 TRP A 26 82.028 1.509 7.399 1.00 0.00 C ATOM 223 CH2 TRP A 26 80.827 0.788 7.373 1.00 0.00 C ATOM 0 H TRP A 26 86.212 1.271 5.664 1.00 0.00 H new ATOM 0 HA TRP A 26 85.541 -1.177 4.174 1.00 0.00 H new ATOM 0 HB2 TRP A 26 84.816 1.749 4.000 1.00 0.00 H new ATOM 0 HB3 TRP A 26 84.715 0.759 2.557 1.00 0.00 H new ATOM 0 HD1 TRP A 26 82.778 -1.114 2.470 1.00 0.00 H new ATOM 0 HE1 TRP A 26 80.634 -1.506 3.863 1.00 0.00 H new ATOM 0 HE3 TRP A 26 83.868 1.965 6.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 79.590 -0.593 6.313 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 82.242 2.156 8.237 1.00 0.00 H new ATOM 0 HH2 TRP A 26 80.132 0.889 8.193 1.00 0.00 H new ATOM 234 N GLU A 27 88.060 0.752 3.633 1.00 0.00 N ATOM 235 CA GLU A 27 89.249 0.959 2.813 1.00 0.00 C ATOM 236 C GLU A 27 90.032 -0.337 2.649 1.00 0.00 C ATOM 237 O GLU A 27 90.530 -0.638 1.564 1.00 0.00 O ATOM 238 CB GLU A 27 90.147 2.032 3.432 1.00 0.00 C ATOM 239 CG GLU A 27 91.015 2.760 2.421 1.00 0.00 C ATOM 240 CD GLU A 27 91.417 4.145 2.890 1.00 0.00 C ATOM 241 OE1 GLU A 27 91.848 4.275 4.055 1.00 0.00 O ATOM 242 OE2 GLU A 27 91.300 5.100 2.093 1.00 0.00 O ATOM 0 H GLU A 27 88.085 1.220 4.539 1.00 0.00 H new ATOM 0 HA GLU A 27 88.921 1.293 1.829 1.00 0.00 H new ATOM 0 HB2 GLU A 27 89.523 2.759 3.952 1.00 0.00 H new ATOM 0 HB3 GLU A 27 90.789 1.568 4.181 1.00 0.00 H new ATOM 0 HG2 GLU A 27 91.912 2.172 2.226 1.00 0.00 H new ATOM 0 HG3 GLU A 27 90.476 2.842 1.477 1.00 0.00 H new ATOM 249 N SER A 28 90.131 -1.106 3.728 1.00 0.00 N ATOM 250 CA SER A 28 90.850 -2.371 3.690 1.00 0.00 C ATOM 251 C SER A 28 90.164 -3.334 2.736 1.00 0.00 C ATOM 252 O SER A 28 90.821 -4.046 1.975 1.00 0.00 O ATOM 253 CB SER A 28 90.940 -2.979 5.089 1.00 0.00 C ATOM 254 OG SER A 28 90.991 -4.396 5.037 1.00 0.00 O ATOM 0 H SER A 28 89.724 -0.876 4.635 1.00 0.00 H new ATOM 0 HA SER A 28 91.863 -2.185 3.332 1.00 0.00 H new ATOM 0 HB2 SER A 28 91.828 -2.600 5.595 1.00 0.00 H new ATOM 0 HB3 SER A 28 90.079 -2.666 5.679 1.00 0.00 H new ATOM 0 HG SER A 28 91.050 -4.755 5.947 1.00 0.00 H new ATOM 260 N ALA A 29 88.836 -3.332 2.758 1.00 0.00 N ATOM 261 CA ALA A 29 88.068 -4.189 1.870 1.00 0.00 C ATOM 262 C ALA A 29 88.361 -3.800 0.432 1.00 0.00 C ATOM 263 O ALA A 29 88.450 -4.650 -0.454 1.00 0.00 O ATOM 264 CB ALA A 29 86.580 -4.077 2.167 1.00 0.00 C ATOM 0 H ALA A 29 88.274 -2.749 3.378 1.00 0.00 H new ATOM 0 HA ALA A 29 88.358 -5.228 2.029 1.00 0.00 H new ATOM 0 HB1 ALA A 29 86.024 -4.727 1.491 1.00 0.00 H new ATOM 0 HB2 ALA A 29 86.391 -4.379 3.197 1.00 0.00 H new ATOM 0 HB3 ALA A 29 86.257 -3.045 2.026 1.00 0.00 H new ATOM 270 N LYS A 30 88.545 -2.500 0.223 1.00 0.00 N ATOM 271 CA LYS A 30 88.864 -1.969 -1.094 1.00 0.00 C ATOM 272 C LYS A 30 90.326 -2.246 -1.423 1.00 0.00 C ATOM 273 O LYS A 30 90.698 -2.382 -2.589 1.00 0.00 O ATOM 274 CB LYS A 30 88.586 -0.464 -1.142 1.00 0.00 C ATOM 275 CG LYS A 30 87.447 -0.084 -2.073 1.00 0.00 C ATOM 276 CD LYS A 30 86.751 1.188 -1.612 1.00 0.00 C ATOM 277 CE LYS A 30 85.431 0.883 -0.923 1.00 0.00 C ATOM 278 NZ LYS A 30 84.735 2.123 -0.480 1.00 0.00 N ATOM 0 H LYS A 30 88.478 -1.793 0.955 1.00 0.00 H new ATOM 0 HA LYS A 30 88.234 -2.461 -1.835 1.00 0.00 H new ATOM 0 HB2 LYS A 30 88.354 -0.114 -0.136 1.00 0.00 H new ATOM 0 HB3 LYS A 30 89.491 0.054 -1.459 1.00 0.00 H new ATOM 0 HG2 LYS A 30 87.833 0.056 -3.083 1.00 0.00 H new ATOM 0 HG3 LYS A 30 86.725 -0.899 -2.118 1.00 0.00 H new ATOM 0 HD2 LYS A 30 87.402 1.733 -0.928 1.00 0.00 H new ATOM 0 HD3 LYS A 30 86.574 1.838 -2.469 1.00 0.00 H new ATOM 0 HE2 LYS A 30 84.786 0.328 -1.604 1.00 0.00 H new ATOM 0 HE3 LYS A 30 85.612 0.241 -0.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 83.839 1.871 -0.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 85.340 2.640 0.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 84.539 2.725 -1.305 1.00 0.00 H new ATOM 292 N THR A 31 91.147 -2.343 -0.380 1.00 0.00 N ATOM 293 CA THR A 31 92.563 -2.618 -0.542 1.00 0.00 C ATOM 294 C THR A 31 92.772 -4.074 -0.934 1.00 0.00 C ATOM 295 O THR A 31 93.311 -4.371 -2.001 1.00 0.00 O ATOM 296 CB THR A 31 93.294 -2.325 0.761 1.00 0.00 C ATOM 297 OG1 THR A 31 93.223 -0.948 1.083 1.00 0.00 O ATOM 298 CG2 THR A 31 94.752 -2.718 0.734 1.00 0.00 C ATOM 0 H THR A 31 90.849 -2.234 0.589 1.00 0.00 H new ATOM 0 HA THR A 31 92.961 -1.980 -1.331 1.00 0.00 H new ATOM 0 HB THR A 31 92.788 -2.930 1.513 1.00 0.00 H new ATOM 0 HG1 THR A 31 92.294 -0.705 1.278 1.00 0.00 H new ATOM 0 HG21 THR A 31 95.211 -2.481 1.694 1.00 0.00 H new ATOM 0 HG22 THR A 31 94.837 -3.788 0.546 1.00 0.00 H new ATOM 0 HG23 THR A 31 95.262 -2.169 -0.057 1.00 0.00 H new ATOM 306 N ALA A 32 92.329 -4.978 -0.065 1.00 0.00 N ATOM 307 CA ALA A 32 92.451 -6.405 -0.325 1.00 0.00 C ATOM 308 C ALA A 32 91.796 -6.745 -1.654 1.00 0.00 C ATOM 309 O ALA A 32 92.165 -7.715 -2.316 1.00 0.00 O ATOM 310 CB ALA A 32 91.823 -7.207 0.803 1.00 0.00 C ATOM 0 H ALA A 32 91.884 -4.746 0.823 1.00 0.00 H new ATOM 0 HA ALA A 32 93.508 -6.666 -0.378 1.00 0.00 H new ATOM 0 HB1 ALA A 32 91.923 -8.272 0.592 1.00 0.00 H new ATOM 0 HB2 ALA A 32 92.328 -6.974 1.740 1.00 0.00 H new ATOM 0 HB3 ALA A 32 90.767 -6.952 0.887 1.00 0.00 H new ATOM 316 N ALA A 33 90.831 -5.918 -2.044 1.00 0.00 N ATOM 317 CA ALA A 33 90.125 -6.105 -3.300 1.00 0.00 C ATOM 318 C ALA A 33 90.981 -5.622 -4.461 1.00 0.00 C ATOM 319 O ALA A 33 91.075 -6.282 -5.493 1.00 0.00 O ATOM 320 CB ALA A 33 88.797 -5.361 -3.277 1.00 0.00 C ATOM 0 H ALA A 33 90.522 -5.110 -1.504 1.00 0.00 H new ATOM 0 HA ALA A 33 89.924 -7.168 -3.432 1.00 0.00 H new ATOM 0 HB1 ALA A 33 88.280 -5.511 -4.225 1.00 0.00 H new ATOM 0 HB2 ALA A 33 88.180 -5.742 -2.463 1.00 0.00 H new ATOM 0 HB3 ALA A 33 88.979 -4.297 -3.127 1.00 0.00 H new ATOM 326 N GLN A 34 91.617 -4.470 -4.278 1.00 0.00 N ATOM 327 CA GLN A 34 92.475 -3.902 -5.312 1.00 0.00 C ATOM 328 C GLN A 34 93.662 -4.819 -5.590 1.00 0.00 C ATOM 329 O GLN A 34 94.105 -4.962 -6.726 1.00 0.00 O ATOM 330 CB GLN A 34 92.970 -2.518 -4.886 1.00 0.00 C ATOM 331 CG GLN A 34 92.808 -1.452 -5.957 1.00 0.00 C ATOM 332 CD GLN A 34 92.954 -0.047 -5.405 1.00 0.00 C ATOM 333 OE1 GLN A 34 93.928 0.264 -4.720 1.00 0.00 O ATOM 334 NE2 GLN A 34 91.984 0.810 -5.701 1.00 0.00 N ATOM 0 H GLN A 34 91.555 -3.912 -3.426 1.00 0.00 H new ATOM 0 HA GLN A 34 91.891 -3.804 -6.227 1.00 0.00 H new ATOM 0 HB2 GLN A 34 92.428 -2.208 -3.993 1.00 0.00 H new ATOM 0 HB3 GLN A 34 94.023 -2.587 -4.612 1.00 0.00 H new ATOM 0 HG2 GLN A 34 93.551 -1.611 -6.738 1.00 0.00 H new ATOM 0 HG3 GLN A 34 91.828 -1.556 -6.423 1.00 0.00 H new ATOM 0 HE21 GLN A 34 91.194 0.509 -6.272 1.00 0.00 H new ATOM 0 HE22 GLN A 34 92.028 1.769 -5.357 1.00 0.00 H new ATOM 343 N ASN A 35 94.175 -5.436 -4.539 1.00 0.00 N ATOM 344 CA ASN A 35 95.309 -6.327 -4.654 1.00 0.00 C ATOM 345 C ASN A 35 95.005 -7.508 -5.575 1.00 0.00 C ATOM 346 O ASN A 35 95.742 -7.779 -6.521 1.00 0.00 O ATOM 347 CB ASN A 35 95.682 -6.823 -3.262 1.00 0.00 C ATOM 348 CG ASN A 35 97.160 -6.667 -2.961 1.00 0.00 C ATOM 349 OD1 ASN A 35 97.738 -5.600 -3.164 1.00 0.00 O ATOM 350 ND2 ASN A 35 97.779 -7.734 -2.468 1.00 0.00 N ATOM 0 H ASN A 35 93.817 -5.332 -3.589 1.00 0.00 H new ATOM 0 HA ASN A 35 96.143 -5.782 -5.095 1.00 0.00 H new ATOM 0 HB2 ASN A 35 95.104 -6.274 -2.518 1.00 0.00 H new ATOM 0 HB3 ASN A 35 95.405 -7.873 -3.169 1.00 0.00 H new ATOM 0 HD21 ASN A 35 98.773 -7.688 -2.242 1.00 0.00 H new ATOM 0 HD22 ASN A 35 97.261 -8.599 -2.315 1.00 0.00 H new ATOM 357 N LEU A 36 93.932 -8.225 -5.277 1.00 0.00 N ATOM 358 CA LEU A 36 93.549 -9.389 -6.048 1.00 0.00 C ATOM 359 C LEU A 36 92.848 -9.032 -7.363 1.00 0.00 C ATOM 360 O LEU A 36 92.915 -9.796 -8.326 1.00 0.00 O ATOM 361 CB LEU A 36 92.634 -10.242 -5.183 1.00 0.00 C ATOM 362 CG LEU A 36 93.072 -11.697 -5.003 1.00 0.00 C ATOM 363 CD1 LEU A 36 92.668 -12.213 -3.628 1.00 0.00 C ATOM 364 CD2 LEU A 36 92.479 -12.568 -6.100 1.00 0.00 C ATOM 0 H LEU A 36 93.308 -8.015 -4.498 1.00 0.00 H new ATOM 0 HA LEU A 36 94.453 -9.931 -6.325 1.00 0.00 H new ATOM 0 HB2 LEU A 36 92.556 -9.779 -4.199 1.00 0.00 H new ATOM 0 HB3 LEU A 36 91.635 -10.232 -5.620 1.00 0.00 H new ATOM 0 HG LEU A 36 94.159 -11.743 -5.077 1.00 0.00 H new ATOM 0 HD11 LEU A 36 92.988 -13.249 -3.520 1.00 0.00 H new ATOM 0 HD12 LEU A 36 93.141 -11.604 -2.857 1.00 0.00 H new ATOM 0 HD13 LEU A 36 91.585 -12.155 -3.522 1.00 0.00 H new ATOM 0 HD21 LEU A 36 92.800 -13.600 -5.958 1.00 0.00 H new ATOM 0 HD22 LEU A 36 91.391 -12.517 -6.057 1.00 0.00 H new ATOM 0 HD23 LEU A 36 92.821 -12.212 -7.072 1.00 0.00 H new ATOM 376 N TYR A 37 92.150 -7.896 -7.398 1.00 0.00 N ATOM 377 CA TYR A 37 91.410 -7.498 -8.604 1.00 0.00 C ATOM 378 C TYR A 37 92.097 -6.392 -9.409 1.00 0.00 C ATOM 379 O TYR A 37 91.585 -5.982 -10.451 1.00 0.00 O ATOM 380 CB TYR A 37 90.005 -7.039 -8.224 1.00 0.00 C ATOM 381 CG TYR A 37 89.019 -8.177 -8.119 1.00 0.00 C ATOM 382 CD1 TYR A 37 88.308 -8.608 -9.232 1.00 0.00 C ATOM 383 CD2 TYR A 37 88.813 -8.834 -6.913 1.00 0.00 C ATOM 384 CE1 TYR A 37 87.418 -9.664 -9.145 1.00 0.00 C ATOM 385 CE2 TYR A 37 87.924 -9.887 -6.817 1.00 0.00 C ATOM 386 CZ TYR A 37 87.230 -10.299 -7.935 1.00 0.00 C ATOM 387 OH TYR A 37 86.347 -11.350 -7.844 1.00 0.00 O ATOM 0 H TYR A 37 92.079 -7.241 -6.619 1.00 0.00 H new ATOM 0 HA TYR A 37 91.373 -8.381 -9.242 1.00 0.00 H new ATOM 0 HB2 TYR A 37 90.047 -6.513 -7.270 1.00 0.00 H new ATOM 0 HB3 TYR A 37 89.649 -6.325 -8.967 1.00 0.00 H new ATOM 0 HD1 TYR A 37 88.452 -8.111 -10.180 1.00 0.00 H new ATOM 0 HD2 TYR A 37 89.357 -8.516 -6.036 1.00 0.00 H new ATOM 0 HE1 TYR A 37 86.874 -9.989 -10.019 1.00 0.00 H new ATOM 0 HE2 TYR A 37 87.773 -10.385 -5.871 1.00 0.00 H new ATOM 0 HH TYR A 37 86.333 -11.686 -6.924 1.00 0.00 H new ATOM 397 N GLU A 38 93.239 -5.905 -8.943 1.00 0.00 N ATOM 398 CA GLU A 38 93.948 -4.845 -9.666 1.00 0.00 C ATOM 399 C GLU A 38 95.445 -5.112 -9.761 1.00 0.00 C ATOM 400 O GLU A 38 95.968 -5.365 -10.846 1.00 0.00 O ATOM 401 CB GLU A 38 93.699 -3.477 -9.021 1.00 0.00 C ATOM 402 CG GLU A 38 92.301 -2.938 -9.267 1.00 0.00 C ATOM 403 CD GLU A 38 91.997 -2.780 -10.743 1.00 0.00 C ATOM 404 OE1 GLU A 38 92.955 -2.642 -11.534 1.00 0.00 O ATOM 405 OE2 GLU A 38 90.804 -2.795 -11.110 1.00 0.00 O ATOM 0 H GLU A 38 93.692 -6.216 -8.084 1.00 0.00 H new ATOM 0 HA GLU A 38 93.548 -4.838 -10.680 1.00 0.00 H new ATOM 0 HB2 GLU A 38 93.866 -3.555 -7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 38 94.428 -2.764 -9.406 1.00 0.00 H new ATOM 0 HG2 GLU A 38 91.570 -3.611 -8.818 1.00 0.00 H new ATOM 0 HG3 GLU A 38 92.193 -1.973 -8.771 1.00 0.00 H new ATOM 412 N LYS A 39 96.136 -5.038 -8.632 1.00 0.00 N ATOM 413 CA LYS A 39 97.580 -5.258 -8.619 1.00 0.00 C ATOM 414 C LYS A 39 97.937 -6.669 -9.089 1.00 0.00 C ATOM 415 O LYS A 39 99.058 -6.918 -9.532 1.00 0.00 O ATOM 416 CB LYS A 39 98.160 -4.981 -7.222 1.00 0.00 C ATOM 417 CG LYS A 39 98.263 -6.204 -6.321 1.00 0.00 C ATOM 418 CD LYS A 39 99.679 -6.757 -6.280 1.00 0.00 C ATOM 419 CE LYS A 39 99.725 -8.102 -5.568 1.00 0.00 C ATOM 420 NZ LYS A 39 101.122 -8.582 -5.366 1.00 0.00 N ATOM 0 H LYS A 39 95.728 -4.830 -7.721 1.00 0.00 H new ATOM 0 HA LYS A 39 98.028 -4.556 -9.322 1.00 0.00 H new ATOM 0 HB2 LYS A 39 99.153 -4.546 -7.336 1.00 0.00 H new ATOM 0 HB3 LYS A 39 97.539 -4.234 -6.728 1.00 0.00 H new ATOM 0 HG2 LYS A 39 97.946 -5.940 -5.312 1.00 0.00 H new ATOM 0 HG3 LYS A 39 97.581 -6.976 -6.677 1.00 0.00 H new ATOM 0 HD2 LYS A 39 100.059 -6.867 -7.296 1.00 0.00 H new ATOM 0 HD3 LYS A 39 100.334 -6.050 -5.770 1.00 0.00 H new ATOM 0 HE2 LYS A 39 99.228 -8.017 -4.602 1.00 0.00 H new ATOM 0 HE3 LYS A 39 99.170 -8.838 -6.149 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 101.106 -9.500 -4.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 101.589 -8.688 -6.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 101.646 -7.893 -4.790 1.00 0.00 H new ATOM 434 N THR A 40 96.983 -7.590 -8.988 1.00 0.00 N ATOM 435 CA THR A 40 97.205 -8.968 -9.397 1.00 0.00 C ATOM 436 C THR A 40 96.643 -9.239 -10.796 1.00 0.00 C ATOM 437 O THR A 40 96.924 -10.280 -11.392 1.00 0.00 O ATOM 438 CB THR A 40 96.564 -9.916 -8.385 1.00 0.00 C ATOM 439 OG1 THR A 40 97.167 -9.773 -7.109 1.00 0.00 O ATOM 440 CG2 THR A 40 96.661 -11.371 -8.779 1.00 0.00 C ATOM 0 H THR A 40 96.048 -7.404 -8.625 1.00 0.00 H new ATOM 0 HA THR A 40 98.281 -9.140 -9.432 1.00 0.00 H new ATOM 0 HB THR A 40 95.511 -9.636 -8.357 1.00 0.00 H new ATOM 0 HG1 THR A 40 96.594 -9.221 -6.537 1.00 0.00 H new ATOM 0 HG21 THR A 40 96.186 -11.987 -8.016 1.00 0.00 H new ATOM 0 HG22 THR A 40 96.158 -11.524 -9.734 1.00 0.00 H new ATOM 0 HG23 THR A 40 97.710 -11.654 -8.872 1.00 0.00 H new ATOM 448 N TYR A 41 95.837 -8.313 -11.309 1.00 0.00 N ATOM 449 CA TYR A 41 95.236 -8.470 -12.626 1.00 0.00 C ATOM 450 C TYR A 41 96.260 -8.258 -13.739 1.00 0.00 C ATOM 451 O TYR A 41 96.731 -9.217 -14.350 1.00 0.00 O ATOM 452 CB TYR A 41 94.067 -7.497 -12.784 1.00 0.00 C ATOM 453 CG TYR A 41 92.805 -8.139 -13.315 1.00 0.00 C ATOM 454 CD1 TYR A 41 92.737 -8.603 -14.622 1.00 0.00 C ATOM 455 CD2 TYR A 41 91.680 -8.274 -12.513 1.00 0.00 C ATOM 456 CE1 TYR A 41 91.585 -9.184 -15.114 1.00 0.00 C ATOM 457 CE2 TYR A 41 90.524 -8.854 -12.997 1.00 0.00 C ATOM 458 CZ TYR A 41 90.481 -9.308 -14.297 1.00 0.00 C ATOM 459 OH TYR A 41 89.331 -9.885 -14.784 1.00 0.00 O ATOM 0 H TYR A 41 95.586 -7.447 -10.831 1.00 0.00 H new ATOM 0 HA TYR A 41 94.867 -9.492 -12.710 1.00 0.00 H new ATOM 0 HB2 TYR A 41 93.853 -7.042 -11.817 1.00 0.00 H new ATOM 0 HB3 TYR A 41 94.365 -6.692 -13.456 1.00 0.00 H new ATOM 0 HD1 TYR A 41 93.600 -8.508 -15.265 1.00 0.00 H new ATOM 0 HD2 TYR A 41 91.709 -7.919 -11.493 1.00 0.00 H new ATOM 0 HE1 TYR A 41 91.549 -9.539 -16.133 1.00 0.00 H new ATOM 0 HE2 TYR A 41 89.658 -8.951 -12.359 1.00 0.00 H new ATOM 0 HH TYR A 41 88.648 -9.897 -14.081 1.00 0.00 H new ATOM 469 N LEU A 42 96.592 -7.001 -14.005 1.00 0.00 N ATOM 470 CA LEU A 42 97.551 -6.669 -15.052 1.00 0.00 C ATOM 471 C LEU A 42 98.955 -6.471 -14.477 1.00 0.00 C ATOM 472 O LEU A 42 99.866 -7.239 -14.784 1.00 0.00 O ATOM 473 CB LEU A 42 97.092 -5.418 -15.809 1.00 0.00 C ATOM 474 CG LEU A 42 98.205 -4.606 -16.477 1.00 0.00 C ATOM 475 CD1 LEU A 42 98.927 -5.447 -17.516 1.00 0.00 C ATOM 476 CD2 LEU A 42 97.637 -3.344 -17.108 1.00 0.00 C ATOM 0 H LEU A 42 96.211 -6.194 -13.510 1.00 0.00 H new ATOM 0 HA LEU A 42 97.597 -7.505 -15.750 1.00 0.00 H new ATOM 0 HB2 LEU A 42 96.377 -5.720 -16.574 1.00 0.00 H new ATOM 0 HB3 LEU A 42 96.560 -4.769 -15.114 1.00 0.00 H new ATOM 0 HG LEU A 42 98.926 -4.313 -15.713 1.00 0.00 H new ATOM 0 HD11 LEU A 42 99.715 -4.854 -17.981 1.00 0.00 H new ATOM 0 HD12 LEU A 42 99.366 -6.321 -17.035 1.00 0.00 H new ATOM 0 HD13 LEU A 42 98.219 -5.770 -18.279 1.00 0.00 H new ATOM 0 HD21 LEU A 42 98.441 -2.779 -17.578 1.00 0.00 H new ATOM 0 HD22 LEU A 42 96.896 -3.615 -17.860 1.00 0.00 H new ATOM 0 HD23 LEU A 42 97.166 -2.733 -16.338 1.00 0.00 H new ATOM 488 N PRO A 43 99.159 -5.435 -13.639 1.00 0.00 N ATOM 489 CA PRO A 43 100.470 -5.159 -13.044 1.00 0.00 C ATOM 490 C PRO A 43 100.881 -6.220 -12.027 1.00 0.00 C ATOM 491 O PRO A 43 101.083 -5.924 -10.849 1.00 0.00 O ATOM 492 CB PRO A 43 100.278 -3.803 -12.362 1.00 0.00 C ATOM 493 CG PRO A 43 98.816 -3.714 -12.094 1.00 0.00 C ATOM 494 CD PRO A 43 98.142 -4.455 -13.215 1.00 0.00 C ATOM 0 HA PRO A 43 101.264 -5.162 -13.791 1.00 0.00 H new ATOM 0 HB2 PRO A 43 100.854 -3.740 -11.439 1.00 0.00 H new ATOM 0 HB3 PRO A 43 100.613 -2.987 -13.003 1.00 0.00 H new ATOM 0 HG2 PRO A 43 98.569 -4.157 -11.129 1.00 0.00 H new ATOM 0 HG3 PRO A 43 98.488 -2.675 -12.061 1.00 0.00 H new ATOM 0 HD2 PRO A 43 97.228 -4.945 -12.880 1.00 0.00 H new ATOM 0 HD3 PRO A 43 97.865 -3.786 -14.030 1.00 0.00 H new ATOM 502 N ALA A 44 101.009 -7.456 -12.497 1.00 0.00 N ATOM 503 CA ALA A 44 101.404 -8.567 -11.640 1.00 0.00 C ATOM 504 C ALA A 44 102.409 -9.473 -12.350 1.00 0.00 C ATOM 505 O ALA A 44 102.677 -10.588 -11.903 1.00 0.00 O ATOM 506 CB ALA A 44 100.181 -9.362 -11.207 1.00 0.00 C ATOM 0 H ALA A 44 100.844 -7.714 -13.470 1.00 0.00 H new ATOM 0 HA ALA A 44 101.886 -8.159 -10.752 1.00 0.00 H new ATOM 0 HB1 ALA A 44 100.492 -10.188 -10.568 1.00 0.00 H new ATOM 0 HB2 ALA A 44 99.501 -8.712 -10.656 1.00 0.00 H new ATOM 0 HB3 ALA A 44 99.673 -9.756 -12.087 1.00 0.00 H new ATOM 512 N VAL A 45 102.962 -8.983 -13.457 1.00 0.00 N ATOM 513 CA VAL A 45 103.941 -9.738 -14.233 1.00 0.00 C ATOM 514 C VAL A 45 105.128 -8.855 -14.599 1.00 0.00 C ATOM 515 O VAL A 45 106.281 -9.214 -14.355 1.00 0.00 O ATOM 516 CB VAL A 45 103.316 -10.298 -15.524 1.00 0.00 C ATOM 517 CG1 VAL A 45 104.304 -11.196 -16.254 1.00 0.00 C ATOM 518 CG2 VAL A 45 102.028 -11.048 -15.214 1.00 0.00 C ATOM 0 H VAL A 45 102.747 -8.062 -13.838 1.00 0.00 H new ATOM 0 HA VAL A 45 104.278 -10.569 -13.613 1.00 0.00 H new ATOM 0 HB VAL A 45 103.073 -9.461 -16.178 1.00 0.00 H new ATOM 0 HG11 VAL A 45 103.842 -11.581 -17.163 1.00 0.00 H new ATOM 0 HG12 VAL A 45 105.194 -10.622 -16.514 1.00 0.00 H new ATOM 0 HG13 VAL A 45 104.584 -12.029 -15.609 1.00 0.00 H new ATOM 0 HG21 VAL A 45 101.601 -11.436 -16.139 1.00 0.00 H new ATOM 0 HG22 VAL A 45 102.243 -11.876 -14.538 1.00 0.00 H new ATOM 0 HG23 VAL A 45 101.316 -10.370 -14.743 1.00 0.00 H new ATOM 528 N ASP A 46 104.837 -7.695 -15.179 1.00 0.00 N ATOM 529 CA ASP A 46 105.879 -6.756 -15.573 1.00 0.00 C ATOM 530 C ASP A 46 106.634 -6.247 -14.351 1.00 0.00 C ATOM 531 O ASP A 46 107.853 -6.079 -14.388 1.00 0.00 O ATOM 532 CB ASP A 46 105.272 -5.580 -16.342 1.00 0.00 C ATOM 533 CG ASP A 46 106.059 -5.237 -17.591 1.00 0.00 C ATOM 534 OD1 ASP A 46 107.284 -5.473 -17.605 1.00 0.00 O ATOM 535 OD2 ASP A 46 105.448 -4.730 -18.557 1.00 0.00 O ATOM 0 H ASP A 46 103.888 -7.384 -15.386 1.00 0.00 H new ATOM 0 HA ASP A 46 106.582 -7.278 -16.223 1.00 0.00 H new ATOM 0 HB2 ASP A 46 104.245 -5.821 -16.618 1.00 0.00 H new ATOM 0 HB3 ASP A 46 105.230 -4.707 -15.691 1.00 0.00 H new ATOM 540 N GLU A 47 105.901 -6.005 -13.267 1.00 0.00 N ATOM 541 CA GLU A 47 106.500 -5.516 -12.030 1.00 0.00 C ATOM 542 C GLU A 47 107.541 -6.495 -11.503 1.00 0.00 C ATOM 543 O GLU A 47 108.695 -6.128 -11.278 1.00 0.00 O ATOM 544 CB GLU A 47 105.425 -5.290 -10.971 1.00 0.00 C ATOM 545 CG GLU A 47 104.932 -3.854 -10.898 1.00 0.00 C ATOM 546 CD GLU A 47 104.356 -3.368 -12.214 1.00 0.00 C ATOM 547 OE1 GLU A 47 105.127 -3.246 -13.190 1.00 0.00 O ATOM 548 OE2 GLU A 47 103.137 -3.108 -12.269 1.00 0.00 O ATOM 0 H GLU A 47 104.891 -6.140 -13.221 1.00 0.00 H new ATOM 0 HA GLU A 47 106.993 -4.569 -12.249 1.00 0.00 H new ATOM 0 HB2 GLU A 47 104.579 -5.945 -11.179 1.00 0.00 H new ATOM 0 HB3 GLU A 47 105.820 -5.579 -9.997 1.00 0.00 H new ATOM 0 HG2 GLU A 47 104.172 -3.774 -10.121 1.00 0.00 H new ATOM 0 HG3 GLU A 47 105.757 -3.205 -10.605 1.00 0.00 H new ATOM 555 N LYS A 48 107.128 -7.745 -11.310 1.00 0.00 N ATOM 556 CA LYS A 48 108.031 -8.778 -10.814 1.00 0.00 C ATOM 557 C LYS A 48 109.314 -8.809 -11.639 1.00 0.00 C ATOM 558 O LYS A 48 110.383 -9.152 -11.136 1.00 0.00 O ATOM 559 CB LYS A 48 107.349 -10.146 -10.856 1.00 0.00 C ATOM 560 CG LYS A 48 107.778 -11.077 -9.735 1.00 0.00 C ATOM 561 CD LYS A 48 107.431 -12.525 -10.047 1.00 0.00 C ATOM 562 CE LYS A 48 108.271 -13.066 -11.194 1.00 0.00 C ATOM 563 NZ LYS A 48 107.443 -13.376 -12.392 1.00 0.00 N ATOM 0 H LYS A 48 106.176 -8.066 -11.489 1.00 0.00 H new ATOM 0 HA LYS A 48 108.286 -8.543 -9.781 1.00 0.00 H new ATOM 0 HB2 LYS A 48 106.269 -10.005 -10.806 1.00 0.00 H new ATOM 0 HB3 LYS A 48 107.565 -10.621 -11.813 1.00 0.00 H new ATOM 0 HG2 LYS A 48 108.853 -10.986 -9.576 1.00 0.00 H new ATOM 0 HG3 LYS A 48 107.292 -10.778 -8.806 1.00 0.00 H new ATOM 0 HD2 LYS A 48 107.589 -13.137 -9.159 1.00 0.00 H new ATOM 0 HD3 LYS A 48 106.374 -12.600 -10.302 1.00 0.00 H new ATOM 0 HE2 LYS A 48 109.035 -12.336 -11.460 1.00 0.00 H new ATOM 0 HE3 LYS A 48 108.791 -13.967 -10.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 108.053 -13.742 -13.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 106.730 -14.092 -12.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 106.967 -12.511 -12.718 1.00 0.00 H new ATOM 577 N LEU A 49 109.193 -8.436 -12.908 1.00 0.00 N ATOM 578 CA LEU A 49 110.335 -8.408 -13.815 1.00 0.00 C ATOM 579 C LEU A 49 110.969 -7.018 -13.850 1.00 0.00 C ATOM 580 O LEU A 49 112.118 -6.862 -14.261 1.00 0.00 O ATOM 581 CB LEU A 49 109.901 -8.820 -15.223 1.00 0.00 C ATOM 582 CG LEU A 49 110.029 -10.314 -15.528 1.00 0.00 C ATOM 583 CD1 LEU A 49 109.068 -10.719 -16.636 1.00 0.00 C ATOM 584 CD2 LEU A 49 111.461 -10.658 -15.909 1.00 0.00 C ATOM 0 H LEU A 49 108.312 -8.148 -13.334 1.00 0.00 H new ATOM 0 HA LEU A 49 111.078 -9.116 -13.449 1.00 0.00 H new ATOM 0 HB2 LEU A 49 108.863 -8.523 -15.368 1.00 0.00 H new ATOM 0 HB3 LEU A 49 110.496 -8.264 -15.948 1.00 0.00 H new ATOM 0 HG LEU A 49 109.768 -10.872 -14.629 1.00 0.00 H new ATOM 0 HD11 LEU A 49 109.174 -11.785 -16.838 1.00 0.00 H new ATOM 0 HD12 LEU A 49 108.045 -10.509 -16.325 1.00 0.00 H new ATOM 0 HD13 LEU A 49 109.296 -10.154 -17.540 1.00 0.00 H new ATOM 0 HD21 LEU A 49 111.535 -11.724 -16.123 1.00 0.00 H new ATOM 0 HD22 LEU A 49 111.749 -10.090 -16.794 1.00 0.00 H new ATOM 0 HD23 LEU A 49 112.127 -10.407 -15.084 1.00 0.00 H new ATOM 596 N ARG A 50 110.212 -6.007 -13.421 1.00 0.00 N ATOM 597 CA ARG A 50 110.707 -4.633 -13.409 1.00 0.00 C ATOM 598 C ARG A 50 111.196 -4.230 -12.019 1.00 0.00 C ATOM 599 O ARG A 50 111.645 -3.102 -11.817 1.00 0.00 O ATOM 600 CB ARG A 50 109.610 -3.671 -13.871 1.00 0.00 C ATOM 601 CG ARG A 50 109.702 -3.303 -15.344 1.00 0.00 C ATOM 602 CD ARG A 50 110.194 -1.877 -15.533 1.00 0.00 C ATOM 603 NE ARG A 50 109.518 -1.206 -16.641 1.00 0.00 N ATOM 604 CZ ARG A 50 109.924 -1.271 -17.907 1.00 0.00 C ATOM 605 NH1 ARG A 50 110.995 -1.983 -18.236 1.00 0.00 N ATOM 606 NH2 ARG A 50 109.252 -0.622 -18.849 1.00 0.00 N ATOM 0 H ARG A 50 109.257 -6.115 -13.079 1.00 0.00 H new ATOM 0 HA ARG A 50 111.551 -4.577 -14.097 1.00 0.00 H new ATOM 0 HB2 ARG A 50 108.637 -4.123 -13.678 1.00 0.00 H new ATOM 0 HB3 ARG A 50 109.662 -2.761 -13.274 1.00 0.00 H new ATOM 0 HG2 ARG A 50 110.378 -3.992 -15.851 1.00 0.00 H new ATOM 0 HG3 ARG A 50 108.723 -3.416 -15.810 1.00 0.00 H new ATOM 0 HD2 ARG A 50 110.032 -1.313 -14.615 1.00 0.00 H new ATOM 0 HD3 ARG A 50 111.268 -1.886 -15.716 1.00 0.00 H new ATOM 0 HE ARG A 50 108.685 -0.655 -16.432 1.00 0.00 H new ATOM 0 HH11 ARG A 50 111.514 -2.486 -17.516 1.00 0.00 H new ATOM 0 HH12 ARG A 50 111.299 -2.027 -19.209 1.00 0.00 H new ATOM 0 HH21 ARG A 50 108.427 -0.075 -18.602 1.00 0.00 H new ATOM 0 HH22 ARG A 50 109.560 -0.670 -19.820 1.00 0.00 H new ATOM 620 N ASP A 51 111.112 -5.154 -11.066 1.00 0.00 N ATOM 621 CA ASP A 51 111.553 -4.880 -9.706 1.00 0.00 C ATOM 622 C ASP A 51 113.073 -4.800 -9.640 1.00 0.00 C ATOM 623 O ASP A 51 113.629 -3.833 -9.123 1.00 0.00 O ATOM 624 CB ASP A 51 111.045 -5.964 -8.753 1.00 0.00 C ATOM 625 CG ASP A 51 109.737 -5.581 -8.086 1.00 0.00 C ATOM 626 OD1 ASP A 51 108.838 -5.074 -8.789 1.00 0.00 O ATOM 627 OD2 ASP A 51 109.614 -5.789 -6.860 1.00 0.00 O ATOM 0 H ASP A 51 110.744 -6.094 -11.211 1.00 0.00 H new ATOM 0 HA ASP A 51 111.140 -3.919 -9.401 1.00 0.00 H new ATOM 0 HB2 ASP A 51 110.910 -6.894 -9.304 1.00 0.00 H new ATOM 0 HB3 ASP A 51 111.798 -6.153 -7.988 1.00 0.00 H new ATOM 632 N LEU A 52 113.740 -5.822 -10.170 1.00 0.00 N ATOM 633 CA LEU A 52 115.199 -5.869 -10.172 1.00 0.00 C ATOM 634 C LEU A 52 115.782 -4.546 -10.657 1.00 0.00 C ATOM 635 O LEU A 52 116.859 -4.134 -10.228 1.00 0.00 O ATOM 636 CB LEU A 52 115.694 -7.016 -11.055 1.00 0.00 C ATOM 637 CG LEU A 52 115.116 -7.038 -12.474 1.00 0.00 C ATOM 638 CD1 LEU A 52 116.229 -6.965 -13.509 1.00 0.00 C ATOM 639 CD2 LEU A 52 114.272 -8.286 -12.690 1.00 0.00 C ATOM 0 H LEU A 52 113.293 -6.629 -10.604 1.00 0.00 H new ATOM 0 HA LEU A 52 115.535 -6.041 -9.149 1.00 0.00 H new ATOM 0 HB2 LEU A 52 116.780 -6.960 -11.122 1.00 0.00 H new ATOM 0 HB3 LEU A 52 115.454 -7.960 -10.566 1.00 0.00 H new ATOM 0 HG LEU A 52 114.476 -6.164 -12.594 1.00 0.00 H new ATOM 0 HD11 LEU A 52 115.797 -6.982 -14.510 1.00 0.00 H new ATOM 0 HD12 LEU A 52 116.793 -6.042 -13.373 1.00 0.00 H new ATOM 0 HD13 LEU A 52 116.896 -7.819 -13.387 1.00 0.00 H new ATOM 0 HD21 LEU A 52 113.871 -8.283 -13.703 1.00 0.00 H new ATOM 0 HD22 LEU A 52 114.890 -9.172 -12.547 1.00 0.00 H new ATOM 0 HD23 LEU A 52 113.450 -8.298 -11.974 1.00 0.00 H new ATOM 651 N TYR A 53 115.052 -3.881 -11.544 1.00 0.00 N ATOM 652 CA TYR A 53 115.483 -2.601 -12.088 1.00 0.00 C ATOM 653 C TYR A 53 115.569 -1.548 -10.988 1.00 0.00 C ATOM 654 O TYR A 53 116.622 -0.951 -10.766 1.00 0.00 O ATOM 655 CB TYR A 53 114.506 -2.141 -13.170 1.00 0.00 C ATOM 656 CG TYR A 53 115.169 -1.378 -14.293 1.00 0.00 C ATOM 657 CD1 TYR A 53 116.039 -2.014 -15.171 1.00 0.00 C ATOM 658 CD2 TYR A 53 114.938 -0.020 -14.468 1.00 0.00 C ATOM 659 CE1 TYR A 53 116.659 -1.317 -16.190 1.00 0.00 C ATOM 660 CE2 TYR A 53 115.553 0.683 -15.487 1.00 0.00 C ATOM 661 CZ TYR A 53 116.413 0.030 -16.345 1.00 0.00 C ATOM 662 OH TYR A 53 117.030 0.727 -17.359 1.00 0.00 O ATOM 0 H TYR A 53 114.155 -4.209 -11.903 1.00 0.00 H new ATOM 0 HA TYR A 53 116.474 -2.728 -12.524 1.00 0.00 H new ATOM 0 HB2 TYR A 53 113.997 -3.012 -13.583 1.00 0.00 H new ATOM 0 HB3 TYR A 53 113.742 -1.511 -12.715 1.00 0.00 H new ATOM 0 HD1 TYR A 53 116.233 -3.070 -15.055 1.00 0.00 H new ATOM 0 HD2 TYR A 53 114.267 0.495 -13.797 1.00 0.00 H new ATOM 0 HE1 TYR A 53 117.334 -1.826 -16.862 1.00 0.00 H new ATOM 0 HE2 TYR A 53 115.361 1.739 -15.611 1.00 0.00 H new ATOM 0 HH TYR A 53 116.748 1.665 -17.330 1.00 0.00 H new ATOM 672 N SER A 54 114.451 -1.329 -10.302 1.00 0.00 N ATOM 673 CA SER A 54 114.390 -0.345 -9.222 1.00 0.00 C ATOM 674 C SER A 54 114.728 -0.971 -7.872 1.00 0.00 C ATOM 675 O SER A 54 114.442 -0.393 -6.823 1.00 0.00 O ATOM 676 CB SER A 54 113.002 0.295 -9.167 1.00 0.00 C ATOM 677 OG SER A 54 113.086 1.667 -8.818 1.00 0.00 O ATOM 0 H SER A 54 113.573 -1.819 -10.474 1.00 0.00 H new ATOM 0 HA SER A 54 115.134 0.423 -9.432 1.00 0.00 H new ATOM 0 HB2 SER A 54 112.512 0.192 -10.135 1.00 0.00 H new ATOM 0 HB3 SER A 54 112.384 -0.231 -8.440 1.00 0.00 H new ATOM 0 HG SER A 54 112.186 2.053 -8.791 1.00 0.00 H new ATOM 683 N LYS A 55 115.351 -2.144 -7.902 1.00 0.00 N ATOM 684 CA LYS A 55 115.740 -2.838 -6.675 1.00 0.00 C ATOM 685 C LYS A 55 117.260 -2.923 -6.567 1.00 0.00 C ATOM 686 O LYS A 55 117.814 -2.941 -5.468 1.00 0.00 O ATOM 687 CB LYS A 55 115.134 -4.241 -6.628 1.00 0.00 C ATOM 688 CG LYS A 55 114.898 -4.749 -5.216 1.00 0.00 C ATOM 689 CD LYS A 55 113.762 -3.997 -4.540 1.00 0.00 C ATOM 690 CE LYS A 55 114.034 -3.786 -3.059 1.00 0.00 C ATOM 691 NZ LYS A 55 113.559 -4.935 -2.238 1.00 0.00 N ATOM 0 H LYS A 55 115.598 -2.636 -8.761 1.00 0.00 H new ATOM 0 HA LYS A 55 115.358 -2.266 -5.829 1.00 0.00 H new ATOM 0 HB2 LYS A 55 114.187 -4.238 -7.168 1.00 0.00 H new ATOM 0 HB3 LYS A 55 115.796 -4.932 -7.149 1.00 0.00 H new ATOM 0 HG2 LYS A 55 114.666 -5.814 -5.244 1.00 0.00 H new ATOM 0 HG3 LYS A 55 115.810 -4.637 -4.630 1.00 0.00 H new ATOM 0 HD2 LYS A 55 113.624 -3.031 -5.026 1.00 0.00 H new ATOM 0 HD3 LYS A 55 112.832 -4.552 -4.664 1.00 0.00 H new ATOM 0 HE2 LYS A 55 115.104 -3.646 -2.903 1.00 0.00 H new ATOM 0 HE3 LYS A 55 113.541 -2.873 -2.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 113.763 -4.752 -1.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 112.534 -5.054 -2.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 114.048 -5.802 -2.538 1.00 0.00 H new ATOM 705 N SER A 56 117.928 -2.966 -7.715 1.00 0.00 N ATOM 706 CA SER A 56 119.385 -3.040 -7.749 1.00 0.00 C ATOM 707 C SER A 56 119.991 -1.728 -8.246 1.00 0.00 C ATOM 708 O SER A 56 121.188 -1.653 -8.518 1.00 0.00 O ATOM 709 CB SER A 56 119.838 -4.190 -8.647 1.00 0.00 C ATOM 710 OG SER A 56 119.501 -3.944 -10.002 1.00 0.00 O ATOM 0 H SER A 56 117.485 -2.951 -8.633 1.00 0.00 H new ATOM 0 HA SER A 56 119.734 -3.219 -6.732 1.00 0.00 H new ATOM 0 HB2 SER A 56 120.916 -4.324 -8.556 1.00 0.00 H new ATOM 0 HB3 SER A 56 119.373 -5.119 -8.316 1.00 0.00 H new ATOM 0 HG SER A 56 118.546 -4.118 -10.138 1.00 0.00 H new ATOM 716 N THR A 57 119.159 -0.695 -8.361 1.00 0.00 N ATOM 717 CA THR A 57 119.621 0.611 -8.826 1.00 0.00 C ATOM 718 C THR A 57 119.154 1.727 -7.896 1.00 0.00 C ATOM 719 O THR A 57 119.747 2.805 -7.864 1.00 0.00 O ATOM 720 CB THR A 57 119.126 0.875 -10.247 1.00 0.00 C ATOM 721 OG1 THR A 57 117.747 1.201 -10.249 1.00 0.00 O ATOM 722 CG2 THR A 57 119.322 -0.306 -11.171 1.00 0.00 C ATOM 0 H THR A 57 118.164 -0.737 -8.139 1.00 0.00 H new ATOM 0 HA THR A 57 120.711 0.599 -8.823 1.00 0.00 H new ATOM 0 HB THR A 57 119.725 1.709 -10.613 1.00 0.00 H new ATOM 0 HG1 THR A 57 117.244 0.493 -10.703 1.00 0.00 H new ATOM 0 HG21 THR A 57 118.951 -0.056 -12.165 1.00 0.00 H new ATOM 0 HG22 THR A 57 120.383 -0.549 -11.231 1.00 0.00 H new ATOM 0 HG23 THR A 57 118.774 -1.165 -10.785 1.00 0.00 H new ATOM 730 N ALA A 58 118.089 1.468 -7.138 1.00 0.00 N ATOM 731 CA ALA A 58 117.555 2.457 -6.211 1.00 0.00 C ATOM 732 C ALA A 58 117.553 1.919 -4.789 1.00 0.00 C ATOM 733 O ALA A 58 117.950 2.612 -3.852 1.00 0.00 O ATOM 734 CB ALA A 58 116.152 2.873 -6.627 1.00 0.00 C ATOM 0 H ALA A 58 117.582 0.583 -7.150 1.00 0.00 H new ATOM 0 HA ALA A 58 118.200 3.336 -6.241 1.00 0.00 H new ATOM 0 HB1 ALA A 58 115.768 3.612 -5.924 1.00 0.00 H new ATOM 0 HB2 ALA A 58 116.182 3.305 -7.627 1.00 0.00 H new ATOM 0 HB3 ALA A 58 115.499 2.000 -6.628 1.00 0.00 H new ATOM 740 N ALA A 59 117.118 0.676 -4.633 1.00 0.00 N ATOM 741 CA ALA A 59 117.084 0.050 -3.321 1.00 0.00 C ATOM 742 C ALA A 59 118.498 -0.186 -2.795 1.00 0.00 C ATOM 743 O ALA A 59 118.685 -0.482 -1.615 1.00 0.00 O ATOM 744 CB ALA A 59 116.316 -1.260 -3.377 1.00 0.00 C ATOM 0 H ALA A 59 116.786 0.085 -5.395 1.00 0.00 H new ATOM 0 HA ALA A 59 116.572 0.726 -2.636 1.00 0.00 H new ATOM 0 HB1 ALA A 59 116.300 -1.715 -2.387 1.00 0.00 H new ATOM 0 HB2 ALA A 59 115.294 -1.069 -3.705 1.00 0.00 H new ATOM 0 HB3 ALA A 59 116.802 -1.937 -4.080 1.00 0.00 H new ATOM 750 N MET A 60 119.493 -0.049 -3.674 1.00 0.00 N ATOM 751 CA MET A 60 120.884 -0.249 -3.277 1.00 0.00 C ATOM 752 C MET A 60 121.652 1.065 -3.314 1.00 0.00 C ATOM 753 O MET A 60 122.531 1.309 -2.488 1.00 0.00 O ATOM 754 CB MET A 60 121.558 -1.274 -4.188 1.00 0.00 C ATOM 755 CG MET A 60 121.672 -0.829 -5.636 1.00 0.00 C ATOM 756 SD MET A 60 123.329 -0.257 -6.060 1.00 0.00 S ATOM 757 CE MET A 60 124.203 -1.816 -6.172 1.00 0.00 C ATOM 0 H MET A 60 119.362 0.197 -4.655 1.00 0.00 H new ATOM 0 HA MET A 60 120.892 -0.626 -2.254 1.00 0.00 H new ATOM 0 HB2 MET A 60 122.556 -1.487 -3.804 1.00 0.00 H new ATOM 0 HB3 MET A 60 120.995 -2.207 -4.148 1.00 0.00 H new ATOM 0 HG2 MET A 60 121.400 -1.658 -6.289 1.00 0.00 H new ATOM 0 HG3 MET A 60 120.957 -0.028 -5.823 1.00 0.00 H new ATOM 0 HE1 MET A 60 125.188 -1.715 -5.716 1.00 0.00 H new ATOM 0 HE2 MET A 60 123.639 -2.588 -5.649 1.00 0.00 H new ATOM 0 HE3 MET A 60 124.315 -2.096 -7.219 1.00 0.00 H new ATOM 767 N SER A 61 121.310 1.909 -4.279 1.00 0.00 N ATOM 768 CA SER A 61 121.962 3.204 -4.426 1.00 0.00 C ATOM 769 C SER A 61 121.600 4.132 -3.269 1.00 0.00 C ATOM 770 O SER A 61 122.332 5.073 -2.965 1.00 0.00 O ATOM 771 CB SER A 61 121.567 3.850 -5.756 1.00 0.00 C ATOM 772 OG SER A 61 122.527 4.812 -6.159 1.00 0.00 O ATOM 0 H SER A 61 120.585 1.720 -4.971 1.00 0.00 H new ATOM 0 HA SER A 61 123.040 3.042 -4.414 1.00 0.00 H new ATOM 0 HB2 SER A 61 121.473 3.082 -6.523 1.00 0.00 H new ATOM 0 HB3 SER A 61 120.591 4.324 -5.658 1.00 0.00 H new ATOM 0 HG SER A 61 122.253 5.210 -7.012 1.00 0.00 H new ATOM 778 N THR A 62 120.466 3.862 -2.627 1.00 0.00 N ATOM 779 CA THR A 62 120.011 4.673 -1.505 1.00 0.00 C ATOM 780 C THR A 62 120.746 4.290 -0.226 1.00 0.00 C ATOM 781 O THR A 62 121.073 5.148 0.595 1.00 0.00 O ATOM 782 CB THR A 62 118.503 4.510 -1.310 1.00 0.00 C ATOM 783 OG1 THR A 62 117.815 4.712 -2.532 1.00 0.00 O ATOM 784 CG2 THR A 62 117.923 5.469 -0.294 1.00 0.00 C ATOM 0 H THR A 62 119.847 3.088 -2.866 1.00 0.00 H new ATOM 0 HA THR A 62 120.230 5.717 -1.730 1.00 0.00 H new ATOM 0 HB THR A 62 118.368 3.492 -0.943 1.00 0.00 H new ATOM 0 HG1 THR A 62 117.550 3.846 -2.905 1.00 0.00 H new ATOM 0 HG21 THR A 62 116.850 5.299 -0.205 1.00 0.00 H new ATOM 0 HG22 THR A 62 118.398 5.305 0.673 1.00 0.00 H new ATOM 0 HG23 THR A 62 118.103 6.494 -0.618 1.00 0.00 H new ATOM 792 N TYR A 63 121.006 2.996 -0.063 1.00 0.00 N ATOM 793 CA TYR A 63 121.700 2.495 1.108 1.00 0.00 C ATOM 794 C TYR A 63 123.182 2.836 1.045 1.00 0.00 C ATOM 795 O TYR A 63 123.824 3.052 2.073 1.00 0.00 O ATOM 796 CB TYR A 63 121.521 0.991 1.185 1.00 0.00 C ATOM 797 CG TYR A 63 120.968 0.505 2.506 1.00 0.00 C ATOM 798 CD1 TYR A 63 121.770 0.455 3.639 1.00 0.00 C ATOM 799 CD2 TYR A 63 119.645 0.099 2.621 1.00 0.00 C ATOM 800 CE1 TYR A 63 121.269 0.012 4.849 1.00 0.00 C ATOM 801 CE2 TYR A 63 119.137 -0.343 3.827 1.00 0.00 C ATOM 802 CZ TYR A 63 119.952 -0.385 4.938 1.00 0.00 C ATOM 803 OH TYR A 63 119.450 -0.826 6.141 1.00 0.00 O ATOM 0 H TYR A 63 120.742 2.275 -0.735 1.00 0.00 H new ATOM 0 HA TYR A 63 121.280 2.965 1.997 1.00 0.00 H new ATOM 0 HB2 TYR A 63 120.853 0.673 0.384 1.00 0.00 H new ATOM 0 HB3 TYR A 63 122.483 0.511 1.007 1.00 0.00 H new ATOM 0 HD1 TYR A 63 122.802 0.767 3.574 1.00 0.00 H new ATOM 0 HD2 TYR A 63 119.003 0.129 1.753 1.00 0.00 H new ATOM 0 HE1 TYR A 63 121.906 -0.023 5.720 1.00 0.00 H new ATOM 0 HE2 TYR A 63 118.105 -0.654 3.899 1.00 0.00 H new ATOM 0 HH TYR A 63 118.506 -1.067 6.033 1.00 0.00 H new ATOM 813 N THR A 64 123.719 2.894 -0.171 1.00 0.00 N ATOM 814 CA THR A 64 125.126 3.223 -0.368 1.00 0.00 C ATOM 815 C THR A 64 125.455 4.528 0.343 1.00 0.00 C ATOM 816 O THR A 64 126.594 4.771 0.741 1.00 0.00 O ATOM 817 CB THR A 64 125.454 3.333 -1.859 1.00 0.00 C ATOM 818 OG1 THR A 64 124.269 3.345 -2.635 1.00 0.00 O ATOM 819 CG2 THR A 64 126.321 2.200 -2.366 1.00 0.00 C ATOM 0 H THR A 64 123.202 2.718 -1.032 1.00 0.00 H new ATOM 0 HA THR A 64 125.734 2.423 0.055 1.00 0.00 H new ATOM 0 HB THR A 64 126.005 4.268 -1.964 1.00 0.00 H new ATOM 0 HG1 THR A 64 123.934 4.263 -2.706 1.00 0.00 H new ATOM 0 HG21 THR A 64 126.516 2.339 -3.429 1.00 0.00 H new ATOM 0 HG22 THR A 64 127.265 2.193 -1.822 1.00 0.00 H new ATOM 0 HG23 THR A 64 125.807 1.251 -2.212 1.00 0.00 H new ATOM 827 N GLY A 65 124.430 5.349 0.513 1.00 0.00 N ATOM 828 CA GLY A 65 124.592 6.615 1.195 1.00 0.00 C ATOM 829 C GLY A 65 124.389 6.474 2.690 1.00 0.00 C ATOM 830 O GLY A 65 124.899 7.278 3.471 1.00 0.00 O ATOM 0 H GLY A 65 123.482 5.159 0.188 1.00 0.00 H new ATOM 0 HA2 GLY A 65 125.589 7.010 0.998 1.00 0.00 H new ATOM 0 HA3 GLY A 65 123.879 7.337 0.797 1.00 0.00 H new ATOM 834 N ILE A 66 123.645 5.442 3.090 1.00 0.00 N ATOM 835 CA ILE A 66 123.382 5.194 4.501 1.00 0.00 C ATOM 836 C ILE A 66 124.410 4.233 5.092 1.00 0.00 C ATOM 837 O ILE A 66 124.512 4.087 6.309 1.00 0.00 O ATOM 838 CB ILE A 66 121.969 4.616 4.717 1.00 0.00 C ATOM 839 CG1 ILE A 66 120.943 5.408 3.905 1.00 0.00 C ATOM 840 CG2 ILE A 66 121.607 4.629 6.196 1.00 0.00 C ATOM 841 CD1 ILE A 66 120.850 6.865 4.305 1.00 0.00 C ATOM 0 H ILE A 66 123.216 4.768 2.456 1.00 0.00 H new ATOM 0 HA ILE A 66 123.454 6.155 5.010 1.00 0.00 H new ATOM 0 HB ILE A 66 121.960 3.582 4.372 1.00 0.00 H new ATOM 0 HG12 ILE A 66 121.202 5.346 2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 66 119.963 4.944 4.021 1.00 0.00 H new ATOM 0 HG21 ILE A 66 120.606 4.218 6.329 1.00 0.00 H new ATOM 0 HG22 ILE A 66 122.325 4.025 6.752 1.00 0.00 H new ATOM 0 HG23 ILE A 66 121.630 5.654 6.567 1.00 0.00 H new ATOM 0 HD11 ILE A 66 120.103 7.365 3.688 1.00 0.00 H new ATOM 0 HD12 ILE A 66 120.561 6.937 5.354 1.00 0.00 H new ATOM 0 HD13 ILE A 66 121.819 7.344 4.162 1.00 0.00 H new ATOM 853 N PHE A 67 125.173 3.587 4.218 1.00 0.00 N ATOM 854 CA PHE A 67 126.196 2.645 4.635 1.00 0.00 C ATOM 855 C PHE A 67 127.268 3.341 5.462 1.00 0.00 C ATOM 856 O PHE A 67 127.662 2.860 6.524 1.00 0.00 O ATOM 857 CB PHE A 67 126.815 2.006 3.397 1.00 0.00 C ATOM 858 CG PHE A 67 127.007 0.519 3.516 1.00 0.00 C ATOM 859 CD1 PHE A 67 128.104 0.000 4.183 1.00 0.00 C ATOM 860 CD2 PHE A 67 126.088 -0.358 2.960 1.00 0.00 C ATOM 861 CE1 PHE A 67 128.281 -1.367 4.295 1.00 0.00 C ATOM 862 CE2 PHE A 67 126.260 -1.725 3.070 1.00 0.00 C ATOM 863 CZ PHE A 67 127.358 -2.230 3.737 1.00 0.00 C ATOM 0 H PHE A 67 125.098 3.703 3.207 1.00 0.00 H new ATOM 0 HA PHE A 67 125.741 1.875 5.258 1.00 0.00 H new ATOM 0 HB2 PHE A 67 126.180 2.214 2.536 1.00 0.00 H new ATOM 0 HB3 PHE A 67 127.780 2.474 3.202 1.00 0.00 H new ATOM 0 HD1 PHE A 67 128.829 0.670 4.621 1.00 0.00 H new ATOM 0 HD2 PHE A 67 125.228 0.031 2.435 1.00 0.00 H new ATOM 0 HE1 PHE A 67 129.140 -1.760 4.818 1.00 0.00 H new ATOM 0 HE2 PHE A 67 125.536 -2.398 2.634 1.00 0.00 H new ATOM 0 HZ PHE A 67 127.495 -3.298 3.822 1.00 0.00 H new ATOM 873 N THR A 68 127.730 4.480 4.963 1.00 0.00 N ATOM 874 CA THR A 68 128.758 5.262 5.643 1.00 0.00 C ATOM 875 C THR A 68 128.362 5.555 7.088 1.00 0.00 C ATOM 876 O THR A 68 129.218 5.780 7.943 1.00 0.00 O ATOM 877 CB THR A 68 129.006 6.574 4.895 1.00 0.00 C ATOM 878 OG1 THR A 68 128.505 6.502 3.572 1.00 0.00 O ATOM 879 CG2 THR A 68 130.471 6.946 4.810 1.00 0.00 C ATOM 0 H THR A 68 127.408 4.886 4.085 1.00 0.00 H new ATOM 0 HA THR A 68 129.676 4.674 5.652 1.00 0.00 H new ATOM 0 HB THR A 68 128.485 7.337 5.473 1.00 0.00 H new ATOM 0 HG1 THR A 68 128.672 7.351 3.112 1.00 0.00 H new ATOM 0 HG21 THR A 68 130.577 7.886 4.268 1.00 0.00 H new ATOM 0 HG22 THR A 68 130.876 7.060 5.815 1.00 0.00 H new ATOM 0 HG23 THR A 68 131.016 6.161 4.286 1.00 0.00 H new ATOM 887 N ASP A 69 127.058 5.557 7.355 1.00 0.00 N ATOM 888 CA ASP A 69 126.554 5.827 8.697 1.00 0.00 C ATOM 889 C ASP A 69 127.159 4.867 9.715 1.00 0.00 C ATOM 890 O ASP A 69 127.298 5.199 10.892 1.00 0.00 O ATOM 891 CB ASP A 69 125.029 5.726 8.724 1.00 0.00 C ATOM 892 CG ASP A 69 124.414 6.584 9.812 1.00 0.00 C ATOM 893 OD1 ASP A 69 125.041 7.594 10.198 1.00 0.00 O ATOM 894 OD2 ASP A 69 123.305 6.248 10.279 1.00 0.00 O ATOM 0 H ASP A 69 126.333 5.375 6.661 1.00 0.00 H new ATOM 0 HA ASP A 69 126.848 6.841 8.967 1.00 0.00 H new ATOM 0 HB2 ASP A 69 124.630 6.030 7.756 1.00 0.00 H new ATOM 0 HB3 ASP A 69 124.739 4.687 8.877 1.00 0.00 H new ATOM 899 N GLN A 70 127.523 3.677 9.252 1.00 0.00 N ATOM 900 CA GLN A 70 128.120 2.670 10.122 1.00 0.00 C ATOM 901 C GLN A 70 129.633 2.595 9.920 1.00 0.00 C ATOM 902 O GLN A 70 130.281 1.654 10.377 1.00 0.00 O ATOM 903 CB GLN A 70 127.489 1.300 9.862 1.00 0.00 C ATOM 904 CG GLN A 70 126.202 1.066 10.637 1.00 0.00 C ATOM 905 CD GLN A 70 126.445 0.807 12.111 1.00 0.00 C ATOM 906 OE1 GLN A 70 126.483 1.737 12.917 1.00 0.00 O ATOM 907 NE2 GLN A 70 126.612 -0.459 12.473 1.00 0.00 N ATOM 0 H GLN A 70 127.416 3.386 8.280 1.00 0.00 H new ATOM 0 HA GLN A 70 127.926 2.962 11.154 1.00 0.00 H new ATOM 0 HB2 GLN A 70 127.285 1.200 8.796 1.00 0.00 H new ATOM 0 HB3 GLN A 70 128.207 0.523 10.123 1.00 0.00 H new ATOM 0 HG2 GLN A 70 125.554 1.935 10.527 1.00 0.00 H new ATOM 0 HG3 GLN A 70 125.672 0.217 10.206 1.00 0.00 H new ATOM 0 HE21 GLN A 70 126.573 -1.199 11.772 1.00 0.00 H new ATOM 0 HE22 GLN A 70 126.779 -0.692 13.452 1.00 0.00 H new ATOM 916 N VAL A 71 130.192 3.592 9.235 1.00 0.00 N ATOM 917 CA VAL A 71 131.628 3.641 8.974 1.00 0.00 C ATOM 918 C VAL A 71 132.323 4.598 9.931 1.00 0.00 C ATOM 919 O VAL A 71 133.070 4.171 10.809 1.00 0.00 O ATOM 920 CB VAL A 71 131.906 4.065 7.515 1.00 0.00 C ATOM 921 CG1 VAL A 71 133.400 4.209 7.248 1.00 0.00 C ATOM 922 CG2 VAL A 71 131.283 3.066 6.552 1.00 0.00 C ATOM 0 H VAL A 71 129.669 4.379 8.850 1.00 0.00 H new ATOM 0 HA VAL A 71 132.027 2.639 9.132 1.00 0.00 H new ATOM 0 HB VAL A 71 131.450 5.042 7.356 1.00 0.00 H new ATOM 0 HG11 VAL A 71 133.557 4.508 6.212 1.00 0.00 H new ATOM 0 HG12 VAL A 71 133.817 4.966 7.912 1.00 0.00 H new ATOM 0 HG13 VAL A 71 133.896 3.255 7.429 1.00 0.00 H new ATOM 0 HG21 VAL A 71 131.485 3.375 5.526 1.00 0.00 H new ATOM 0 HG22 VAL A 71 131.711 2.079 6.725 1.00 0.00 H new ATOM 0 HG23 VAL A 71 130.206 3.028 6.714 1.00 0.00 H new ATOM 932 N LEU A 72 132.064 5.893 9.776 1.00 0.00 N ATOM 933 CA LEU A 72 132.669 6.879 10.650 1.00 0.00 C ATOM 934 C LEU A 72 132.194 6.654 12.074 1.00 0.00 C ATOM 935 O LEU A 72 132.902 6.945 13.038 1.00 0.00 O ATOM 936 CB LEU A 72 132.336 8.305 10.194 1.00 0.00 C ATOM 937 CG LEU A 72 130.949 8.493 9.570 1.00 0.00 C ATOM 938 CD1 LEU A 72 130.350 9.828 9.988 1.00 0.00 C ATOM 939 CD2 LEU A 72 131.029 8.395 8.052 1.00 0.00 C ATOM 0 H LEU A 72 131.446 6.276 9.061 1.00 0.00 H new ATOM 0 HA LEU A 72 133.752 6.763 10.607 1.00 0.00 H new ATOM 0 HB2 LEU A 72 132.422 8.971 11.052 1.00 0.00 H new ATOM 0 HB3 LEU A 72 133.087 8.620 9.469 1.00 0.00 H new ATOM 0 HG LEU A 72 130.299 7.697 9.933 1.00 0.00 H new ATOM 0 HD11 LEU A 72 129.365 9.943 9.535 1.00 0.00 H new ATOM 0 HD12 LEU A 72 130.256 9.861 11.073 1.00 0.00 H new ATOM 0 HD13 LEU A 72 130.999 10.638 9.656 1.00 0.00 H new ATOM 0 HD21 LEU A 72 130.035 8.531 7.626 1.00 0.00 H new ATOM 0 HD22 LEU A 72 131.696 9.169 7.672 1.00 0.00 H new ATOM 0 HD23 LEU A 72 131.414 7.415 7.770 1.00 0.00 H new ATOM 951 N SER A 73 130.989 6.109 12.191 1.00 0.00 N ATOM 952 CA SER A 73 130.396 5.812 13.482 1.00 0.00 C ATOM 953 C SER A 73 131.115 4.654 14.163 1.00 0.00 C ATOM 954 O SER A 73 130.904 4.393 15.347 1.00 0.00 O ATOM 955 CB SER A 73 128.922 5.469 13.305 1.00 0.00 C ATOM 956 OG SER A 73 128.208 5.633 14.517 1.00 0.00 O ATOM 0 H SER A 73 130.400 5.863 11.395 1.00 0.00 H new ATOM 0 HA SER A 73 130.494 6.695 14.114 1.00 0.00 H new ATOM 0 HB2 SER A 73 128.488 6.107 12.535 1.00 0.00 H new ATOM 0 HB3 SER A 73 128.825 4.440 12.959 1.00 0.00 H new ATOM 0 HG SER A 73 128.749 5.299 15.263 1.00 0.00 H new ATOM 962 N VAL A 74 131.954 3.951 13.407 1.00 0.00 N ATOM 963 CA VAL A 74 132.681 2.810 13.945 1.00 0.00 C ATOM 964 C VAL A 74 134.192 2.949 13.776 1.00 0.00 C ATOM 965 O VAL A 74 134.951 2.280 14.477 1.00 0.00 O ATOM 966 CB VAL A 74 132.234 1.506 13.263 1.00 0.00 C ATOM 967 CG1 VAL A 74 132.847 0.298 13.955 1.00 0.00 C ATOM 968 CG2 VAL A 74 130.715 1.408 13.245 1.00 0.00 C ATOM 0 H VAL A 74 132.145 4.152 12.425 1.00 0.00 H new ATOM 0 HA VAL A 74 132.451 2.779 15.010 1.00 0.00 H new ATOM 0 HB VAL A 74 132.588 1.518 12.232 1.00 0.00 H new ATOM 0 HG11 VAL A 74 132.517 -0.613 13.456 1.00 0.00 H new ATOM 0 HG12 VAL A 74 133.934 0.364 13.908 1.00 0.00 H new ATOM 0 HG13 VAL A 74 132.530 0.276 14.998 1.00 0.00 H new ATOM 0 HG21 VAL A 74 130.416 0.479 12.759 1.00 0.00 H new ATOM 0 HG22 VAL A 74 130.337 1.420 14.267 1.00 0.00 H new ATOM 0 HG23 VAL A 74 130.302 2.254 12.696 1.00 0.00 H new ATOM 978 N LEU A 75 134.640 3.783 12.837 1.00 0.00 N ATOM 979 CA LEU A 75 136.084 3.926 12.615 1.00 0.00 C ATOM 980 C LEU A 75 136.581 5.376 12.651 1.00 0.00 C ATOM 981 O LEU A 75 137.791 5.603 12.648 1.00 0.00 O ATOM 982 CB LEU A 75 136.488 3.267 11.294 1.00 0.00 C ATOM 983 CG LEU A 75 136.057 4.003 10.025 1.00 0.00 C ATOM 984 CD1 LEU A 75 137.070 5.079 9.657 1.00 0.00 C ATOM 985 CD2 LEU A 75 135.881 3.016 8.881 1.00 0.00 C ATOM 0 H LEU A 75 134.048 4.354 12.234 1.00 0.00 H new ATOM 0 HA LEU A 75 136.565 3.418 13.451 1.00 0.00 H new ATOM 0 HB2 LEU A 75 137.573 3.161 11.279 1.00 0.00 H new ATOM 0 HB3 LEU A 75 136.069 2.261 11.268 1.00 0.00 H new ATOM 0 HG LEU A 75 135.100 4.490 10.213 1.00 0.00 H new ATOM 0 HD11 LEU A 75 136.744 5.591 8.751 1.00 0.00 H new ATOM 0 HD12 LEU A 75 137.149 5.799 10.472 1.00 0.00 H new ATOM 0 HD13 LEU A 75 138.043 4.619 9.484 1.00 0.00 H new ATOM 0 HD21 LEU A 75 135.574 3.551 7.983 1.00 0.00 H new ATOM 0 HD22 LEU A 75 136.825 2.504 8.694 1.00 0.00 H new ATOM 0 HD23 LEU A 75 135.118 2.284 9.146 1.00 0.00 H new ATOM 997 N LYS A 76 135.681 6.356 12.688 1.00 0.00 N ATOM 998 CA LYS A 76 136.108 7.752 12.731 1.00 0.00 C ATOM 999 C LYS A 76 135.967 8.331 14.134 1.00 0.00 C ATOM 1000 O LYS A 76 136.531 9.381 14.444 1.00 0.00 O ATOM 1001 CB LYS A 76 135.285 8.583 11.757 1.00 0.00 C ATOM 1002 CG LYS A 76 135.942 8.767 10.398 1.00 0.00 C ATOM 1003 CD LYS A 76 136.118 10.240 10.056 1.00 0.00 C ATOM 1004 CE LYS A 76 137.220 10.880 10.886 1.00 0.00 C ATOM 1005 NZ LYS A 76 136.775 12.154 11.516 1.00 0.00 N ATOM 0 H LYS A 76 134.671 6.214 12.689 1.00 0.00 H new ATOM 0 HA LYS A 76 137.159 7.786 12.446 1.00 0.00 H new ATOM 0 HB2 LYS A 76 134.314 8.108 11.619 1.00 0.00 H new ATOM 0 HB3 LYS A 76 135.100 9.563 12.196 1.00 0.00 H new ATOM 0 HG2 LYS A 76 136.914 8.273 10.393 1.00 0.00 H new ATOM 0 HG3 LYS A 76 135.335 8.285 9.632 1.00 0.00 H new ATOM 0 HD2 LYS A 76 136.354 10.342 8.997 1.00 0.00 H new ATOM 0 HD3 LYS A 76 135.180 10.768 10.227 1.00 0.00 H new ATOM 0 HE2 LYS A 76 137.540 10.184 11.662 1.00 0.00 H new ATOM 0 HE3 LYS A 76 138.086 11.072 10.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 137.556 12.557 12.072 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 136.494 12.828 10.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 135.965 11.968 12.141 1.00 0.00 H new ATOM 1019 N GLY A 77 135.197 7.650 14.971 1.00 0.00 N ATOM 1020 CA GLY A 77 134.974 8.116 16.322 1.00 0.00 C ATOM 1021 C GLY A 77 133.502 8.326 16.592 1.00 0.00 C ATOM 1022 O GLY A 77 133.108 9.297 17.239 1.00 0.00 O ATOM 0 H GLY A 77 134.721 6.779 14.736 1.00 0.00 H new ATOM 0 HA2 GLY A 77 135.377 7.392 17.030 1.00 0.00 H new ATOM 0 HA3 GLY A 77 135.512 9.050 16.481 1.00 0.00 H new ATOM 1026 N GLU A 78 132.686 7.403 16.088 1.00 0.00 N ATOM 1027 CA GLU A 78 131.248 7.468 16.262 1.00 0.00 C ATOM 1028 C GLU A 78 130.659 8.703 15.582 1.00 0.00 C ATOM 1029 O GLU A 78 130.035 9.539 16.238 1.00 0.00 O ATOM 1030 CB GLU A 78 130.916 7.466 17.748 1.00 0.00 C ATOM 1031 CG GLU A 78 129.528 6.931 18.064 1.00 0.00 C ATOM 1032 CD GLU A 78 129.557 5.759 19.025 1.00 0.00 C ATOM 1033 OE1 GLU A 78 130.390 4.850 18.829 1.00 0.00 O ATOM 1034 OE2 GLU A 78 128.746 5.751 19.975 1.00 0.00 O ATOM 0 H GLU A 78 133.006 6.596 15.552 1.00 0.00 H new ATOM 0 HA GLU A 78 130.802 6.593 15.790 1.00 0.00 H new ATOM 0 HB2 GLU A 78 131.656 6.865 18.276 1.00 0.00 H new ATOM 0 HB3 GLU A 78 131.000 8.483 18.131 1.00 0.00 H new ATOM 0 HG2 GLU A 78 128.923 7.731 18.491 1.00 0.00 H new ATOM 0 HG3 GLU A 78 129.042 6.624 17.138 1.00 0.00 H new ATOM 1041 N GLU A 79 130.844 8.816 14.260 1.00 0.00 N ATOM 1042 CA GLU A 79 130.312 9.957 13.522 1.00 0.00 C ATOM 1043 C GLU A 79 131.087 11.230 13.849 1.00 0.00 C ATOM 1044 O GLU A 79 130.742 11.890 14.852 1.00 0.00 O ATOM 1045 CB GLU A 79 128.828 10.154 13.848 1.00 0.00 C ATOM 1046 CG GLU A 79 128.047 10.867 12.758 1.00 0.00 C ATOM 1047 CD GLU A 79 128.484 12.307 12.571 1.00 0.00 C ATOM 1048 OE1 GLU A 79 127.926 13.191 13.254 1.00 0.00 O ATOM 1049 OE2 GLU A 79 129.385 12.551 11.740 1.00 0.00 O ATOM 0 H GLU A 79 131.352 8.139 13.691 1.00 0.00 H new ATOM 0 HA GLU A 79 130.422 9.750 12.457 1.00 0.00 H new ATOM 0 HB2 GLU A 79 128.374 9.180 14.029 1.00 0.00 H new ATOM 0 HB3 GLU A 79 128.742 10.723 14.774 1.00 0.00 H new ATOM 0 HG2 GLU A 79 128.170 10.329 11.818 1.00 0.00 H new ATOM 0 HG3 GLU A 79 126.985 10.843 13.003 1.00 0.00 H new TER 1056 GLU A 79