USER MOD reduce.3.24.130724 H: found=0, std=0, add=1135, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1139 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 149 SER OG : rot 180:sc= -0.562 USER MOD Set 1.2: A 155 THR OG1 : rot -42:sc= -1.3 USER MOD Set 2.1: A 124 HIS :FLIP no HD1:sc= -2.3! C(o=-5!,f=-2.3!) USER MOD Set 2.2: A 125 MET CE :methyl 177:sc=-0.00619 (180deg=-0.0129) USER MOD Set 3.1: A 86 SER OG : rot 174:sc= -1.35! USER MOD Set 3.2: A 92 SER OG : rot -38:sc= 1.61 USER MOD Set 4.1: A 8 LYS NZ :NH3+ -125:sc= -0.918 (180deg=0) USER MOD Set 4.2: A 57 GLN :FLIP amide:sc= -1.68! C(o=-16!,f=-2.6!) USER MOD Set 5.1: A 25 GLN : amide:sc= -7.75! C(o=-16!,f=-24!) USER MOD Set 5.2: A 153 ASN : amide:sc= -7.91! C(o=-16!,f=-19!) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 146:sc= -3.18! (180deg=-3.35!) USER MOD Single : A 20 SER OG : rot 180:sc= 0.089 USER MOD Single : A 21 SER OG : rot -33:sc= -0.716 USER MOD Single : A 23 THR OG1 : rot 54:sc= 0.514 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 ASN : amide:sc= -1.69 X(o=-1.7,f=-2) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0.0258 USER MOD Single : A 44 THR OG1 : rot 180:sc=-0.00431 USER MOD Single : A 45 LYS NZ :NH3+ -178:sc= 1.63 (180deg=1.62) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -5.89! C(o=-5.9!,f=-6.3!) USER MOD Single : A 52 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 54 TYR OH : rot 54:sc= -0.283 USER MOD Single : A 55 HIS : no HD1:sc= -2.49 X(o=-2.5,f=-2.5!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.734 X(o=-0.73,f=-0.32) USER MOD Single : A 81 TYR OH : rot 165:sc= 0 USER MOD Single : A 85 TYR OH : rot -61:sc= 0.0981 USER MOD Single : A 88 THR OG1 : rot -29:sc= 0.348 USER MOD Single : A 89 SER OG : rot 180:sc= 0.0881 USER MOD Single : A 91 LYS NZ :NH3+ 158:sc= -0.228 (180deg=-1.09) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS :FLIP no HD1:sc= -2.71 F(o=-5.4!,f=-2.7) USER MOD Single : A 102 LYS NZ :NH3+ 149:sc= -0.218 (180deg=-1.5!) USER MOD Single : A 111 GLN : amide:sc= -1.39 K(o=-1.4,f=-6.1!) USER MOD Single : A 115 MET CE :methyl 178:sc= -1.77 (180deg=-1.91) USER MOD Single : A 119 ASN : amide:sc= -3.16! C(o=-3.2!,f=-3.5!) USER MOD Single : A 120 LYS NZ :NH3+ 176:sc= 1.26 (180deg=1.23) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 SER OG : rot -59:sc= -3.71! USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0771) USER MOD Single : A 140 SER OG : rot -87:sc= 0.577 USER MOD Single : A 142 ASN : amide:sc= -0.771 K(o=-0.77,f=-3.5!) USER MOD Single : A 148 SER OG : rot 150:sc= -0.163 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 169 LYS NZ :NH3+ 147:sc= -0.245 (180deg=-1.41!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 6 -13.715 -4.328 -5.938 1.00 0.00 N ATOM 2 CA SER A 6 -12.662 -4.024 -6.892 1.00 0.00 C ATOM 3 C SER A 6 -12.009 -2.692 -6.548 1.00 0.00 C ATOM 4 O SER A 6 -12.601 -1.627 -6.726 1.00 0.00 O ATOM 5 CB SER A 6 -13.240 -3.944 -8.291 1.00 0.00 C ATOM 6 OG SER A 6 -12.443 -4.716 -9.179 1.00 0.00 O ATOM 0 HA SER A 6 -11.915 -4.816 -6.847 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.266 -4.312 -8.293 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.273 -2.906 -8.624 1.00 0.00 H new ATOM 0 HG SER A 6 -12.818 -4.665 -10.083 1.00 0.00 H new ATOM 12 N ARG A 7 -10.791 -2.771 -6.052 1.00 0.00 N ATOM 13 CA ARG A 7 -10.035 -1.584 -5.670 1.00 0.00 C ATOM 14 C ARG A 7 -8.577 -1.749 -6.080 1.00 0.00 C ATOM 15 O ARG A 7 -8.003 -2.819 -5.898 1.00 0.00 O ATOM 16 CB ARG A 7 -10.144 -1.356 -4.161 1.00 0.00 C ATOM 17 CG ARG A 7 -11.609 -1.504 -3.737 1.00 0.00 C ATOM 18 CD ARG A 7 -11.787 -1.040 -2.288 1.00 0.00 C ATOM 19 NE ARG A 7 -11.281 -2.052 -1.369 1.00 0.00 N ATOM 20 CZ ARG A 7 -11.798 -2.201 -0.153 1.00 0.00 C ATOM 21 NH1 ARG A 7 -12.762 -1.419 0.252 1.00 0.00 N ATOM 22 NH2 ARG A 7 -11.336 -3.128 0.639 1.00 0.00 N ATOM 0 H ARG A 7 -10.296 -3.650 -5.901 1.00 0.00 H new ATOM 0 HA ARG A 7 -10.448 -0.715 -6.182 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -9.523 -2.075 -3.626 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -9.776 -0.363 -3.903 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -12.248 -0.916 -4.396 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -11.921 -2.544 -3.835 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -11.258 -0.100 -2.132 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -12.841 -0.850 -2.086 1.00 0.00 H new ATOM 0 HE ARG A 7 -10.515 -2.658 -1.664 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -13.121 -0.691 -0.365 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -13.156 -1.537 1.185 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -10.580 -3.737 0.325 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -11.731 -3.245 1.572 1.00 0.00 H new ATOM 36 N LYS A 8 -7.972 -0.705 -6.640 1.00 0.00 N ATOM 37 CA LYS A 8 -6.595 -0.803 -7.060 1.00 0.00 C ATOM 38 C LYS A 8 -5.737 -0.026 -6.085 1.00 0.00 C ATOM 39 O LYS A 8 -6.055 1.100 -5.753 1.00 0.00 O ATOM 40 CB LYS A 8 -6.456 -0.251 -8.481 1.00 0.00 C ATOM 41 CG LYS A 8 -7.770 -0.459 -9.241 1.00 0.00 C ATOM 42 CD LYS A 8 -7.579 -0.079 -10.711 1.00 0.00 C ATOM 43 CE LYS A 8 -8.784 -0.557 -11.523 1.00 0.00 C ATOM 44 NZ LYS A 8 -8.379 -1.708 -12.380 1.00 0.00 N ATOM 0 H LYS A 8 -8.412 0.200 -6.808 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.268 -1.843 -7.068 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.207 0.810 -8.448 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -5.640 -0.754 -9.000 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.087 -1.499 -9.162 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -8.559 0.149 -8.797 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.468 1.001 -10.807 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -6.665 -0.529 -11.098 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -9.592 -0.854 -10.855 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -9.165 0.255 -12.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.612 -1.501 -13.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -7.355 -1.864 -12.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.887 -2.563 -12.076 1.00 0.00 H new ATOM 58 N ILE A 9 -4.677 -0.639 -5.590 1.00 0.00 N ATOM 59 CA ILE A 9 -3.831 0.020 -4.629 1.00 0.00 C ATOM 60 C ILE A 9 -2.535 0.513 -5.300 1.00 0.00 C ATOM 61 O ILE A 9 -1.812 -0.244 -5.917 1.00 0.00 O ATOM 62 CB ILE A 9 -3.556 -0.932 -3.446 1.00 0.00 C ATOM 63 CG1 ILE A 9 -4.688 -2.004 -3.280 1.00 0.00 C ATOM 64 CG2 ILE A 9 -3.451 -0.112 -2.178 1.00 0.00 C ATOM 65 CD1 ILE A 9 -6.014 -1.410 -2.802 1.00 0.00 C ATOM 0 H ILE A 9 -4.388 -1.585 -5.839 1.00 0.00 H new ATOM 0 HA ILE A 9 -4.336 0.902 -4.236 1.00 0.00 H new ATOM 0 HB ILE A 9 -2.625 -1.464 -3.644 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.846 -2.507 -4.234 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -4.360 -2.763 -2.569 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -3.257 -0.772 -1.333 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -2.635 0.604 -2.274 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -4.386 0.423 -2.013 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -6.755 -2.204 -2.707 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -5.870 -0.931 -1.834 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -6.363 -0.672 -3.524 1.00 0.00 H new ATOM 77 N ALA A 10 -2.255 1.807 -5.201 1.00 0.00 N ATOM 78 CA ALA A 10 -1.061 2.366 -5.851 1.00 0.00 C ATOM 79 C ALA A 10 0.171 2.202 -4.978 1.00 0.00 C ATOM 80 O ALA A 10 0.132 2.487 -3.792 1.00 0.00 O ATOM 81 CB ALA A 10 -1.248 3.851 -6.083 1.00 0.00 C ATOM 0 H ALA A 10 -2.822 2.483 -4.689 1.00 0.00 H new ATOM 0 HA ALA A 10 -0.925 1.831 -6.791 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.359 4.259 -6.565 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -2.115 4.013 -6.724 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -1.405 4.352 -5.128 1.00 0.00 H new ATOM 87 N ILE A 11 1.265 1.760 -5.583 1.00 0.00 N ATOM 88 CA ILE A 11 2.511 1.552 -4.844 1.00 0.00 C ATOM 89 C ILE A 11 3.433 2.756 -4.949 1.00 0.00 C ATOM 90 O ILE A 11 3.737 3.237 -6.040 1.00 0.00 O ATOM 91 CB ILE A 11 3.245 0.312 -5.366 1.00 0.00 C ATOM 92 CG1 ILE A 11 2.262 -0.851 -5.557 1.00 0.00 C ATOM 93 CG2 ILE A 11 4.318 -0.101 -4.356 1.00 0.00 C ATOM 94 CD1 ILE A 11 2.968 -1.998 -6.282 1.00 0.00 C ATOM 0 H ILE A 11 1.319 1.539 -6.577 1.00 0.00 H new ATOM 0 HA ILE A 11 2.243 1.409 -3.797 1.00 0.00 H new ATOM 0 HB ILE A 11 3.703 0.551 -6.326 1.00 0.00 H new ATOM 0 HG12 ILE A 11 1.891 -1.191 -4.590 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.397 -0.520 -6.132 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.843 -0.983 -4.723 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.028 0.716 -4.225 1.00 0.00 H new ATOM 0 HG23 ILE A 11 3.848 -0.330 -3.399 1.00 0.00 H new ATOM 0 HD11 ILE A 11 2.272 -2.825 -6.419 1.00 0.00 H new ATOM 0 HD12 ILE A 11 3.317 -1.653 -7.255 1.00 0.00 H new ATOM 0 HD13 ILE A 11 3.819 -2.334 -5.689 1.00 0.00 H new ATOM 106 N LEU A 12 3.870 3.231 -3.786 1.00 0.00 N ATOM 107 CA LEU A 12 4.762 4.382 -3.712 1.00 0.00 C ATOM 108 C LEU A 12 5.985 4.027 -2.866 1.00 0.00 C ATOM 109 O LEU A 12 5.926 4.018 -1.637 1.00 0.00 O ATOM 110 CB LEU A 12 3.982 5.569 -3.120 1.00 0.00 C ATOM 111 CG LEU A 12 4.919 6.674 -2.597 1.00 0.00 C ATOM 112 CD1 LEU A 12 5.834 7.168 -3.715 1.00 0.00 C ATOM 113 CD2 LEU A 12 4.079 7.852 -2.094 1.00 0.00 C ATOM 0 H LEU A 12 3.620 2.835 -2.880 1.00 0.00 H new ATOM 0 HA LEU A 12 5.118 4.662 -4.704 1.00 0.00 H new ATOM 0 HB2 LEU A 12 3.322 5.984 -3.881 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.348 5.216 -2.306 1.00 0.00 H new ATOM 0 HG LEU A 12 5.525 6.266 -1.788 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.490 7.949 -3.330 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.436 6.338 -4.086 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.230 7.570 -4.528 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.738 8.637 -1.723 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.474 8.243 -2.912 1.00 0.00 H new ATOM 0 HD23 LEU A 12 3.426 7.516 -1.289 1.00 0.00 H new ATOM 125 N GLY A 13 7.082 3.698 -3.543 1.00 0.00 N ATOM 126 CA GLY A 13 8.310 3.306 -2.862 1.00 0.00 C ATOM 127 C GLY A 13 9.550 3.846 -3.572 1.00 0.00 C ATOM 128 O GLY A 13 9.654 3.776 -4.796 1.00 0.00 O ATOM 0 H GLY A 13 7.145 3.695 -4.561 1.00 0.00 H new ATOM 0 HA2 GLY A 13 8.290 3.673 -1.836 1.00 0.00 H new ATOM 0 HA3 GLY A 13 8.366 2.219 -2.810 1.00 0.00 H new ATOM 132 N TYR A 14 10.492 4.370 -2.795 1.00 0.00 N ATOM 133 CA TYR A 14 11.731 4.898 -3.358 1.00 0.00 C ATOM 134 C TYR A 14 12.356 3.893 -4.321 1.00 0.00 C ATOM 135 O TYR A 14 11.805 2.827 -4.573 1.00 0.00 O ATOM 136 CB TYR A 14 12.722 5.205 -2.232 1.00 0.00 C ATOM 137 CG TYR A 14 13.237 6.617 -2.380 1.00 0.00 C ATOM 138 CD1 TYR A 14 12.344 7.691 -2.322 1.00 0.00 C ATOM 139 CD2 TYR A 14 14.604 6.852 -2.581 1.00 0.00 C ATOM 140 CE1 TYR A 14 12.817 9.002 -2.465 1.00 0.00 C ATOM 141 CE2 TYR A 14 15.076 8.162 -2.722 1.00 0.00 C ATOM 142 CZ TYR A 14 14.182 9.237 -2.664 1.00 0.00 C ATOM 143 OH TYR A 14 14.646 10.529 -2.805 1.00 0.00 O ATOM 0 H TYR A 14 10.423 4.441 -1.780 1.00 0.00 H new ATOM 0 HA TYR A 14 11.499 5.812 -3.904 1.00 0.00 H new ATOM 0 HB2 TYR A 14 12.236 5.084 -1.264 1.00 0.00 H new ATOM 0 HB3 TYR A 14 13.552 4.499 -2.262 1.00 0.00 H new ATOM 0 HD1 TYR A 14 11.291 7.510 -2.167 1.00 0.00 H new ATOM 0 HD2 TYR A 14 15.293 6.022 -2.627 1.00 0.00 H new ATOM 0 HE1 TYR A 14 12.127 9.832 -2.422 1.00 0.00 H new ATOM 0 HE2 TYR A 14 16.130 8.343 -2.875 1.00 0.00 H new ATOM 0 HH TYR A 14 15.617 10.515 -2.935 1.00 0.00 H new ATOM 153 N ARG A 15 13.510 4.248 -4.859 1.00 0.00 N ATOM 154 CA ARG A 15 14.207 3.374 -5.799 1.00 0.00 C ATOM 155 C ARG A 15 14.856 2.199 -5.069 1.00 0.00 C ATOM 156 O ARG A 15 15.408 2.361 -3.980 1.00 0.00 O ATOM 157 CB ARG A 15 15.280 4.168 -6.545 1.00 0.00 C ATOM 158 CG ARG A 15 15.717 3.398 -7.793 1.00 0.00 C ATOM 159 CD ARG A 15 17.226 3.560 -7.987 1.00 0.00 C ATOM 160 NE ARG A 15 17.617 4.947 -7.756 1.00 0.00 N ATOM 161 CZ ARG A 15 18.844 5.259 -7.349 1.00 0.00 C ATOM 162 NH1 ARG A 15 19.728 4.319 -7.155 1.00 0.00 N ATOM 163 NH2 ARG A 15 19.166 6.508 -7.144 1.00 0.00 N ATOM 0 H ARG A 15 13.986 5.129 -4.665 1.00 0.00 H new ATOM 0 HA ARG A 15 13.479 2.983 -6.510 1.00 0.00 H new ATOM 0 HB2 ARG A 15 14.892 5.147 -6.827 1.00 0.00 H new ATOM 0 HB3 ARG A 15 16.137 4.341 -5.894 1.00 0.00 H new ATOM 0 HG2 ARG A 15 15.464 2.343 -7.690 1.00 0.00 H new ATOM 0 HG3 ARG A 15 15.185 3.770 -8.668 1.00 0.00 H new ATOM 0 HD2 ARG A 15 17.761 2.904 -7.300 1.00 0.00 H new ATOM 0 HD3 ARG A 15 17.505 3.259 -8.997 1.00 0.00 H new ATOM 0 HE ARG A 15 16.936 5.691 -7.910 1.00 0.00 H new ATOM 0 HH11 ARG A 15 19.478 3.343 -7.316 1.00 0.00 H new ATOM 0 HH12 ARG A 15 20.669 4.560 -6.843 1.00 0.00 H new ATOM 0 HH21 ARG A 15 18.476 7.244 -7.296 1.00 0.00 H new ATOM 0 HH22 ARG A 15 20.107 6.747 -6.832 1.00 0.00 H new ATOM 177 N SER A 16 14.800 1.019 -5.684 1.00 0.00 N ATOM 178 CA SER A 16 15.396 -0.170 -5.096 1.00 0.00 C ATOM 179 C SER A 16 14.902 -0.400 -3.670 1.00 0.00 C ATOM 180 O SER A 16 15.537 -1.120 -2.895 1.00 0.00 O ATOM 181 CB SER A 16 16.907 -0.027 -5.098 1.00 0.00 C ATOM 182 OG SER A 16 17.339 0.392 -6.386 1.00 0.00 O ATOM 0 H SER A 16 14.349 0.865 -6.586 1.00 0.00 H new ATOM 0 HA SER A 16 15.099 -1.032 -5.694 1.00 0.00 H new ATOM 0 HB2 SER A 16 17.216 0.698 -4.345 1.00 0.00 H new ATOM 0 HB3 SER A 16 17.374 -0.977 -4.837 1.00 0.00 H new ATOM 0 HG SER A 16 18.314 0.487 -6.389 1.00 0.00 H new ATOM 188 N VAL A 17 13.770 0.206 -3.322 1.00 0.00 N ATOM 189 CA VAL A 17 13.223 0.038 -1.981 1.00 0.00 C ATOM 190 C VAL A 17 12.728 -1.393 -1.783 1.00 0.00 C ATOM 191 O VAL A 17 12.508 -1.838 -0.657 1.00 0.00 O ATOM 192 CB VAL A 17 12.064 1.013 -1.738 1.00 0.00 C ATOM 193 CG1 VAL A 17 10.874 0.644 -2.620 1.00 0.00 C ATOM 194 CG2 VAL A 17 11.613 0.905 -0.290 1.00 0.00 C ATOM 0 H VAL A 17 13.223 0.807 -3.938 1.00 0.00 H new ATOM 0 HA VAL A 17 14.019 0.248 -1.267 1.00 0.00 H new ATOM 0 HB VAL A 17 12.405 2.022 -1.968 1.00 0.00 H new ATOM 0 HG11 VAL A 17 10.057 1.342 -2.439 1.00 0.00 H new ATOM 0 HG12 VAL A 17 11.169 0.694 -3.668 1.00 0.00 H new ATOM 0 HG13 VAL A 17 10.545 -0.368 -2.383 1.00 0.00 H new ATOM 0 HG21 VAL A 17 10.789 1.596 -0.113 1.00 0.00 H new ATOM 0 HG22 VAL A 17 11.282 -0.113 -0.087 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.444 1.154 0.370 1.00 0.00 H new ATOM 204 N GLY A 18 12.541 -2.102 -2.895 1.00 0.00 N ATOM 205 CA GLY A 18 12.059 -3.475 -2.843 1.00 0.00 C ATOM 206 C GLY A 18 10.586 -3.553 -3.234 1.00 0.00 C ATOM 207 O GLY A 18 9.860 -4.435 -2.776 1.00 0.00 O ATOM 0 H GLY A 18 12.715 -1.749 -3.836 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.651 -4.097 -3.514 1.00 0.00 H new ATOM 0 HA3 GLY A 18 12.194 -3.874 -1.837 1.00 0.00 H new ATOM 211 N LYS A 19 10.150 -2.629 -4.084 1.00 0.00 N ATOM 212 CA LYS A 19 8.759 -2.614 -4.526 1.00 0.00 C ATOM 213 C LYS A 19 8.445 -3.869 -5.333 1.00 0.00 C ATOM 214 O LYS A 19 7.594 -4.669 -4.952 1.00 0.00 O ATOM 215 CB LYS A 19 8.494 -1.384 -5.405 1.00 0.00 C ATOM 216 CG LYS A 19 7.908 -0.233 -4.573 1.00 0.00 C ATOM 217 CD LYS A 19 7.419 0.879 -5.507 1.00 0.00 C ATOM 218 CE LYS A 19 8.542 1.302 -6.458 1.00 0.00 C ATOM 219 NZ LYS A 19 9.841 1.324 -5.727 1.00 0.00 N ATOM 0 H LYS A 19 10.731 -1.889 -4.477 1.00 0.00 H new ATOM 0 HA LYS A 19 8.123 -2.579 -3.641 1.00 0.00 H new ATOM 0 HB2 LYS A 19 9.423 -1.062 -5.876 1.00 0.00 H new ATOM 0 HB3 LYS A 19 7.804 -1.647 -6.207 1.00 0.00 H new ATOM 0 HG2 LYS A 19 7.083 -0.597 -3.961 1.00 0.00 H new ATOM 0 HG3 LYS A 19 8.663 0.157 -3.891 1.00 0.00 H new ATOM 0 HD2 LYS A 19 6.559 0.531 -6.080 1.00 0.00 H new ATOM 0 HD3 LYS A 19 7.086 1.736 -4.921 1.00 0.00 H new ATOM 0 HE2 LYS A 19 8.599 0.610 -7.299 1.00 0.00 H new ATOM 0 HE3 LYS A 19 8.330 2.288 -6.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 10.606 1.039 -6.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 10.025 2.285 -5.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 9.799 0.664 -4.925 1.00 0.00 H new ATOM 233 N SER A 20 9.133 -4.019 -6.458 1.00 0.00 N ATOM 234 CA SER A 20 8.919 -5.165 -7.335 1.00 0.00 C ATOM 235 C SER A 20 9.107 -6.486 -6.591 1.00 0.00 C ATOM 236 O SER A 20 8.505 -7.497 -6.952 1.00 0.00 O ATOM 237 CB SER A 20 9.891 -5.098 -8.514 1.00 0.00 C ATOM 238 OG SER A 20 10.130 -3.736 -8.850 1.00 0.00 O ATOM 0 H SER A 20 9.843 -3.363 -6.785 1.00 0.00 H new ATOM 0 HA SER A 20 7.891 -5.125 -7.695 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.828 -5.591 -8.256 1.00 0.00 H new ATOM 0 HB3 SER A 20 9.478 -5.629 -9.372 1.00 0.00 H new ATOM 0 HG SER A 20 10.754 -3.690 -9.604 1.00 0.00 H new ATOM 244 N SER A 21 9.943 -6.481 -5.557 1.00 0.00 N ATOM 245 CA SER A 21 10.191 -7.690 -4.797 1.00 0.00 C ATOM 246 C SER A 21 8.951 -8.103 -4.020 1.00 0.00 C ATOM 247 O SER A 21 8.525 -9.256 -4.094 1.00 0.00 O ATOM 248 CB SER A 21 11.354 -7.464 -3.840 1.00 0.00 C ATOM 249 OG SER A 21 10.966 -6.515 -2.857 1.00 0.00 O ATOM 0 H SER A 21 10.453 -5.659 -5.233 1.00 0.00 H new ATOM 0 HA SER A 21 10.443 -8.492 -5.491 1.00 0.00 H new ATOM 0 HB2 SER A 21 11.639 -8.403 -3.365 1.00 0.00 H new ATOM 0 HB3 SER A 21 12.227 -7.105 -4.386 1.00 0.00 H new ATOM 0 HG SER A 21 10.350 -5.865 -3.255 1.00 0.00 H new ATOM 255 N LEU A 22 8.364 -7.170 -3.271 1.00 0.00 N ATOM 256 CA LEU A 22 7.177 -7.510 -2.505 1.00 0.00 C ATOM 257 C LEU A 22 5.948 -7.566 -3.403 1.00 0.00 C ATOM 258 O LEU A 22 4.993 -8.273 -3.102 1.00 0.00 O ATOM 259 CB LEU A 22 6.936 -6.537 -1.344 1.00 0.00 C ATOM 260 CG LEU A 22 5.669 -6.947 -0.570 1.00 0.00 C ATOM 261 CD1 LEU A 22 5.795 -8.399 -0.083 1.00 0.00 C ATOM 262 CD2 LEU A 22 5.504 -6.025 0.639 1.00 0.00 C ATOM 0 H LEU A 22 8.681 -6.205 -3.182 1.00 0.00 H new ATOM 0 HA LEU A 22 7.352 -8.497 -2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 22 7.797 -6.535 -0.675 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.827 -5.522 -1.726 1.00 0.00 H new ATOM 0 HG LEU A 22 4.803 -6.865 -1.227 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.894 -8.679 0.463 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.920 -9.061 -0.940 1.00 0.00 H new ATOM 0 HD13 LEU A 22 6.660 -8.489 0.574 1.00 0.00 H new ATOM 0 HD21 LEU A 22 4.609 -6.308 1.193 1.00 0.00 H new ATOM 0 HD22 LEU A 22 6.376 -6.115 1.287 1.00 0.00 H new ATOM 0 HD23 LEU A 22 5.409 -4.993 0.300 1.00 0.00 H new ATOM 274 N THR A 23 5.968 -6.828 -4.506 1.00 0.00 N ATOM 275 CA THR A 23 4.845 -6.839 -5.414 1.00 0.00 C ATOM 276 C THR A 23 4.640 -8.256 -5.927 1.00 0.00 C ATOM 277 O THR A 23 3.514 -8.735 -6.003 1.00 0.00 O ATOM 278 CB THR A 23 5.113 -5.888 -6.583 1.00 0.00 C ATOM 279 OG1 THR A 23 5.450 -4.603 -6.078 1.00 0.00 O ATOM 280 CG2 THR A 23 3.867 -5.783 -7.455 1.00 0.00 C ATOM 0 H THR A 23 6.742 -6.224 -4.785 1.00 0.00 H new ATOM 0 HA THR A 23 3.946 -6.506 -4.895 1.00 0.00 H new ATOM 0 HB THR A 23 5.939 -6.273 -7.181 1.00 0.00 H new ATOM 0 HG1 THR A 23 6.191 -4.685 -5.442 1.00 0.00 H new ATOM 0 HG21 THR A 23 4.061 -5.105 -8.286 1.00 0.00 H new ATOM 0 HG22 THR A 23 3.610 -6.769 -7.843 1.00 0.00 H new ATOM 0 HG23 THR A 23 3.038 -5.400 -6.860 1.00 0.00 H new ATOM 288 N ILE A 24 5.744 -8.911 -6.272 1.00 0.00 N ATOM 289 CA ILE A 24 5.697 -10.278 -6.777 1.00 0.00 C ATOM 290 C ILE A 24 5.500 -11.273 -5.630 1.00 0.00 C ATOM 291 O ILE A 24 4.735 -12.226 -5.754 1.00 0.00 O ATOM 292 CB ILE A 24 7.007 -10.597 -7.526 1.00 0.00 C ATOM 293 CG1 ILE A 24 6.925 -10.171 -9.004 1.00 0.00 C ATOM 294 CG2 ILE A 24 7.288 -12.096 -7.463 1.00 0.00 C ATOM 295 CD1 ILE A 24 7.217 -8.676 -9.126 1.00 0.00 C ATOM 0 H ILE A 24 6.683 -8.517 -6.211 1.00 0.00 H new ATOM 0 HA ILE A 24 4.853 -10.369 -7.461 1.00 0.00 H new ATOM 0 HB ILE A 24 7.810 -10.040 -7.043 1.00 0.00 H new ATOM 0 HG12 ILE A 24 7.641 -10.741 -9.597 1.00 0.00 H new ATOM 0 HG13 ILE A 24 5.934 -10.392 -9.402 1.00 0.00 H new ATOM 0 HG21 ILE A 24 8.214 -12.315 -7.994 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.384 -12.405 -6.422 1.00 0.00 H new ATOM 0 HG23 ILE A 24 6.466 -12.640 -7.928 1.00 0.00 H new ATOM 0 HD11 ILE A 24 7.158 -8.378 -10.173 1.00 0.00 H new ATOM 0 HD12 ILE A 24 6.484 -8.114 -8.547 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.217 -8.468 -8.745 1.00 0.00 H new ATOM 307 N GLN A 25 6.206 -11.068 -4.523 1.00 0.00 N ATOM 308 CA GLN A 25 6.094 -11.981 -3.389 1.00 0.00 C ATOM 309 C GLN A 25 4.711 -11.909 -2.753 1.00 0.00 C ATOM 310 O GLN A 25 4.216 -12.899 -2.228 1.00 0.00 O ATOM 311 CB GLN A 25 7.153 -11.647 -2.339 1.00 0.00 C ATOM 312 CG GLN A 25 7.099 -12.659 -1.194 1.00 0.00 C ATOM 313 CD GLN A 25 6.421 -12.033 0.015 1.00 0.00 C ATOM 314 OE1 GLN A 25 5.236 -12.266 0.256 1.00 0.00 O ATOM 315 NE2 GLN A 25 7.116 -11.253 0.797 1.00 0.00 N ATOM 0 H GLN A 25 6.852 -10.291 -4.386 1.00 0.00 H new ATOM 0 HA GLN A 25 6.251 -12.993 -3.761 1.00 0.00 H new ATOM 0 HB2 GLN A 25 8.143 -11.655 -2.795 1.00 0.00 H new ATOM 0 HB3 GLN A 25 6.988 -10.641 -1.953 1.00 0.00 H new ATOM 0 HG2 GLN A 25 6.553 -13.549 -1.508 1.00 0.00 H new ATOM 0 HG3 GLN A 25 8.107 -12.979 -0.932 1.00 0.00 H new ATOM 0 HE21 GLN A 25 8.097 -11.066 0.589 1.00 0.00 H new ATOM 0 HE22 GLN A 25 6.678 -10.831 1.616 1.00 0.00 H new ATOM 324 N PHE A 26 4.106 -10.732 -2.795 1.00 0.00 N ATOM 325 CA PHE A 26 2.783 -10.522 -2.212 1.00 0.00 C ATOM 326 C PHE A 26 1.685 -11.076 -3.111 1.00 0.00 C ATOM 327 O PHE A 26 0.939 -11.978 -2.730 1.00 0.00 O ATOM 328 CB PHE A 26 2.551 -9.024 -2.020 1.00 0.00 C ATOM 329 CG PHE A 26 1.166 -8.783 -1.479 1.00 0.00 C ATOM 330 CD1 PHE A 26 0.086 -8.633 -2.357 1.00 0.00 C ATOM 331 CD2 PHE A 26 0.964 -8.699 -0.099 1.00 0.00 C ATOM 332 CE1 PHE A 26 -1.198 -8.401 -1.852 1.00 0.00 C ATOM 333 CE2 PHE A 26 -0.317 -8.467 0.407 1.00 0.00 C ATOM 334 CZ PHE A 26 -1.400 -8.317 -0.469 1.00 0.00 C ATOM 0 H PHE A 26 4.510 -9.902 -3.228 1.00 0.00 H new ATOM 0 HA PHE A 26 2.746 -11.045 -1.257 1.00 0.00 H new ATOM 0 HB2 PHE A 26 3.294 -8.617 -1.334 1.00 0.00 H new ATOM 0 HB3 PHE A 26 2.675 -8.504 -2.970 1.00 0.00 H new ATOM 0 HD1 PHE A 26 0.244 -8.696 -3.424 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.799 -8.814 0.577 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -2.032 -8.287 -2.528 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -0.473 -8.403 1.474 1.00 0.00 H new ATOM 0 HZ PHE A 26 -2.390 -8.137 -0.078 1.00 0.00 H new ATOM 344 N VAL A 27 1.592 -10.505 -4.301 1.00 0.00 N ATOM 345 CA VAL A 27 0.583 -10.902 -5.272 1.00 0.00 C ATOM 346 C VAL A 27 0.530 -12.417 -5.426 1.00 0.00 C ATOM 347 O VAL A 27 -0.545 -13.016 -5.384 1.00 0.00 O ATOM 348 CB VAL A 27 0.905 -10.248 -6.607 1.00 0.00 C ATOM 349 CG1 VAL A 27 2.233 -10.792 -7.126 1.00 0.00 C ATOM 350 CG2 VAL A 27 -0.196 -10.552 -7.612 1.00 0.00 C ATOM 0 H VAL A 27 2.209 -9.758 -4.621 1.00 0.00 H new ATOM 0 HA VAL A 27 -0.396 -10.574 -4.922 1.00 0.00 H new ATOM 0 HB VAL A 27 0.976 -9.169 -6.472 1.00 0.00 H new ATOM 0 HG11 VAL A 27 2.468 -10.326 -8.083 1.00 0.00 H new ATOM 0 HG12 VAL A 27 3.023 -10.568 -6.409 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.158 -11.871 -7.257 1.00 0.00 H new ATOM 0 HG21 VAL A 27 0.041 -10.080 -8.566 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.275 -11.630 -7.750 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -1.144 -10.163 -7.241 1.00 0.00 H new ATOM 360 N GLU A 28 1.693 -13.035 -5.582 1.00 0.00 N ATOM 361 CA GLU A 28 1.762 -14.481 -5.715 1.00 0.00 C ATOM 362 C GLU A 28 1.748 -15.096 -4.337 1.00 0.00 C ATOM 363 O GLU A 28 1.374 -16.255 -4.154 1.00 0.00 O ATOM 364 CB GLU A 28 3.045 -14.897 -6.432 1.00 0.00 C ATOM 365 CG GLU A 28 2.695 -15.676 -7.701 1.00 0.00 C ATOM 366 CD GLU A 28 1.995 -16.981 -7.337 1.00 0.00 C ATOM 367 OE1 GLU A 28 2.554 -17.732 -6.554 1.00 0.00 O ATOM 368 OE2 GLU A 28 0.911 -17.212 -7.847 1.00 0.00 O ATOM 0 H GLU A 28 2.595 -12.560 -5.619 1.00 0.00 H new ATOM 0 HA GLU A 28 0.908 -14.824 -6.299 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.634 -14.016 -6.685 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.658 -15.512 -5.773 1.00 0.00 H new ATOM 0 HG2 GLU A 28 2.050 -15.074 -8.341 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.601 -15.886 -8.270 1.00 0.00 H new ATOM 375 N GLY A 29 2.184 -14.305 -3.368 1.00 0.00 N ATOM 376 CA GLY A 29 2.247 -14.767 -2.005 1.00 0.00 C ATOM 377 C GLY A 29 3.387 -15.761 -1.861 1.00 0.00 C ATOM 378 O GLY A 29 3.334 -16.671 -1.033 1.00 0.00 O ATOM 0 H GLY A 29 2.497 -13.344 -3.508 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.397 -13.924 -1.330 1.00 0.00 H new ATOM 0 HA3 GLY A 29 1.304 -15.236 -1.724 1.00 0.00 H new ATOM 382 N GLN A 30 4.410 -15.593 -2.696 1.00 0.00 N ATOM 383 CA GLN A 30 5.545 -16.497 -2.675 1.00 0.00 C ATOM 384 C GLN A 30 6.859 -15.770 -2.978 1.00 0.00 C ATOM 385 O GLN A 30 7.001 -15.121 -4.012 1.00 0.00 O ATOM 386 CB GLN A 30 5.319 -17.597 -3.712 1.00 0.00 C ATOM 387 CG GLN A 30 6.370 -18.679 -3.523 1.00 0.00 C ATOM 388 CD GLN A 30 5.729 -19.937 -2.948 1.00 0.00 C ATOM 389 OE1 GLN A 30 5.804 -21.006 -3.554 1.00 0.00 O ATOM 390 NE2 GLN A 30 5.099 -19.873 -1.807 1.00 0.00 N ATOM 0 H GLN A 30 4.472 -14.845 -3.387 1.00 0.00 H new ATOM 0 HA GLN A 30 5.626 -16.922 -1.674 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.320 -18.019 -3.602 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.381 -17.184 -4.719 1.00 0.00 H new ATOM 0 HG2 GLN A 30 6.844 -18.907 -4.478 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.154 -18.323 -2.855 1.00 0.00 H new ATOM 0 HE21 GLN A 30 5.038 -18.986 -1.307 1.00 0.00 H new ATOM 0 HE22 GLN A 30 4.667 -20.710 -1.415 1.00 0.00 H new ATOM 399 N PHE A 31 7.825 -15.922 -2.077 1.00 0.00 N ATOM 400 CA PHE A 31 9.139 -15.313 -2.236 1.00 0.00 C ATOM 401 C PHE A 31 9.933 -16.040 -3.315 1.00 0.00 C ATOM 402 O PHE A 31 10.602 -17.037 -3.043 1.00 0.00 O ATOM 403 CB PHE A 31 9.897 -15.395 -0.907 1.00 0.00 C ATOM 404 CG PHE A 31 11.382 -15.377 -1.167 1.00 0.00 C ATOM 405 CD1 PHE A 31 11.920 -14.424 -2.032 1.00 0.00 C ATOM 406 CD2 PHE A 31 12.218 -16.309 -0.541 1.00 0.00 C ATOM 407 CE1 PHE A 31 13.299 -14.397 -2.276 1.00 0.00 C ATOM 408 CE2 PHE A 31 13.596 -16.285 -0.784 1.00 0.00 C ATOM 409 CZ PHE A 31 14.137 -15.328 -1.652 1.00 0.00 C ATOM 0 H PHE A 31 7.719 -16.467 -1.222 1.00 0.00 H new ATOM 0 HA PHE A 31 9.014 -14.271 -2.531 1.00 0.00 H new ATOM 0 HB2 PHE A 31 9.620 -14.557 -0.267 1.00 0.00 H new ATOM 0 HB3 PHE A 31 9.622 -16.306 -0.376 1.00 0.00 H new ATOM 0 HD1 PHE A 31 11.273 -13.706 -2.514 1.00 0.00 H new ATOM 0 HD2 PHE A 31 11.800 -17.046 0.129 1.00 0.00 H new ATOM 0 HE1 PHE A 31 13.715 -13.658 -2.945 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.242 -17.004 -0.302 1.00 0.00 H new ATOM 0 HZ PHE A 31 15.200 -15.309 -1.840 1.00 0.00 H new ATOM 538 N GLU A 40 8.168 -0.620 -14.279 1.00 0.00 N ATOM 539 CA GLU A 40 6.851 -0.253 -13.793 1.00 0.00 C ATOM 540 C GLU A 40 5.787 -1.135 -14.435 1.00 0.00 C ATOM 541 O GLU A 40 5.949 -1.583 -15.570 1.00 0.00 O ATOM 542 CB GLU A 40 6.571 1.214 -14.116 1.00 0.00 C ATOM 543 CG GLU A 40 6.877 1.481 -15.591 1.00 0.00 C ATOM 544 CD GLU A 40 8.084 2.405 -15.714 1.00 0.00 C ATOM 545 OE1 GLU A 40 7.956 3.565 -15.357 1.00 0.00 O ATOM 546 OE2 GLU A 40 9.119 1.940 -16.163 1.00 0.00 O ATOM 0 HA GLU A 40 6.822 -0.396 -12.713 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.529 1.452 -13.901 1.00 0.00 H new ATOM 0 HB3 GLU A 40 7.182 1.859 -13.485 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.074 0.541 -16.106 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.011 1.934 -16.074 1.00 0.00 H new ATOM 553 N ASN A 41 4.708 -1.400 -13.704 1.00 0.00 N ATOM 554 CA ASN A 41 3.654 -2.253 -14.236 1.00 0.00 C ATOM 555 C ASN A 41 2.491 -2.412 -13.267 1.00 0.00 C ATOM 556 O ASN A 41 2.539 -1.957 -12.124 1.00 0.00 O ATOM 557 CB ASN A 41 4.241 -3.623 -14.509 1.00 0.00 C ATOM 558 CG ASN A 41 4.483 -3.811 -16.002 1.00 0.00 C ATOM 559 OD1 ASN A 41 3.615 -3.499 -16.817 1.00 0.00 O ATOM 560 ND2 ASN A 41 5.619 -4.304 -16.411 1.00 0.00 N ATOM 0 H ASN A 41 4.543 -1.045 -12.762 1.00 0.00 H new ATOM 0 HA ASN A 41 3.271 -1.786 -15.143 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.178 -3.739 -13.965 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.563 -4.395 -14.144 1.00 0.00 H new ATOM 0 HD21 ASN A 41 5.790 -4.432 -17.408 1.00 0.00 H new ATOM 0 HD22 ASN A 41 6.337 -4.562 -15.733 1.00 0.00 H new ATOM 567 N THR A 42 1.448 -3.079 -13.752 1.00 0.00 N ATOM 568 CA THR A 42 0.258 -3.331 -12.966 1.00 0.00 C ATOM 569 C THR A 42 0.178 -4.808 -12.581 1.00 0.00 C ATOM 570 O THR A 42 0.434 -5.688 -13.402 1.00 0.00 O ATOM 571 CB THR A 42 -0.975 -2.959 -13.794 1.00 0.00 C ATOM 572 OG1 THR A 42 -0.669 -3.108 -15.173 1.00 0.00 O ATOM 573 CG2 THR A 42 -1.398 -1.510 -13.526 1.00 0.00 C ATOM 0 H THR A 42 1.410 -3.457 -14.699 1.00 0.00 H new ATOM 0 HA THR A 42 0.297 -2.731 -12.057 1.00 0.00 H new ATOM 0 HB THR A 42 -1.796 -3.618 -13.512 1.00 0.00 H new ATOM 0 HG1 THR A 42 -1.455 -2.873 -15.710 1.00 0.00 H new ATOM 0 HG21 THR A 42 -2.276 -1.270 -14.126 1.00 0.00 H new ATOM 0 HG22 THR A 42 -1.637 -1.390 -12.469 1.00 0.00 H new ATOM 0 HG23 THR A 42 -0.582 -0.838 -13.792 1.00 0.00 H new ATOM 581 N PHE A 43 -0.188 -5.063 -11.330 1.00 0.00 N ATOM 582 CA PHE A 43 -0.313 -6.429 -10.831 1.00 0.00 C ATOM 583 C PHE A 43 -1.716 -6.659 -10.322 1.00 0.00 C ATOM 584 O PHE A 43 -2.483 -5.713 -10.161 1.00 0.00 O ATOM 585 CB PHE A 43 0.686 -6.678 -9.698 1.00 0.00 C ATOM 586 CG PHE A 43 2.093 -6.722 -10.248 1.00 0.00 C ATOM 587 CD1 PHE A 43 2.668 -5.572 -10.806 1.00 0.00 C ATOM 588 CD2 PHE A 43 2.821 -7.916 -10.203 1.00 0.00 C ATOM 589 CE1 PHE A 43 3.970 -5.619 -11.318 1.00 0.00 C ATOM 590 CE2 PHE A 43 4.122 -7.963 -10.718 1.00 0.00 C ATOM 591 CZ PHE A 43 4.696 -6.814 -11.275 1.00 0.00 C ATOM 0 H PHE A 43 -0.404 -4.342 -10.642 1.00 0.00 H new ATOM 0 HA PHE A 43 -0.101 -7.119 -11.648 1.00 0.00 H new ATOM 0 HB2 PHE A 43 0.604 -5.889 -8.950 1.00 0.00 H new ATOM 0 HB3 PHE A 43 0.453 -7.618 -9.197 1.00 0.00 H new ATOM 0 HD1 PHE A 43 2.107 -4.650 -10.841 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.379 -8.802 -9.771 1.00 0.00 H new ATOM 0 HE1 PHE A 43 4.414 -4.733 -11.746 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.683 -8.885 -10.686 1.00 0.00 H new ATOM 0 HZ PHE A 43 5.700 -6.850 -11.672 1.00 0.00 H new ATOM 601 N THR A 44 -2.055 -7.918 -10.083 1.00 0.00 N ATOM 602 CA THR A 44 -3.374 -8.235 -9.614 1.00 0.00 C ATOM 603 C THR A 44 -3.380 -9.423 -8.671 1.00 0.00 C ATOM 604 O THR A 44 -2.578 -10.346 -8.799 1.00 0.00 O ATOM 605 CB THR A 44 -4.277 -8.533 -10.805 1.00 0.00 C ATOM 606 OG1 THR A 44 -3.573 -8.294 -12.015 1.00 0.00 O ATOM 607 CG2 THR A 44 -5.505 -7.650 -10.743 1.00 0.00 C ATOM 0 H THR A 44 -1.436 -8.719 -10.207 1.00 0.00 H new ATOM 0 HA THR A 44 -3.741 -7.371 -9.060 1.00 0.00 H new ATOM 0 HB THR A 44 -4.583 -9.579 -10.772 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.157 -8.488 -12.777 1.00 0.00 H new ATOM 0 HG21 THR A 44 -6.150 -7.864 -11.595 1.00 0.00 H new ATOM 0 HG22 THR A 44 -6.048 -7.846 -9.818 1.00 0.00 H new ATOM 0 HG23 THR A 44 -5.202 -6.603 -10.771 1.00 0.00 H new ATOM 615 N LYS A 45 -4.313 -9.386 -7.727 1.00 0.00 N ATOM 616 CA LYS A 45 -4.444 -10.457 -6.754 1.00 0.00 C ATOM 617 C LYS A 45 -5.902 -10.653 -6.351 1.00 0.00 C ATOM 618 O LYS A 45 -6.502 -9.789 -5.711 1.00 0.00 O ATOM 619 CB LYS A 45 -3.610 -10.139 -5.512 1.00 0.00 C ATOM 620 CG LYS A 45 -3.431 -11.408 -4.677 1.00 0.00 C ATOM 621 CD LYS A 45 -3.023 -11.029 -3.251 1.00 0.00 C ATOM 622 CE LYS A 45 -2.911 -12.295 -2.398 1.00 0.00 C ATOM 623 NZ LYS A 45 -1.629 -12.989 -2.707 1.00 0.00 N ATOM 0 H LYS A 45 -4.986 -8.628 -7.617 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.083 -11.378 -7.212 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -2.637 -9.744 -5.806 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -4.101 -9.367 -4.919 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.359 -11.979 -4.661 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -2.671 -12.047 -5.126 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -2.070 -10.500 -3.263 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -3.759 -10.351 -2.819 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -2.952 -12.038 -1.339 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -3.753 -12.957 -2.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -1.567 -13.867 -2.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -1.593 -13.216 -3.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -0.831 -12.369 -2.463 1.00 0.00 H new ATOM 637 N LEU A 46 -6.463 -11.794 -6.736 1.00 0.00 N ATOM 638 CA LEU A 46 -7.846 -12.106 -6.424 1.00 0.00 C ATOM 639 C LEU A 46 -7.910 -13.167 -5.328 1.00 0.00 C ATOM 640 O LEU A 46 -7.394 -14.272 -5.490 1.00 0.00 O ATOM 641 CB LEU A 46 -8.555 -12.640 -7.671 1.00 0.00 C ATOM 642 CG LEU A 46 -8.805 -11.504 -8.669 1.00 0.00 C ATOM 643 CD1 LEU A 46 -7.522 -11.175 -9.428 1.00 0.00 C ATOM 644 CD2 LEU A 46 -9.885 -11.929 -9.666 1.00 0.00 C ATOM 0 H LEU A 46 -5.977 -12.517 -7.266 1.00 0.00 H new ATOM 0 HA LEU A 46 -8.338 -11.195 -6.082 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -7.949 -13.416 -8.138 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.502 -13.101 -7.390 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.132 -10.620 -8.122 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -7.714 -10.367 -10.133 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -6.751 -10.866 -8.722 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -7.184 -12.058 -9.971 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -10.063 -11.121 -10.376 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -9.555 -12.818 -10.203 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -10.808 -12.151 -9.130 1.00 0.00 H new ATOM 656 N ILE A 47 -8.541 -12.819 -4.211 1.00 0.00 N ATOM 657 CA ILE A 47 -8.662 -13.745 -3.089 1.00 0.00 C ATOM 658 C ILE A 47 -9.997 -13.548 -2.378 1.00 0.00 C ATOM 659 O ILE A 47 -10.678 -12.548 -2.596 1.00 0.00 O ATOM 660 CB ILE A 47 -7.514 -13.532 -2.096 1.00 0.00 C ATOM 661 CG1 ILE A 47 -6.778 -12.225 -2.416 1.00 0.00 C ATOM 662 CG2 ILE A 47 -6.533 -14.701 -2.196 1.00 0.00 C ATOM 663 CD1 ILE A 47 -7.746 -11.047 -2.294 1.00 0.00 C ATOM 0 H ILE A 47 -8.974 -11.908 -4.058 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.613 -14.762 -3.478 1.00 0.00 H new ATOM 0 HB ILE A 47 -7.922 -13.476 -1.087 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -5.939 -12.092 -1.733 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -6.365 -12.266 -3.424 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -5.716 -14.551 -1.491 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.050 -15.631 -1.960 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.133 -14.755 -3.209 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.221 -10.119 -2.522 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -8.570 -11.179 -2.995 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.138 -11.002 -1.278 1.00 0.00 H new ATOM 675 N THR A 48 -10.368 -14.513 -1.539 1.00 0.00 N ATOM 676 CA THR A 48 -11.634 -14.441 -0.812 1.00 0.00 C ATOM 677 C THR A 48 -11.409 -14.350 0.695 1.00 0.00 C ATOM 678 O THR A 48 -10.746 -15.203 1.285 1.00 0.00 O ATOM 679 CB THR A 48 -12.473 -15.678 -1.122 1.00 0.00 C ATOM 680 OG1 THR A 48 -12.392 -15.967 -2.511 1.00 0.00 O ATOM 681 CG2 THR A 48 -13.929 -15.423 -0.734 1.00 0.00 C ATOM 0 H THR A 48 -9.815 -15.348 -1.346 1.00 0.00 H new ATOM 0 HA THR A 48 -12.156 -13.540 -1.135 1.00 0.00 H new ATOM 0 HB THR A 48 -12.094 -16.526 -0.552 1.00 0.00 H new ATOM 0 HG1 THR A 48 -12.929 -16.762 -2.712 1.00 0.00 H new ATOM 0 HG21 THR A 48 -14.525 -16.308 -0.957 1.00 0.00 H new ATOM 0 HG22 THR A 48 -13.988 -15.204 0.332 1.00 0.00 H new ATOM 0 HG23 THR A 48 -14.313 -14.575 -1.300 1.00 0.00 H new ATOM 689 N VAL A 49 -11.981 -13.316 1.311 1.00 0.00 N ATOM 690 CA VAL A 49 -11.859 -13.120 2.751 1.00 0.00 C ATOM 691 C VAL A 49 -13.244 -13.145 3.394 1.00 0.00 C ATOM 692 O VAL A 49 -14.095 -12.309 3.091 1.00 0.00 O ATOM 693 CB VAL A 49 -11.173 -11.784 3.034 1.00 0.00 C ATOM 694 CG1 VAL A 49 -12.036 -10.643 2.497 1.00 0.00 C ATOM 695 CG2 VAL A 49 -10.974 -11.615 4.544 1.00 0.00 C ATOM 0 H VAL A 49 -12.533 -12.603 0.834 1.00 0.00 H new ATOM 0 HA VAL A 49 -11.257 -13.924 3.175 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.201 -11.765 2.541 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.546 -9.690 2.699 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -12.168 -10.762 1.422 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -13.010 -10.662 2.987 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.485 -10.661 4.742 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -11.943 -11.636 5.043 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -10.353 -12.427 4.922 1.00 0.00 H new ATOM 705 N ASN A 50 -13.469 -14.115 4.273 1.00 0.00 N ATOM 706 CA ASN A 50 -14.762 -14.240 4.937 1.00 0.00 C ATOM 707 C ASN A 50 -15.821 -14.688 3.937 1.00 0.00 C ATOM 708 O ASN A 50 -17.008 -14.407 4.105 1.00 0.00 O ATOM 709 CB ASN A 50 -15.174 -12.897 5.545 1.00 0.00 C ATOM 710 CG ASN A 50 -13.940 -12.118 5.987 1.00 0.00 C ATOM 711 OD1 ASN A 50 -13.755 -10.968 5.587 1.00 0.00 O ATOM 712 ND2 ASN A 50 -13.081 -12.676 6.795 1.00 0.00 N ATOM 0 H ASN A 50 -12.782 -14.819 4.541 1.00 0.00 H new ATOM 0 HA ASN A 50 -14.676 -14.983 5.730 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -15.737 -12.316 4.814 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -15.833 -13.062 6.397 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -12.255 -12.160 7.096 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -13.236 -13.629 7.125 1.00 0.00 H new ATOM 719 N GLY A 51 -15.381 -15.378 2.890 1.00 0.00 N ATOM 720 CA GLY A 51 -16.295 -15.852 1.860 1.00 0.00 C ATOM 721 C GLY A 51 -16.604 -14.735 0.872 1.00 0.00 C ATOM 722 O GLY A 51 -17.207 -14.965 -0.176 1.00 0.00 O ATOM 0 H GLY A 51 -14.403 -15.620 2.734 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.854 -16.699 1.335 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -17.218 -16.207 2.319 1.00 0.00 H new ATOM 726 N GLN A 52 -16.173 -13.526 1.212 1.00 0.00 N ATOM 727 CA GLN A 52 -16.391 -12.376 0.349 1.00 0.00 C ATOM 728 C GLN A 52 -15.219 -12.235 -0.612 1.00 0.00 C ATOM 729 O GLN A 52 -14.063 -12.307 -0.200 1.00 0.00 O ATOM 730 CB GLN A 52 -16.525 -11.113 1.195 1.00 0.00 C ATOM 731 CG GLN A 52 -17.395 -10.091 0.462 1.00 0.00 C ATOM 732 CD GLN A 52 -16.975 -8.676 0.844 1.00 0.00 C ATOM 733 OE1 GLN A 52 -16.668 -8.411 2.007 1.00 0.00 O ATOM 734 NE2 GLN A 52 -16.943 -7.746 -0.071 1.00 0.00 N ATOM 0 H GLN A 52 -15.673 -13.319 2.076 1.00 0.00 H new ATOM 0 HA GLN A 52 -17.309 -12.519 -0.221 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -16.968 -11.356 2.161 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -15.540 -10.691 1.394 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -17.301 -10.228 -0.615 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -18.444 -10.248 0.713 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -17.198 -7.968 -1.033 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -16.663 -6.797 0.176 1.00 0.00 H new ATOM 743 N GLU A 53 -15.512 -12.055 -1.892 1.00 0.00 N ATOM 744 CA GLU A 53 -14.460 -11.936 -2.879 1.00 0.00 C ATOM 745 C GLU A 53 -13.801 -10.568 -2.823 1.00 0.00 C ATOM 746 O GLU A 53 -14.443 -9.552 -2.548 1.00 0.00 O ATOM 747 CB GLU A 53 -15.035 -12.168 -4.262 1.00 0.00 C ATOM 748 CG GLU A 53 -14.509 -13.489 -4.816 1.00 0.00 C ATOM 749 CD GLU A 53 -15.137 -13.772 -6.177 1.00 0.00 C ATOM 750 OE1 GLU A 53 -16.323 -13.530 -6.321 1.00 0.00 O ATOM 751 OE2 GLU A 53 -14.421 -14.227 -7.054 1.00 0.00 O ATOM 0 H GLU A 53 -16.459 -11.989 -2.264 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.701 -12.687 -2.660 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -16.124 -12.188 -4.216 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -14.759 -11.348 -4.925 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -13.424 -13.447 -4.909 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -14.739 -14.300 -4.125 1.00 0.00 H new ATOM 758 N TYR A 54 -12.509 -10.568 -3.091 1.00 0.00 N ATOM 759 CA TYR A 54 -11.719 -9.345 -3.079 1.00 0.00 C ATOM 760 C TYR A 54 -10.787 -9.316 -4.285 1.00 0.00 C ATOM 761 O TYR A 54 -9.969 -10.218 -4.468 1.00 0.00 O ATOM 762 CB TYR A 54 -10.876 -9.269 -1.805 1.00 0.00 C ATOM 763 CG TYR A 54 -11.605 -8.486 -0.740 1.00 0.00 C ATOM 764 CD1 TYR A 54 -12.720 -9.041 -0.119 1.00 0.00 C ATOM 765 CD2 TYR A 54 -11.159 -7.211 -0.370 1.00 0.00 C ATOM 766 CE1 TYR A 54 -13.400 -8.326 0.874 1.00 0.00 C ATOM 767 CE2 TYR A 54 -11.837 -6.494 0.622 1.00 0.00 C ATOM 768 CZ TYR A 54 -12.958 -7.051 1.244 1.00 0.00 C ATOM 769 OH TYR A 54 -13.627 -6.345 2.224 1.00 0.00 O ATOM 0 H TYR A 54 -11.978 -11.408 -3.322 1.00 0.00 H new ATOM 0 HA TYR A 54 -12.401 -8.496 -3.116 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -10.660 -10.274 -1.443 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -9.918 -8.796 -2.022 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -13.061 -10.025 -0.404 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -10.292 -6.781 -0.850 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -14.265 -8.758 1.354 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -11.494 -5.510 0.907 1.00 0.00 H new ATOM 0 HH TYR A 54 -13.688 -6.890 3.036 1.00 0.00 H new ATOM 779 N HIS A 55 -10.914 -8.277 -5.096 1.00 0.00 N ATOM 780 CA HIS A 55 -10.085 -8.130 -6.280 1.00 0.00 C ATOM 781 C HIS A 55 -9.234 -6.875 -6.152 1.00 0.00 C ATOM 782 O HIS A 55 -9.766 -5.763 -6.165 1.00 0.00 O ATOM 783 CB HIS A 55 -10.992 -7.988 -7.503 1.00 0.00 C ATOM 784 CG HIS A 55 -11.748 -9.269 -7.748 1.00 0.00 C ATOM 785 ND1 HIS A 55 -12.833 -9.325 -8.611 1.00 0.00 N ATOM 786 CD2 HIS A 55 -11.602 -10.542 -7.250 1.00 0.00 C ATOM 787 CE1 HIS A 55 -13.293 -10.589 -8.604 1.00 0.00 C ATOM 788 NE2 HIS A 55 -12.580 -11.371 -7.791 1.00 0.00 N ATOM 0 H HIS A 55 -11.585 -7.522 -4.954 1.00 0.00 H new ATOM 0 HA HIS A 55 -9.439 -9.002 -6.386 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -11.693 -7.168 -7.350 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -10.395 -7.737 -8.380 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -10.844 -10.852 -6.546 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -14.137 -10.930 -9.186 1.00 0.00 H new ATOM 0 HE2 HIS A 55 -12.722 -12.364 -7.606 1.00 0.00 H new ATOM 797 N LEU A 56 -7.917 -7.053 -6.030 1.00 0.00 N ATOM 798 CA LEU A 56 -7.018 -5.910 -5.896 1.00 0.00 C ATOM 799 C LEU A 56 -6.013 -5.846 -7.032 1.00 0.00 C ATOM 800 O LEU A 56 -5.501 -6.863 -7.495 1.00 0.00 O ATOM 801 CB LEU A 56 -6.252 -5.962 -4.577 1.00 0.00 C ATOM 802 CG LEU A 56 -7.040 -5.257 -3.471 1.00 0.00 C ATOM 803 CD1 LEU A 56 -8.388 -5.943 -3.288 1.00 0.00 C ATOM 804 CD2 LEU A 56 -6.256 -5.325 -2.157 1.00 0.00 C ATOM 0 H LEU A 56 -7.457 -7.963 -6.021 1.00 0.00 H new ATOM 0 HA LEU A 56 -7.648 -5.021 -5.924 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.069 -6.999 -4.297 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -5.278 -5.488 -4.696 1.00 0.00 H new ATOM 0 HG LEU A 56 -7.195 -4.215 -3.749 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -8.948 -5.440 -2.500 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -8.950 -5.895 -4.220 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -8.231 -6.986 -3.012 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -6.819 -4.822 -1.371 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -6.099 -6.368 -1.881 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -5.291 -4.834 -2.283 1.00 0.00 H new ATOM 816 N GLN A 57 -5.730 -4.624 -7.445 1.00 0.00 N ATOM 817 CA GLN A 57 -4.767 -4.364 -8.515 1.00 0.00 C ATOM 818 C GLN A 57 -3.816 -3.249 -8.099 1.00 0.00 C ATOM 819 O GLN A 57 -4.257 -2.156 -7.782 1.00 0.00 O ATOM 820 CB GLN A 57 -5.499 -3.969 -9.800 1.00 0.00 C ATOM 821 CG GLN A 57 -6.964 -4.399 -9.708 1.00 0.00 C ATOM 822 CD GLN A 57 -7.662 -4.160 -11.042 1.00 0.00 C ATOM 823 OE1 GLN A 57 -8.898 -3.741 -11.055 1.00 0.00 O flip ATOM 824 NE2 GLN A 57 -7.067 -4.361 -12.100 1.00 0.00 N flip ATOM 0 H GLN A 57 -6.156 -3.783 -7.054 1.00 0.00 H new ATOM 0 HA GLN A 57 -4.194 -5.273 -8.700 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -5.434 -2.891 -9.951 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -5.024 -4.440 -10.661 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -7.026 -5.454 -9.440 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -7.467 -3.839 -8.919 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -6.101 -4.688 -12.088 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -7.540 -4.200 -12.989 1.00 0.00 H new ATOM 833 N LEU A 58 -2.512 -3.520 -8.073 1.00 0.00 N ATOM 834 CA LEU A 58 -1.570 -2.509 -7.650 1.00 0.00 C ATOM 835 C LEU A 58 -0.621 -2.121 -8.749 1.00 0.00 C ATOM 836 O LEU A 58 -0.360 -2.893 -9.669 1.00 0.00 O ATOM 837 CB LEU A 58 -0.750 -2.971 -6.439 1.00 0.00 C ATOM 838 CG LEU A 58 -1.456 -4.049 -5.634 1.00 0.00 C ATOM 839 CD1 LEU A 58 -2.850 -3.580 -5.220 1.00 0.00 C ATOM 840 CD2 LEU A 58 -1.535 -5.354 -6.422 1.00 0.00 C ATOM 0 H LEU A 58 -2.099 -4.415 -8.336 1.00 0.00 H new ATOM 0 HA LEU A 58 -2.171 -1.642 -7.376 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.214 -3.349 -6.780 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.547 -2.116 -5.795 1.00 0.00 H new ATOM 0 HG LEU A 58 -0.874 -4.237 -4.731 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.342 -4.364 -4.644 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.765 -2.681 -4.610 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -3.439 -3.360 -6.110 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.045 -6.110 -5.824 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -2.089 -5.188 -7.346 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.528 -5.697 -6.659 1.00 0.00 H new ATOM 852 N VAL A 59 -0.116 -0.897 -8.638 1.00 0.00 N ATOM 853 CA VAL A 59 0.810 -0.387 -9.641 1.00 0.00 C ATOM 854 C VAL A 59 2.083 0.160 -9.035 1.00 0.00 C ATOM 855 O VAL A 59 2.086 0.776 -7.974 1.00 0.00 O ATOM 856 CB VAL A 59 0.147 0.711 -10.493 1.00 0.00 C ATOM 857 CG1 VAL A 59 0.524 2.109 -9.973 1.00 0.00 C ATOM 858 CG2 VAL A 59 0.619 0.593 -11.953 1.00 0.00 C ATOM 0 H VAL A 59 -0.327 -0.250 -7.878 1.00 0.00 H new ATOM 0 HA VAL A 59 1.073 -1.238 -10.270 1.00 0.00 H new ATOM 0 HB VAL A 59 -0.933 0.580 -10.430 1.00 0.00 H new ATOM 0 HG11 VAL A 59 0.044 2.868 -10.590 1.00 0.00 H new ATOM 0 HG12 VAL A 59 0.190 2.216 -8.941 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.606 2.235 -10.019 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.147 1.372 -12.552 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.702 0.708 -11.996 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.342 -0.385 -12.347 1.00 0.00 H new ATOM 868 N ASP A 60 3.156 -0.049 -9.770 1.00 0.00 N ATOM 869 CA ASP A 60 4.462 0.440 -9.377 1.00 0.00 C ATOM 870 C ASP A 60 4.973 1.358 -10.472 1.00 0.00 C ATOM 871 O ASP A 60 5.320 0.899 -11.561 1.00 0.00 O ATOM 872 CB ASP A 60 5.426 -0.730 -9.162 1.00 0.00 C ATOM 873 CG ASP A 60 6.765 -0.443 -9.833 1.00 0.00 C ATOM 874 OD1 ASP A 60 7.320 0.612 -9.577 1.00 0.00 O ATOM 875 OD2 ASP A 60 7.216 -1.285 -10.590 1.00 0.00 O ATOM 0 H ASP A 60 3.148 -0.560 -10.653 1.00 0.00 H new ATOM 0 HA ASP A 60 4.390 0.988 -8.437 1.00 0.00 H new ATOM 0 HB2 ASP A 60 5.574 -0.896 -8.095 1.00 0.00 H new ATOM 0 HB3 ASP A 60 4.996 -1.644 -9.570 1.00 0.00 H new ATOM 880 N THR A 61 4.984 2.660 -10.194 1.00 0.00 N ATOM 881 CA THR A 61 5.428 3.629 -11.180 1.00 0.00 C ATOM 882 C THR A 61 6.340 4.661 -10.538 1.00 0.00 C ATOM 883 O THR A 61 6.339 4.841 -9.321 1.00 0.00 O ATOM 884 CB THR A 61 4.218 4.327 -11.807 1.00 0.00 C ATOM 885 OG1 THR A 61 3.076 4.108 -10.993 1.00 0.00 O ATOM 886 CG2 THR A 61 3.959 3.764 -13.206 1.00 0.00 C ATOM 0 H THR A 61 4.693 3.060 -9.302 1.00 0.00 H new ATOM 0 HA THR A 61 5.984 3.104 -11.957 1.00 0.00 H new ATOM 0 HB THR A 61 4.419 5.396 -11.882 1.00 0.00 H new ATOM 0 HG1 THR A 61 2.300 4.555 -11.391 1.00 0.00 H new ATOM 0 HG21 THR A 61 3.097 4.265 -13.646 1.00 0.00 H new ATOM 0 HG22 THR A 61 4.835 3.931 -13.833 1.00 0.00 H new ATOM 0 HG23 THR A 61 3.761 2.694 -13.137 1.00 0.00 H new ATOM 1134 N ILE A 78 -7.717 4.313 -9.559 1.00 0.00 N ATOM 1135 CA ILE A 78 -7.648 3.400 -8.453 1.00 0.00 C ATOM 1136 C ILE A 78 -8.597 3.759 -7.327 1.00 0.00 C ATOM 1137 O ILE A 78 -9.395 4.690 -7.431 1.00 0.00 O ATOM 1138 CB ILE A 78 -6.249 3.444 -7.947 1.00 0.00 C ATOM 1139 CG1 ILE A 78 -5.917 4.817 -7.370 1.00 0.00 C ATOM 1140 CG2 ILE A 78 -5.297 3.142 -9.097 1.00 0.00 C ATOM 1141 CD1 ILE A 78 -4.518 4.734 -6.824 1.00 0.00 C ATOM 0 HA ILE A 78 -7.940 2.408 -8.797 1.00 0.00 H new ATOM 0 HB ILE A 78 -6.142 2.702 -7.156 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.986 5.586 -8.139 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -6.623 5.087 -6.584 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -4.269 3.172 -8.736 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -5.512 2.151 -9.497 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.427 3.886 -9.882 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -4.236 5.697 -6.399 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -4.475 3.969 -6.049 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -3.828 4.476 -7.628 1.00 0.00 H new ATOM 1153 N ASN A 79 -8.477 3.012 -6.237 1.00 0.00 N ATOM 1154 CA ASN A 79 -9.304 3.252 -5.062 1.00 0.00 C ATOM 1155 C ASN A 79 -8.540 2.827 -3.820 1.00 0.00 C ATOM 1156 O ASN A 79 -9.118 2.613 -2.755 1.00 0.00 O ATOM 1157 CB ASN A 79 -10.616 2.474 -5.166 1.00 0.00 C ATOM 1158 CG ASN A 79 -11.612 3.244 -6.028 1.00 0.00 C ATOM 1159 OD1 ASN A 79 -12.223 2.674 -6.932 1.00 0.00 O ATOM 1160 ND2 ASN A 79 -11.813 4.514 -5.802 1.00 0.00 N ATOM 0 H ASN A 79 -7.819 2.239 -6.142 1.00 0.00 H new ATOM 0 HA ASN A 79 -9.541 4.314 -4.999 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.432 1.491 -5.599 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.032 2.312 -4.172 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -12.477 5.035 -6.375 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -11.306 4.985 -5.053 1.00 0.00 H new ATOM 1167 N GLY A 80 -7.230 2.694 -3.985 1.00 0.00 N ATOM 1168 CA GLY A 80 -6.359 2.278 -2.896 1.00 0.00 C ATOM 1169 C GLY A 80 -4.991 2.924 -2.998 1.00 0.00 C ATOM 1170 O GLY A 80 -4.609 3.457 -4.040 1.00 0.00 O ATOM 0 H GLY A 80 -6.747 2.869 -4.866 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -6.816 2.542 -1.942 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.252 1.193 -2.909 1.00 0.00 H new ATOM 1174 N TYR A 81 -4.251 2.833 -1.912 1.00 0.00 N ATOM 1175 CA TYR A 81 -2.902 3.369 -1.865 1.00 0.00 C ATOM 1176 C TYR A 81 -2.047 2.597 -0.867 1.00 0.00 C ATOM 1177 O TYR A 81 -2.375 2.541 0.318 1.00 0.00 O ATOM 1178 CB TYR A 81 -2.923 4.845 -1.469 1.00 0.00 C ATOM 1179 CG TYR A 81 -2.044 5.665 -2.392 1.00 0.00 C ATOM 1180 CD1 TYR A 81 -0.773 5.203 -2.762 1.00 0.00 C ATOM 1181 CD2 TYR A 81 -2.496 6.903 -2.863 1.00 0.00 C ATOM 1182 CE1 TYR A 81 0.039 5.972 -3.595 1.00 0.00 C ATOM 1183 CE2 TYR A 81 -1.683 7.673 -3.703 1.00 0.00 C ATOM 1184 CZ TYR A 81 -0.414 7.208 -4.069 1.00 0.00 C ATOM 1185 OH TYR A 81 0.389 7.969 -4.893 1.00 0.00 O ATOM 0 H TYR A 81 -4.561 2.392 -1.046 1.00 0.00 H new ATOM 0 HA TYR A 81 -2.471 3.267 -2.861 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -3.946 5.221 -1.505 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -2.579 4.955 -0.440 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.422 4.248 -2.400 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -3.473 7.265 -2.578 1.00 0.00 H new ATOM 0 HE1 TYR A 81 1.019 5.613 -3.875 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -2.035 8.626 -4.069 1.00 0.00 H new ATOM 0 HH TYR A 81 -0.149 8.668 -5.319 1.00 0.00 H new ATOM 1195 N ILE A 82 -0.945 2.038 -1.334 1.00 0.00 N ATOM 1196 CA ILE A 82 -0.036 1.311 -0.461 1.00 0.00 C ATOM 1197 C ILE A 82 1.359 1.899 -0.613 1.00 0.00 C ATOM 1198 O ILE A 82 2.050 1.670 -1.600 1.00 0.00 O ATOM 1199 CB ILE A 82 -0.042 -0.171 -0.817 1.00 0.00 C ATOM 1200 CG1 ILE A 82 0.998 -0.914 0.019 1.00 0.00 C ATOM 1201 CG2 ILE A 82 0.297 -0.319 -2.287 1.00 0.00 C ATOM 1202 CD1 ILE A 82 0.857 -2.411 -0.241 1.00 0.00 C ATOM 0 H ILE A 82 -0.657 2.072 -2.312 1.00 0.00 H new ATOM 0 HA ILE A 82 -0.356 1.407 0.576 1.00 0.00 H new ATOM 0 HB ILE A 82 -1.027 -0.592 -0.612 1.00 0.00 H new ATOM 0 HG12 ILE A 82 2.002 -0.578 -0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 82 0.855 -0.699 1.078 1.00 0.00 H new ATOM 0 HG21 ILE A 82 0.296 -1.375 -2.556 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.445 0.209 -2.886 1.00 0.00 H new ATOM 0 HG23 ILE A 82 1.284 0.103 -2.477 1.00 0.00 H new ATOM 0 HD11 ILE A 82 1.594 -2.954 0.350 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -0.145 -2.736 0.040 1.00 0.00 H new ATOM 0 HD13 ILE A 82 1.020 -2.613 -1.300 1.00 0.00 H new ATOM 1214 N LEU A 83 1.764 2.683 0.356 1.00 0.00 N ATOM 1215 CA LEU A 83 3.062 3.319 0.280 1.00 0.00 C ATOM 1216 C LEU A 83 4.099 2.516 1.042 1.00 0.00 C ATOM 1217 O LEU A 83 3.918 2.189 2.216 1.00 0.00 O ATOM 1218 CB LEU A 83 2.982 4.748 0.821 1.00 0.00 C ATOM 1219 CG LEU A 83 1.599 5.022 1.433 1.00 0.00 C ATOM 1220 CD1 LEU A 83 1.600 6.397 2.100 1.00 0.00 C ATOM 1221 CD2 LEU A 83 0.530 5.005 0.334 1.00 0.00 C ATOM 0 H LEU A 83 1.225 2.896 1.196 1.00 0.00 H new ATOM 0 HA LEU A 83 3.367 3.359 -0.766 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.755 4.900 1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.176 5.458 0.017 1.00 0.00 H new ATOM 0 HG LEU A 83 1.378 4.250 2.170 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.619 6.592 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 83 2.355 6.420 2.885 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.826 7.162 1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.448 5.200 0.774 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.755 5.774 -0.405 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.522 4.029 -0.150 1.00 0.00 H new ATOM 1233 N VAL A 84 5.182 2.179 0.347 1.00 0.00 N ATOM 1234 CA VAL A 84 6.241 1.387 0.952 1.00 0.00 C ATOM 1235 C VAL A 84 7.355 2.287 1.485 1.00 0.00 C ATOM 1236 O VAL A 84 7.996 3.019 0.731 1.00 0.00 O ATOM 1237 CB VAL A 84 6.808 0.388 -0.076 1.00 0.00 C ATOM 1238 CG1 VAL A 84 8.307 0.167 0.157 1.00 0.00 C ATOM 1239 CG2 VAL A 84 6.093 -0.962 0.060 1.00 0.00 C ATOM 0 H VAL A 84 5.346 2.440 -0.625 1.00 0.00 H new ATOM 0 HA VAL A 84 5.820 0.832 1.791 1.00 0.00 H new ATOM 0 HB VAL A 84 6.650 0.801 -1.072 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.689 -0.541 -0.578 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.835 1.115 0.056 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.465 -0.231 1.160 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.498 -1.663 -0.669 1.00 0.00 H new ATOM 0 HG22 VAL A 84 6.246 -1.355 1.065 1.00 0.00 H new ATOM 0 HG23 VAL A 84 5.026 -0.828 -0.119 1.00 0.00 H new ATOM 1249 N TYR A 85 7.580 2.207 2.793 1.00 0.00 N ATOM 1250 CA TYR A 85 8.621 2.993 3.444 1.00 0.00 C ATOM 1251 C TYR A 85 9.745 2.060 3.878 1.00 0.00 C ATOM 1252 O TYR A 85 9.499 0.906 4.223 1.00 0.00 O ATOM 1253 CB TYR A 85 8.050 3.751 4.649 1.00 0.00 C ATOM 1254 CG TYR A 85 8.011 2.851 5.860 1.00 0.00 C ATOM 1255 CD1 TYR A 85 9.169 2.649 6.622 1.00 0.00 C ATOM 1256 CD2 TYR A 85 6.814 2.224 6.226 1.00 0.00 C ATOM 1257 CE1 TYR A 85 9.129 1.820 7.748 1.00 0.00 C ATOM 1258 CE2 TYR A 85 6.775 1.394 7.352 1.00 0.00 C ATOM 1259 CZ TYR A 85 7.933 1.193 8.114 1.00 0.00 C ATOM 1260 OH TYR A 85 7.896 0.374 9.223 1.00 0.00 O ATOM 0 H TYR A 85 7.053 1.603 3.424 1.00 0.00 H new ATOM 0 HA TYR A 85 9.013 3.731 2.744 1.00 0.00 H new ATOM 0 HB2 TYR A 85 8.661 4.629 4.859 1.00 0.00 H new ATOM 0 HB3 TYR A 85 7.046 4.109 4.420 1.00 0.00 H new ATOM 0 HD1 TYR A 85 10.092 3.133 6.340 1.00 0.00 H new ATOM 0 HD2 TYR A 85 5.921 2.381 5.639 1.00 0.00 H new ATOM 0 HE1 TYR A 85 10.022 1.664 8.335 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.852 0.909 7.633 1.00 0.00 H new ATOM 0 HH TYR A 85 8.517 -0.374 9.098 1.00 0.00 H new ATOM 1270 N SER A 86 10.980 2.544 3.820 1.00 0.00 N ATOM 1271 CA SER A 86 12.122 1.709 4.176 1.00 0.00 C ATOM 1272 C SER A 86 12.640 2.027 5.571 1.00 0.00 C ATOM 1273 O SER A 86 12.652 3.182 5.996 1.00 0.00 O ATOM 1274 CB SER A 86 13.243 1.920 3.168 1.00 0.00 C ATOM 1275 OG SER A 86 14.233 2.746 3.755 1.00 0.00 O ATOM 0 H SER A 86 11.215 3.495 3.535 1.00 0.00 H new ATOM 0 HA SER A 86 11.790 0.671 4.164 1.00 0.00 H new ATOM 0 HB2 SER A 86 13.674 0.962 2.877 1.00 0.00 H new ATOM 0 HB3 SER A 86 12.854 2.383 2.261 1.00 0.00 H new ATOM 0 HG SER A 86 15.004 2.810 3.154 1.00 0.00 H new ATOM 1281 N VAL A 87 13.078 0.989 6.276 1.00 0.00 N ATOM 1282 CA VAL A 87 13.608 1.159 7.616 1.00 0.00 C ATOM 1283 C VAL A 87 15.058 1.637 7.554 1.00 0.00 C ATOM 1284 O VAL A 87 15.818 1.457 8.508 1.00 0.00 O ATOM 1285 CB VAL A 87 13.551 -0.174 8.354 1.00 0.00 C ATOM 1286 CG1 VAL A 87 12.127 -0.712 8.337 1.00 0.00 C ATOM 1287 CG2 VAL A 87 14.473 -1.178 7.662 1.00 0.00 C ATOM 0 H VAL A 87 13.075 0.026 5.940 1.00 0.00 H new ATOM 0 HA VAL A 87 13.009 1.903 8.142 1.00 0.00 H new ATOM 0 HB VAL A 87 13.872 -0.026 9.385 1.00 0.00 H new ATOM 0 HG11 VAL A 87 12.092 -1.665 8.866 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.463 -0.000 8.827 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.805 -0.857 7.306 1.00 0.00 H new ATOM 0 HG21 VAL A 87 14.433 -2.132 8.189 1.00 0.00 H new ATOM 0 HG22 VAL A 87 14.149 -1.319 6.631 1.00 0.00 H new ATOM 0 HG23 VAL A 87 15.495 -0.800 7.672 1.00 0.00 H new ATOM 1297 N THR A 88 15.450 2.209 6.414 1.00 0.00 N ATOM 1298 CA THR A 88 16.828 2.655 6.239 1.00 0.00 C ATOM 1299 C THR A 88 16.939 3.964 5.466 1.00 0.00 C ATOM 1300 O THR A 88 18.008 4.575 5.435 1.00 0.00 O ATOM 1301 CB THR A 88 17.586 1.589 5.448 1.00 0.00 C ATOM 1302 OG1 THR A 88 18.936 1.999 5.278 1.00 0.00 O ATOM 1303 CG2 THR A 88 16.926 1.404 4.070 1.00 0.00 C ATOM 0 H THR A 88 14.842 2.371 5.611 1.00 0.00 H new ATOM 0 HA THR A 88 17.242 2.814 7.235 1.00 0.00 H new ATOM 0 HB THR A 88 17.558 0.644 5.991 1.00 0.00 H new ATOM 0 HG1 THR A 88 18.982 2.978 5.268 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.467 0.644 3.507 1.00 0.00 H new ATOM 0 HG22 THR A 88 15.891 1.090 4.202 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.952 2.347 3.524 1.00 0.00 H new ATOM 1311 N SER A 89 15.863 4.349 4.785 1.00 0.00 N ATOM 1312 CA SER A 89 15.899 5.535 3.956 1.00 0.00 C ATOM 1313 C SER A 89 15.004 6.629 4.474 1.00 0.00 C ATOM 1314 O SER A 89 13.823 6.703 4.127 1.00 0.00 O ATOM 1315 CB SER A 89 15.478 5.176 2.531 1.00 0.00 C ATOM 1316 OG SER A 89 15.433 6.358 1.744 1.00 0.00 O ATOM 0 H SER A 89 14.968 3.859 4.794 1.00 0.00 H new ATOM 0 HA SER A 89 16.922 5.910 3.974 1.00 0.00 H new ATOM 0 HB2 SER A 89 16.182 4.464 2.100 1.00 0.00 H new ATOM 0 HB3 SER A 89 14.501 4.693 2.539 1.00 0.00 H new ATOM 0 HG SER A 89 15.165 6.132 0.829 1.00 0.00 H new ATOM 1322 N ILE A 90 15.585 7.522 5.253 1.00 0.00 N ATOM 1323 CA ILE A 90 14.837 8.656 5.745 1.00 0.00 C ATOM 1324 C ILE A 90 14.204 9.335 4.556 1.00 0.00 C ATOM 1325 O ILE A 90 13.283 10.135 4.692 1.00 0.00 O ATOM 1326 CB ILE A 90 15.769 9.624 6.466 1.00 0.00 C ATOM 1327 CG1 ILE A 90 16.587 8.877 7.536 1.00 0.00 C ATOM 1328 CG2 ILE A 90 14.971 10.768 7.104 1.00 0.00 C ATOM 1329 CD1 ILE A 90 15.688 8.418 8.690 1.00 0.00 C ATOM 0 H ILE A 90 16.559 7.483 5.554 1.00 0.00 H new ATOM 0 HA ILE A 90 14.073 8.333 6.452 1.00 0.00 H new ATOM 0 HB ILE A 90 16.456 10.052 5.736 1.00 0.00 H new ATOM 0 HG12 ILE A 90 17.078 8.014 7.087 1.00 0.00 H new ATOM 0 HG13 ILE A 90 17.373 9.528 7.919 1.00 0.00 H new ATOM 0 HG21 ILE A 90 15.654 11.448 7.614 1.00 0.00 H new ATOM 0 HG22 ILE A 90 14.430 11.311 6.329 1.00 0.00 H new ATOM 0 HG23 ILE A 90 14.261 10.360 7.824 1.00 0.00 H new ATOM 0 HD11 ILE A 90 16.289 7.893 9.433 1.00 0.00 H new ATOM 0 HD12 ILE A 90 15.217 9.286 9.152 1.00 0.00 H new ATOM 0 HD13 ILE A 90 14.918 7.748 8.307 1.00 0.00 H new ATOM 1341 N LYS A 91 14.697 8.969 3.379 1.00 0.00 N ATOM 1342 CA LYS A 91 14.176 9.510 2.144 1.00 0.00 C ATOM 1343 C LYS A 91 12.866 8.824 1.781 1.00 0.00 C ATOM 1344 O LYS A 91 11.895 9.483 1.421 1.00 0.00 O ATOM 1345 CB LYS A 91 15.192 9.317 1.028 1.00 0.00 C ATOM 1346 CG LYS A 91 16.600 9.234 1.624 1.00 0.00 C ATOM 1347 CD LYS A 91 17.638 9.392 0.511 1.00 0.00 C ATOM 1348 CE LYS A 91 19.045 9.267 1.100 1.00 0.00 C ATOM 1349 NZ LYS A 91 19.136 8.019 1.908 1.00 0.00 N ATOM 0 H LYS A 91 15.457 8.299 3.261 1.00 0.00 H new ATOM 0 HA LYS A 91 13.988 10.576 2.276 1.00 0.00 H new ATOM 0 HB2 LYS A 91 14.968 8.407 0.471 1.00 0.00 H new ATOM 0 HB3 LYS A 91 15.133 10.145 0.322 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.735 10.013 2.374 1.00 0.00 H new ATOM 0 HG3 LYS A 91 16.736 8.278 2.129 1.00 0.00 H new ATOM 0 HD2 LYS A 91 17.484 8.631 -0.254 1.00 0.00 H new ATOM 0 HD3 LYS A 91 17.521 10.361 0.025 1.00 0.00 H new ATOM 0 HE2 LYS A 91 19.785 9.250 0.300 1.00 0.00 H new ATOM 0 HE3 LYS A 91 19.268 10.133 1.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 20.132 7.734 1.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 18.741 8.189 2.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 18.599 7.262 1.439 1.00 0.00 H new ATOM 1363 N SER A 92 12.848 7.495 1.866 1.00 0.00 N ATOM 1364 CA SER A 92 11.649 6.738 1.524 1.00 0.00 C ATOM 1365 C SER A 92 10.460 7.080 2.424 1.00 0.00 C ATOM 1366 O SER A 92 9.339 7.242 1.934 1.00 0.00 O ATOM 1367 CB SER A 92 11.930 5.239 1.624 1.00 0.00 C ATOM 1368 OG SER A 92 12.196 4.902 2.979 1.00 0.00 O ATOM 0 H SER A 92 13.641 6.927 2.165 1.00 0.00 H new ATOM 0 HA SER A 92 11.386 7.012 0.502 1.00 0.00 H new ATOM 0 HB2 SER A 92 11.075 4.671 1.257 1.00 0.00 H new ATOM 0 HB3 SER A 92 12.781 4.974 0.997 1.00 0.00 H new ATOM 0 HG SER A 92 12.712 5.621 3.400 1.00 0.00 H new ATOM 1374 N PHE A 93 10.674 7.155 3.739 1.00 0.00 N ATOM 1375 CA PHE A 93 9.552 7.432 4.629 1.00 0.00 C ATOM 1376 C PHE A 93 9.154 8.912 4.634 1.00 0.00 C ATOM 1377 O PHE A 93 7.965 9.226 4.717 1.00 0.00 O ATOM 1378 CB PHE A 93 9.853 6.898 6.038 1.00 0.00 C ATOM 1379 CG PHE A 93 10.278 7.990 6.985 1.00 0.00 C ATOM 1380 CD1 PHE A 93 9.363 8.961 7.426 1.00 0.00 C ATOM 1381 CD2 PHE A 93 11.596 8.014 7.436 1.00 0.00 C ATOM 1382 CE1 PHE A 93 9.777 9.959 8.312 1.00 0.00 C ATOM 1383 CE2 PHE A 93 12.008 9.015 8.325 1.00 0.00 C ATOM 1384 CZ PHE A 93 11.100 9.988 8.761 1.00 0.00 C ATOM 0 H PHE A 93 11.578 7.033 4.195 1.00 0.00 H new ATOM 0 HA PHE A 93 8.680 6.902 4.246 1.00 0.00 H new ATOM 0 HB2 PHE A 93 8.966 6.402 6.433 1.00 0.00 H new ATOM 0 HB3 PHE A 93 10.639 6.145 5.979 1.00 0.00 H new ATOM 0 HD1 PHE A 93 8.340 8.936 7.080 1.00 0.00 H new ATOM 0 HD2 PHE A 93 12.297 7.264 7.101 1.00 0.00 H new ATOM 0 HE1 PHE A 93 9.075 10.707 8.649 1.00 0.00 H new ATOM 0 HE2 PHE A 93 13.029 9.037 8.675 1.00 0.00 H new ATOM 0 HZ PHE A 93 11.422 10.760 9.444 1.00 0.00 H new ATOM 1394 N GLU A 94 10.120 9.826 4.554 1.00 0.00 N ATOM 1395 CA GLU A 94 9.783 11.250 4.565 1.00 0.00 C ATOM 1396 C GLU A 94 9.038 11.656 3.298 1.00 0.00 C ATOM 1397 O GLU A 94 8.051 12.391 3.362 1.00 0.00 O ATOM 1398 CB GLU A 94 11.040 12.102 4.698 1.00 0.00 C ATOM 1399 CG GLU A 94 11.551 12.029 6.137 1.00 0.00 C ATOM 1400 CD GLU A 94 12.814 12.870 6.288 1.00 0.00 C ATOM 1401 OE1 GLU A 94 13.513 13.037 5.302 1.00 0.00 O ATOM 1402 OE2 GLU A 94 13.064 13.335 7.388 1.00 0.00 O ATOM 0 H GLU A 94 11.116 9.616 4.483 1.00 0.00 H new ATOM 0 HA GLU A 94 9.135 11.419 5.425 1.00 0.00 H new ATOM 0 HB2 GLU A 94 11.807 11.748 4.009 1.00 0.00 H new ATOM 0 HB3 GLU A 94 10.822 13.136 4.429 1.00 0.00 H new ATOM 0 HG2 GLU A 94 10.783 12.386 6.823 1.00 0.00 H new ATOM 0 HG3 GLU A 94 11.760 10.993 6.405 1.00 0.00 H new ATOM 1409 N VAL A 95 9.505 11.186 2.146 1.00 0.00 N ATOM 1410 CA VAL A 95 8.847 11.537 0.895 1.00 0.00 C ATOM 1411 C VAL A 95 7.453 10.933 0.858 1.00 0.00 C ATOM 1412 O VAL A 95 6.507 11.565 0.394 1.00 0.00 O ATOM 1413 CB VAL A 95 9.659 11.057 -0.304 1.00 0.00 C ATOM 1414 CG1 VAL A 95 11.049 11.694 -0.263 1.00 0.00 C ATOM 1415 CG2 VAL A 95 9.785 9.541 -0.247 1.00 0.00 C ATOM 0 H VAL A 95 10.317 10.576 2.053 1.00 0.00 H new ATOM 0 HA VAL A 95 8.771 12.623 0.840 1.00 0.00 H new ATOM 0 HB VAL A 95 9.159 11.345 -1.229 1.00 0.00 H new ATOM 0 HG11 VAL A 95 11.631 11.352 -1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 95 10.953 12.779 -0.299 1.00 0.00 H new ATOM 0 HG13 VAL A 95 11.555 11.405 0.658 1.00 0.00 H new ATOM 0 HG21 VAL A 95 10.364 9.192 -1.102 1.00 0.00 H new ATOM 0 HG22 VAL A 95 10.289 9.252 0.675 1.00 0.00 H new ATOM 0 HG23 VAL A 95 8.792 9.092 -0.274 1.00 0.00 H new ATOM 1425 N ILE A 96 7.319 9.719 1.375 1.00 0.00 N ATOM 1426 CA ILE A 96 6.017 9.077 1.409 1.00 0.00 C ATOM 1427 C ILE A 96 5.049 9.949 2.205 1.00 0.00 C ATOM 1428 O ILE A 96 3.882 10.097 1.838 1.00 0.00 O ATOM 1429 CB ILE A 96 6.151 7.684 2.040 1.00 0.00 C ATOM 1430 CG1 ILE A 96 6.138 6.639 0.926 1.00 0.00 C ATOM 1431 CG2 ILE A 96 4.994 7.404 3.010 1.00 0.00 C ATOM 1432 CD1 ILE A 96 6.586 5.289 1.479 1.00 0.00 C ATOM 0 H ILE A 96 8.082 9.169 1.769 1.00 0.00 H new ATOM 0 HA ILE A 96 5.628 8.959 0.398 1.00 0.00 H new ATOM 0 HB ILE A 96 7.085 7.639 2.600 1.00 0.00 H new ATOM 0 HG12 ILE A 96 5.136 6.555 0.505 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.799 6.948 0.117 1.00 0.00 H new ATOM 0 HG21 ILE A 96 5.114 6.411 3.442 1.00 0.00 H new ATOM 0 HG22 ILE A 96 4.998 8.149 3.806 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.048 7.453 2.471 1.00 0.00 H new ATOM 0 HD11 ILE A 96 6.575 4.547 0.681 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.596 5.377 1.879 1.00 0.00 H new ATOM 0 HD13 ILE A 96 5.907 4.978 2.273 1.00 0.00 H new ATOM 1444 N LYS A 97 5.551 10.532 3.289 1.00 0.00 N ATOM 1445 CA LYS A 97 4.732 11.397 4.129 1.00 0.00 C ATOM 1446 C LYS A 97 4.407 12.689 3.391 1.00 0.00 C ATOM 1447 O LYS A 97 3.381 13.322 3.642 1.00 0.00 O ATOM 1448 CB LYS A 97 5.474 11.715 5.430 1.00 0.00 C ATOM 1449 CG LYS A 97 4.510 12.362 6.427 1.00 0.00 C ATOM 1450 CD LYS A 97 5.307 13.005 7.563 1.00 0.00 C ATOM 1451 CE LYS A 97 4.343 13.540 8.623 1.00 0.00 C ATOM 1452 NZ LYS A 97 5.106 13.904 9.850 1.00 0.00 N ATOM 0 H LYS A 97 6.515 10.422 3.605 1.00 0.00 H new ATOM 0 HA LYS A 97 3.802 10.880 4.365 1.00 0.00 H new ATOM 0 HB2 LYS A 97 5.893 10.802 5.854 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.309 12.386 5.229 1.00 0.00 H new ATOM 0 HG2 LYS A 97 3.901 13.114 5.925 1.00 0.00 H new ATOM 0 HG3 LYS A 97 3.826 11.613 6.827 1.00 0.00 H new ATOM 0 HD2 LYS A 97 5.983 12.274 8.007 1.00 0.00 H new ATOM 0 HD3 LYS A 97 5.924 13.815 7.175 1.00 0.00 H new ATOM 0 HE2 LYS A 97 3.812 14.412 8.240 1.00 0.00 H new ATOM 0 HE3 LYS A 97 3.591 12.787 8.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.451 14.268 10.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 5.593 13.062 10.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.807 14.636 9.618 1.00 0.00 H new ATOM 1466 N VAL A 98 5.282 13.067 2.465 1.00 0.00 N ATOM 1467 CA VAL A 98 5.073 14.276 1.685 1.00 0.00 C ATOM 1468 C VAL A 98 4.033 14.018 0.603 1.00 0.00 C ATOM 1469 O VAL A 98 2.933 14.570 0.646 1.00 0.00 O ATOM 1470 CB VAL A 98 6.388 14.714 1.058 1.00 0.00 C ATOM 1471 CG1 VAL A 98 6.128 15.843 0.070 1.00 0.00 C ATOM 1472 CG2 VAL A 98 7.339 15.204 2.153 1.00 0.00 C ATOM 0 H VAL A 98 6.136 12.556 2.239 1.00 0.00 H new ATOM 0 HA VAL A 98 4.711 15.070 2.338 1.00 0.00 H new ATOM 0 HB VAL A 98 6.839 13.870 0.536 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.070 16.157 -0.380 1.00 0.00 H new ATOM 0 HG12 VAL A 98 5.452 15.495 -0.711 1.00 0.00 H new ATOM 0 HG13 VAL A 98 5.676 16.686 0.592 1.00 0.00 H new ATOM 0 HG21 VAL A 98 8.281 15.518 1.703 1.00 0.00 H new ATOM 0 HG22 VAL A 98 6.888 16.047 2.676 1.00 0.00 H new ATOM 0 HG23 VAL A 98 7.526 14.396 2.861 1.00 0.00 H new ATOM 1482 N ILE A 99 4.382 13.169 -0.358 1.00 0.00 N ATOM 1483 CA ILE A 99 3.461 12.834 -1.437 1.00 0.00 C ATOM 1484 C ILE A 99 2.050 12.654 -0.883 1.00 0.00 C ATOM 1485 O ILE A 99 1.073 13.060 -1.511 1.00 0.00 O ATOM 1486 CB ILE A 99 3.926 11.545 -2.123 1.00 0.00 C ATOM 1487 CG1 ILE A 99 4.914 11.884 -3.246 1.00 0.00 C ATOM 1488 CG2 ILE A 99 2.725 10.804 -2.721 1.00 0.00 C ATOM 1489 CD1 ILE A 99 6.118 12.636 -2.672 1.00 0.00 C ATOM 0 H ILE A 99 5.288 12.704 -0.412 1.00 0.00 H new ATOM 0 HA ILE A 99 3.449 13.645 -2.166 1.00 0.00 H new ATOM 0 HB ILE A 99 4.412 10.910 -1.382 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.246 10.970 -3.738 1.00 0.00 H new ATOM 0 HG13 ILE A 99 4.421 12.493 -4.004 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.066 9.890 -3.206 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.021 10.553 -1.928 1.00 0.00 H new ATOM 0 HG23 ILE A 99 2.233 11.442 -3.455 1.00 0.00 H new ATOM 0 HD11 ILE A 99 6.815 12.873 -3.475 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.780 13.559 -2.201 1.00 0.00 H new ATOM 0 HD13 ILE A 99 6.617 12.012 -1.931 1.00 0.00 H new ATOM 1501 N HIS A 100 1.949 12.047 0.298 1.00 0.00 N ATOM 1502 CA HIS A 100 0.647 11.826 0.918 1.00 0.00 C ATOM 1503 C HIS A 100 -0.019 13.157 1.259 1.00 0.00 C ATOM 1504 O HIS A 100 -1.056 13.499 0.699 1.00 0.00 O ATOM 1505 CB HIS A 100 0.820 11.000 2.196 1.00 0.00 C ATOM 1506 CG HIS A 100 -0.518 10.491 2.669 1.00 0.00 C ATOM 1507 ND1 HIS A 100 -1.807 10.852 2.358 1.00 0.00 N flip ATOM 1508 CD2 HIS A 100 -0.628 9.461 3.590 1.00 0.00 C flip ATOM 1509 CE1 HIS A 100 -2.700 10.061 3.073 1.00 0.00 C flip ATOM 1510 NE2 HIS A 100 -1.939 9.238 3.796 1.00 0.00 N flip ATOM 0 H HIS A 100 2.743 11.704 0.838 1.00 0.00 H new ATOM 0 HA HIS A 100 0.013 11.287 0.213 1.00 0.00 H new ATOM 0 HB2 HIS A 100 1.491 10.162 2.008 1.00 0.00 H new ATOM 0 HB3 HIS A 100 1.281 11.610 2.973 1.00 0.00 H new ATOM 0 HD2 HIS A 100 0.190 8.933 4.057 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -3.779 10.104 3.048 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -2.306 8.526 4.428 1.00 0.00 H new ATOM 1519 N GLY A 101 0.589 13.902 2.177 1.00 0.00 N ATOM 1520 CA GLY A 101 0.056 15.188 2.595 1.00 0.00 C ATOM 1521 C GLY A 101 -0.551 15.949 1.431 1.00 0.00 C ATOM 1522 O GLY A 101 -1.725 16.316 1.448 1.00 0.00 O ATOM 0 H GLY A 101 1.454 13.633 2.645 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -0.701 15.036 3.364 1.00 0.00 H new ATOM 0 HA3 GLY A 101 0.851 15.783 3.044 1.00 0.00 H new ATOM 1526 N LYS A 102 0.270 16.178 0.431 1.00 0.00 N ATOM 1527 CA LYS A 102 -0.156 16.903 -0.764 1.00 0.00 C ATOM 1528 C LYS A 102 -1.260 16.142 -1.492 1.00 0.00 C ATOM 1529 O LYS A 102 -2.386 16.623 -1.587 1.00 0.00 O ATOM 1530 CB LYS A 102 1.038 17.105 -1.701 1.00 0.00 C ATOM 1531 CG LYS A 102 0.643 18.041 -2.848 1.00 0.00 C ATOM 1532 CD LYS A 102 0.377 19.457 -2.317 1.00 0.00 C ATOM 1533 CE LYS A 102 0.993 20.483 -3.269 1.00 0.00 C ATOM 1534 NZ LYS A 102 0.702 20.094 -4.678 1.00 0.00 N ATOM 0 H LYS A 102 1.244 15.874 0.414 1.00 0.00 H new ATOM 0 HA LYS A 102 -0.547 17.874 -0.459 1.00 0.00 H new ATOM 0 HB2 LYS A 102 1.879 17.526 -1.149 1.00 0.00 H new ATOM 0 HB3 LYS A 102 1.366 16.145 -2.099 1.00 0.00 H new ATOM 0 HG2 LYS A 102 1.438 18.069 -3.593 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.248 17.659 -3.347 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.696 19.627 -2.227 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.803 19.569 -1.320 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.588 21.474 -3.063 1.00 0.00 H new ATOM 0 HE3 LYS A 102 2.070 20.540 -3.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 0.625 20.949 -5.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 1.472 19.495 -5.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -0.194 19.567 -4.715 1.00 0.00 H new ATOM 1548 N LEU A 103 -0.931 14.957 -2.005 1.00 0.00 N ATOM 1549 CA LEU A 103 -1.914 14.141 -2.718 1.00 0.00 C ATOM 1550 C LEU A 103 -3.279 14.280 -2.045 1.00 0.00 C ATOM 1551 O LEU A 103 -4.246 14.736 -2.655 1.00 0.00 O ATOM 1552 CB LEU A 103 -1.482 12.673 -2.699 1.00 0.00 C ATOM 1553 CG LEU A 103 -2.500 11.816 -3.461 1.00 0.00 C ATOM 1554 CD1 LEU A 103 -1.842 11.245 -4.713 1.00 0.00 C ATOM 1555 CD2 LEU A 103 -2.974 10.674 -2.559 1.00 0.00 C ATOM 0 H LEU A 103 -0.001 14.543 -1.942 1.00 0.00 H new ATOM 0 HA LEU A 103 -1.981 14.482 -3.751 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.496 12.570 -3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.398 12.323 -1.670 1.00 0.00 H new ATOM 0 HG LEU A 103 -3.355 12.427 -3.750 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.563 10.635 -5.257 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.503 12.062 -5.351 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.989 10.630 -4.427 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -3.698 10.062 -3.097 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -2.121 10.059 -2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -3.441 11.087 -1.665 1.00 0.00 H new ATOM 1567 N LEU A 104 -3.337 13.899 -0.775 1.00 0.00 N ATOM 1568 CA LEU A 104 -4.569 13.999 -0.005 1.00 0.00 C ATOM 1569 C LEU A 104 -5.198 15.373 -0.227 1.00 0.00 C ATOM 1570 O LEU A 104 -6.394 15.498 -0.482 1.00 0.00 O ATOM 1571 CB LEU A 104 -4.243 13.742 1.486 1.00 0.00 C ATOM 1572 CG LEU A 104 -4.786 14.841 2.402 1.00 0.00 C ATOM 1573 CD1 LEU A 104 -6.302 14.870 2.308 1.00 0.00 C ATOM 1574 CD2 LEU A 104 -4.382 14.536 3.844 1.00 0.00 C ATOM 0 H LEU A 104 -2.545 13.518 -0.257 1.00 0.00 H new ATOM 0 HA LEU A 104 -5.293 13.252 -0.330 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.664 12.782 1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -3.163 13.670 1.611 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.379 15.806 2.098 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.692 15.652 2.960 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.599 15.073 1.279 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.704 13.905 2.618 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.766 15.316 4.502 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.796 13.573 4.142 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.295 14.502 3.918 1.00 0.00 H new ATOM 1586 N ASP A 105 -4.371 16.388 -0.106 1.00 0.00 N ATOM 1587 CA ASP A 105 -4.798 17.767 -0.267 1.00 0.00 C ATOM 1588 C ASP A 105 -5.370 18.014 -1.659 1.00 0.00 C ATOM 1589 O ASP A 105 -6.245 18.860 -1.844 1.00 0.00 O ATOM 1590 CB ASP A 105 -3.584 18.656 -0.047 1.00 0.00 C ATOM 1591 CG ASP A 105 -3.261 19.439 -1.315 1.00 0.00 C ATOM 1592 OD1 ASP A 105 -2.898 18.815 -2.297 1.00 0.00 O ATOM 1593 OD2 ASP A 105 -3.382 20.652 -1.285 1.00 0.00 O ATOM 0 H ASP A 105 -3.379 16.283 0.108 1.00 0.00 H new ATOM 0 HA ASP A 105 -5.585 17.989 0.454 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -3.775 19.346 0.775 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -2.727 18.047 0.240 1.00 0.00 H new ATOM 1676 N GLN A 111 -12.026 9.303 3.317 1.00 0.00 N ATOM 1677 CA GLN A 111 -11.078 8.275 3.720 1.00 0.00 C ATOM 1678 C GLN A 111 -11.008 7.165 2.680 1.00 0.00 C ATOM 1679 O GLN A 111 -11.997 6.484 2.415 1.00 0.00 O ATOM 1680 CB GLN A 111 -11.484 7.678 5.062 1.00 0.00 C ATOM 1681 CG GLN A 111 -11.674 8.795 6.090 1.00 0.00 C ATOM 1682 CD GLN A 111 -11.806 8.199 7.488 1.00 0.00 C ATOM 1683 OE1 GLN A 111 -12.469 7.177 7.668 1.00 0.00 O ATOM 1684 NE2 GLN A 111 -11.211 8.778 8.495 1.00 0.00 N ATOM 0 HA GLN A 111 -10.097 8.741 3.809 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -12.408 7.110 4.953 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -10.720 6.981 5.406 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.827 9.480 6.056 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -12.564 9.376 5.848 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -10.662 9.624 8.345 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -11.295 8.384 9.432 1.00 0.00 H new ATOM 1693 N ILE A 112 -9.823 6.986 2.108 1.00 0.00 N ATOM 1694 CA ILE A 112 -9.608 5.947 1.107 1.00 0.00 C ATOM 1695 C ILE A 112 -8.621 4.919 1.657 1.00 0.00 C ATOM 1696 O ILE A 112 -7.770 5.268 2.466 1.00 0.00 O ATOM 1697 CB ILE A 112 -9.042 6.562 -0.175 1.00 0.00 C ATOM 1698 CG1 ILE A 112 -8.322 7.870 0.163 1.00 0.00 C ATOM 1699 CG2 ILE A 112 -10.182 6.846 -1.153 1.00 0.00 C ATOM 1700 CD1 ILE A 112 -7.542 8.355 -1.060 1.00 0.00 C ATOM 0 H ILE A 112 -8.997 7.546 2.320 1.00 0.00 H new ATOM 0 HA ILE A 112 -10.558 5.464 0.879 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.338 5.866 -0.632 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -9.045 8.626 0.470 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -7.644 7.718 1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -9.778 7.284 -2.066 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -10.695 5.915 -1.394 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -10.887 7.542 -0.698 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -7.030 9.286 -0.819 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -6.809 7.601 -1.346 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -8.231 8.524 -1.888 1.00 0.00 H new ATOM 1712 N PRO A 113 -8.701 3.673 1.261 1.00 0.00 N ATOM 1713 CA PRO A 113 -7.759 2.633 1.765 1.00 0.00 C ATOM 1714 C PRO A 113 -6.299 3.088 1.695 1.00 0.00 C ATOM 1715 O PRO A 113 -5.736 3.216 0.606 1.00 0.00 O ATOM 1716 CB PRO A 113 -7.984 1.439 0.836 1.00 0.00 C ATOM 1717 CG PRO A 113 -9.334 1.626 0.227 1.00 0.00 C ATOM 1718 CD PRO A 113 -9.682 3.114 0.312 1.00 0.00 C ATOM 0 HA PRO A 113 -7.944 2.406 2.815 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -7.214 1.396 0.066 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -7.934 0.501 1.390 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -9.335 1.292 -0.811 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -10.078 1.029 0.755 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -9.608 3.595 -0.664 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -10.703 3.263 0.664 1.00 0.00 H new ATOM 1726 N ILE A 114 -5.683 3.300 2.862 1.00 0.00 N ATOM 1727 CA ILE A 114 -4.284 3.703 2.921 1.00 0.00 C ATOM 1728 C ILE A 114 -3.515 2.661 3.718 1.00 0.00 C ATOM 1729 O ILE A 114 -3.920 2.277 4.821 1.00 0.00 O ATOM 1730 CB ILE A 114 -4.132 5.088 3.566 1.00 0.00 C ATOM 1731 CG1 ILE A 114 -5.027 6.098 2.847 1.00 0.00 C ATOM 1732 CG2 ILE A 114 -2.683 5.555 3.450 1.00 0.00 C ATOM 1733 CD1 ILE A 114 -6.046 6.682 3.831 1.00 0.00 C ATOM 0 H ILE A 114 -6.133 3.199 3.772 1.00 0.00 H new ATOM 0 HA ILE A 114 -3.886 3.770 1.909 1.00 0.00 H new ATOM 0 HB ILE A 114 -4.419 5.018 4.615 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -4.420 6.897 2.421 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -5.544 5.614 2.018 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.580 6.538 3.909 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -2.030 4.846 3.960 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.403 5.614 2.398 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -6.681 7.401 3.313 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -6.662 5.879 4.236 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -5.521 7.182 4.645 1.00 0.00 H new ATOM 1745 N MET A 115 -2.423 2.188 3.137 1.00 0.00 N ATOM 1746 CA MET A 115 -1.619 1.167 3.780 1.00 0.00 C ATOM 1747 C MET A 115 -0.151 1.552 3.825 1.00 0.00 C ATOM 1748 O MET A 115 0.509 1.647 2.790 1.00 0.00 O ATOM 1749 CB MET A 115 -1.763 -0.145 3.014 1.00 0.00 C ATOM 1750 CG MET A 115 -1.255 -1.288 3.881 1.00 0.00 C ATOM 1751 SD MET A 115 -2.559 -1.781 5.023 1.00 0.00 S ATOM 1752 CE MET A 115 -1.492 -2.671 6.171 1.00 0.00 C ATOM 0 H MET A 115 -2.077 2.494 2.228 1.00 0.00 H new ATOM 0 HA MET A 115 -1.975 1.057 4.804 1.00 0.00 H new ATOM 0 HB2 MET A 115 -2.807 -0.311 2.747 1.00 0.00 H new ATOM 0 HB3 MET A 115 -1.198 -0.100 2.083 1.00 0.00 H new ATOM 0 HG2 MET A 115 -0.962 -2.132 3.257 1.00 0.00 H new ATOM 0 HG3 MET A 115 -0.368 -0.977 4.433 1.00 0.00 H new ATOM 0 HE1 MET A 115 -2.087 -3.047 7.004 1.00 0.00 H new ATOM 0 HE2 MET A 115 -1.020 -3.507 5.655 1.00 0.00 H new ATOM 0 HE3 MET A 115 -0.723 -1.998 6.549 1.00 0.00 H new ATOM 1762 N LEU A 116 0.365 1.737 5.032 1.00 0.00 N ATOM 1763 CA LEU A 116 1.754 2.066 5.198 1.00 0.00 C ATOM 1764 C LEU A 116 2.520 0.805 5.498 1.00 0.00 C ATOM 1765 O LEU A 116 2.560 0.347 6.640 1.00 0.00 O ATOM 1766 CB LEU A 116 1.912 2.997 6.360 1.00 0.00 C ATOM 1767 CG LEU A 116 1.776 4.436 5.871 1.00 0.00 C ATOM 1768 CD1 LEU A 116 1.248 5.285 7.006 1.00 0.00 C ATOM 1769 CD2 LEU A 116 3.140 4.964 5.439 1.00 0.00 C ATOM 0 H LEU A 116 -0.164 1.663 5.901 1.00 0.00 H new ATOM 0 HA LEU A 116 2.127 2.537 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.157 2.785 7.117 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.885 2.850 6.830 1.00 0.00 H new ATOM 0 HG LEU A 116 1.093 4.474 5.023 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.145 6.317 6.671 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.275 4.907 7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.942 5.243 7.845 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.039 5.992 5.090 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.826 4.934 6.285 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.531 4.344 4.632 1.00 0.00 H new ATOM 1781 N VAL A 117 3.120 0.250 4.471 1.00 0.00 N ATOM 1782 CA VAL A 117 3.879 -0.964 4.626 1.00 0.00 C ATOM 1783 C VAL A 117 5.358 -0.663 4.646 1.00 0.00 C ATOM 1784 O VAL A 117 5.883 0.093 3.845 1.00 0.00 O ATOM 1785 CB VAL A 117 3.529 -1.958 3.525 1.00 0.00 C ATOM 1786 CG1 VAL A 117 4.168 -3.315 3.817 1.00 0.00 C ATOM 1787 CG2 VAL A 117 2.023 -2.131 3.522 1.00 0.00 C ATOM 0 H VAL A 117 3.096 0.621 3.521 1.00 0.00 H new ATOM 0 HA VAL A 117 3.618 -1.420 5.581 1.00 0.00 H new ATOM 0 HB VAL A 117 3.893 -1.590 2.566 1.00 0.00 H new ATOM 0 HG11 VAL A 117 3.911 -4.017 3.023 1.00 0.00 H new ATOM 0 HG12 VAL A 117 5.251 -3.204 3.866 1.00 0.00 H new ATOM 0 HG13 VAL A 117 3.798 -3.694 4.770 1.00 0.00 H new ATOM 0 HG21 VAL A 117 1.740 -2.839 2.743 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.698 -2.509 4.491 1.00 0.00 H new ATOM 0 HG23 VAL A 117 1.547 -1.170 3.330 1.00 0.00 H new ATOM 1797 N GLY A 118 6.002 -1.274 5.592 1.00 0.00 N ATOM 1798 CA GLY A 118 7.431 -1.116 5.776 1.00 0.00 C ATOM 1799 C GLY A 118 8.133 -2.322 5.200 1.00 0.00 C ATOM 1800 O GLY A 118 7.992 -3.423 5.719 1.00 0.00 O ATOM 0 H GLY A 118 5.560 -1.900 6.265 1.00 0.00 H new ATOM 0 HA2 GLY A 118 7.777 -0.207 5.283 1.00 0.00 H new ATOM 0 HA3 GLY A 118 7.666 -1.013 6.835 1.00 0.00 H new ATOM 1804 N ASN A 119 8.867 -2.129 4.116 1.00 0.00 N ATOM 1805 CA ASN A 119 9.538 -3.254 3.492 1.00 0.00 C ATOM 1806 C ASN A 119 10.989 -3.353 3.939 1.00 0.00 C ATOM 1807 O ASN A 119 11.491 -2.493 4.662 1.00 0.00 O ATOM 1808 CB ASN A 119 9.478 -3.133 1.968 1.00 0.00 C ATOM 1809 CG ASN A 119 10.062 -4.388 1.324 1.00 0.00 C ATOM 1810 OD1 ASN A 119 9.529 -5.483 1.503 1.00 0.00 O ATOM 1811 ND2 ASN A 119 11.133 -4.296 0.584 1.00 0.00 N ATOM 0 H ASN A 119 9.011 -1.228 3.660 1.00 0.00 H new ATOM 0 HA ASN A 119 9.019 -4.160 3.805 1.00 0.00 H new ATOM 0 HB2 ASN A 119 8.446 -2.995 1.646 1.00 0.00 H new ATOM 0 HB3 ASN A 119 10.034 -2.254 1.642 1.00 0.00 H new ATOM 0 HD21 ASN A 119 11.529 -5.132 0.154 1.00 0.00 H new ATOM 0 HD22 ASN A 119 11.574 -3.388 0.436 1.00 0.00 H new ATOM 1818 N LYS A 120 11.640 -4.430 3.517 1.00 0.00 N ATOM 1819 CA LYS A 120 13.035 -4.678 3.885 1.00 0.00 C ATOM 1820 C LYS A 120 13.153 -4.767 5.401 1.00 0.00 C ATOM 1821 O LYS A 120 13.869 -3.991 6.030 1.00 0.00 O ATOM 1822 CB LYS A 120 13.951 -3.562 3.361 1.00 0.00 C ATOM 1823 CG LYS A 120 13.900 -3.516 1.830 1.00 0.00 C ATOM 1824 CD LYS A 120 15.286 -3.162 1.277 1.00 0.00 C ATOM 1825 CE LYS A 120 15.133 -2.554 -0.117 1.00 0.00 C ATOM 1826 NZ LYS A 120 16.457 -2.520 -0.803 1.00 0.00 N ATOM 0 H LYS A 120 11.228 -5.147 2.920 1.00 0.00 H new ATOM 0 HA LYS A 120 13.349 -5.619 3.433 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.640 -2.602 3.772 1.00 0.00 H new ATOM 0 HB3 LYS A 120 14.975 -3.734 3.694 1.00 0.00 H new ATOM 0 HG2 LYS A 120 13.577 -4.480 1.438 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.168 -2.778 1.503 1.00 0.00 H new ATOM 0 HD2 LYS A 120 15.786 -2.457 1.941 1.00 0.00 H new ATOM 0 HD3 LYS A 120 15.911 -4.054 1.231 1.00 0.00 H new ATOM 0 HE2 LYS A 120 14.425 -3.140 -0.703 1.00 0.00 H new ATOM 0 HE3 LYS A 120 14.727 -1.545 -0.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 16.336 -2.169 -1.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 17.101 -1.889 -0.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 16.859 -3.479 -0.829 1.00 0.00 H new ATOM 1840 N LYS A 121 12.417 -5.708 5.978 1.00 0.00 N ATOM 1841 CA LYS A 121 12.408 -5.889 7.424 1.00 0.00 C ATOM 1842 C LYS A 121 13.771 -6.319 7.966 1.00 0.00 C ATOM 1843 O LYS A 121 14.141 -5.934 9.070 1.00 0.00 O ATOM 1844 CB LYS A 121 11.365 -6.938 7.806 1.00 0.00 C ATOM 1845 CG LYS A 121 11.200 -6.961 9.327 1.00 0.00 C ATOM 1846 CD LYS A 121 10.016 -7.854 9.699 1.00 0.00 C ATOM 1847 CE LYS A 121 10.122 -8.255 11.171 1.00 0.00 C ATOM 1848 NZ LYS A 121 10.957 -9.484 11.293 1.00 0.00 N ATOM 0 H LYS A 121 11.819 -6.357 5.467 1.00 0.00 H new ATOM 0 HA LYS A 121 12.162 -4.924 7.867 1.00 0.00 H new ATOM 0 HB2 LYS A 121 10.412 -6.709 7.329 1.00 0.00 H new ATOM 0 HB3 LYS A 121 11.673 -7.920 7.448 1.00 0.00 H new ATOM 0 HG2 LYS A 121 12.111 -7.333 9.796 1.00 0.00 H new ATOM 0 HG3 LYS A 121 11.038 -5.950 9.701 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.079 -7.326 9.521 1.00 0.00 H new ATOM 0 HD3 LYS A 121 10.005 -8.743 9.069 1.00 0.00 H new ATOM 0 HE2 LYS A 121 10.564 -7.443 11.749 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.129 -8.435 11.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 11.029 -9.757 12.294 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 10.517 -10.257 10.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.908 -9.296 10.916 1.00 0.00 H new ATOM 1862 N ASP A 122 14.511 -7.130 7.218 1.00 0.00 N ATOM 1863 CA ASP A 122 15.809 -7.588 7.709 1.00 0.00 C ATOM 1864 C ASP A 122 16.745 -6.411 7.962 1.00 0.00 C ATOM 1865 O ASP A 122 17.794 -6.570 8.587 1.00 0.00 O ATOM 1866 CB ASP A 122 16.454 -8.573 6.734 1.00 0.00 C ATOM 1867 CG ASP A 122 16.640 -7.928 5.372 1.00 0.00 C ATOM 1868 OD1 ASP A 122 15.684 -7.911 4.623 1.00 0.00 O ATOM 1869 OD2 ASP A 122 17.743 -7.494 5.086 1.00 0.00 O ATOM 0 H ASP A 122 14.247 -7.477 6.296 1.00 0.00 H new ATOM 0 HA ASP A 122 15.636 -8.104 8.654 1.00 0.00 H new ATOM 0 HB2 ASP A 122 17.418 -8.900 7.123 1.00 0.00 H new ATOM 0 HB3 ASP A 122 15.830 -9.462 6.640 1.00 0.00 H new ATOM 1874 N LEU A 123 16.350 -5.224 7.510 1.00 0.00 N ATOM 1875 CA LEU A 123 17.158 -4.038 7.740 1.00 0.00 C ATOM 1876 C LEU A 123 16.709 -3.406 9.041 1.00 0.00 C ATOM 1877 O LEU A 123 17.506 -2.795 9.749 1.00 0.00 O ATOM 1878 CB LEU A 123 17.020 -3.040 6.581 1.00 0.00 C ATOM 1879 CG LEU A 123 18.118 -3.288 5.543 1.00 0.00 C ATOM 1880 CD1 LEU A 123 17.947 -4.682 4.959 1.00 0.00 C ATOM 1881 CD2 LEU A 123 18.003 -2.251 4.424 1.00 0.00 C ATOM 0 H LEU A 123 15.488 -5.062 6.990 1.00 0.00 H new ATOM 0 HA LEU A 123 18.210 -4.318 7.800 1.00 0.00 H new ATOM 0 HB2 LEU A 123 16.039 -3.143 6.117 1.00 0.00 H new ATOM 0 HB3 LEU A 123 17.089 -2.020 6.959 1.00 0.00 H new ATOM 0 HG LEU A 123 19.096 -3.205 6.016 1.00 0.00 H new ATOM 0 HD11 LEU A 123 18.726 -4.865 4.219 1.00 0.00 H new ATOM 0 HD12 LEU A 123 18.023 -5.422 5.756 1.00 0.00 H new ATOM 0 HD13 LEU A 123 16.969 -4.760 4.483 1.00 0.00 H new ATOM 0 HD21 LEU A 123 18.784 -2.426 3.684 1.00 0.00 H new ATOM 0 HD22 LEU A 123 17.026 -2.336 3.948 1.00 0.00 H new ATOM 0 HD23 LEU A 123 18.117 -1.251 4.842 1.00 0.00 H new ATOM 1893 N HIS A 124 15.426 -3.585 9.360 1.00 0.00 N ATOM 1894 CA HIS A 124 14.879 -3.056 10.599 1.00 0.00 C ATOM 1895 C HIS A 124 15.883 -3.242 11.730 1.00 0.00 C ATOM 1896 O HIS A 124 15.865 -2.511 12.711 1.00 0.00 O ATOM 1897 CB HIS A 124 13.572 -3.770 10.945 1.00 0.00 C ATOM 1898 CG HIS A 124 13.848 -4.947 11.842 1.00 0.00 C ATOM 1899 ND1 HIS A 124 14.749 -5.982 11.763 1.00 0.00 N flip ATOM 1900 CD2 HIS A 124 13.134 -5.157 13.011 1.00 0.00 C flip ATOM 1901 CE1 HIS A 124 14.596 -6.820 12.863 1.00 0.00 C flip ATOM 1902 NE2 HIS A 124 13.611 -6.277 13.583 1.00 0.00 N flip ATOM 0 H HIS A 124 14.755 -4.089 8.779 1.00 0.00 H new ATOM 0 HA HIS A 124 14.678 -1.993 10.469 1.00 0.00 H new ATOM 0 HB2 HIS A 124 12.890 -3.078 11.439 1.00 0.00 H new ATOM 0 HB3 HIS A 124 13.079 -4.106 10.033 1.00 0.00 H new ATOM 0 HD2 HIS A 124 12.339 -4.534 13.393 1.00 0.00 H new ATOM 0 HE1 HIS A 124 15.154 -7.717 13.087 1.00 0.00 H new ATOM 0 HE2 HIS A 124 13.263 -6.664 14.460 1.00 0.00 H new ATOM 1911 N MET A 125 16.778 -4.213 11.583 1.00 0.00 N ATOM 1912 CA MET A 125 17.787 -4.441 12.607 1.00 0.00 C ATOM 1913 C MET A 125 18.376 -3.102 13.024 1.00 0.00 C ATOM 1914 O MET A 125 18.883 -2.945 14.134 1.00 0.00 O ATOM 1915 CB MET A 125 18.893 -5.348 12.071 1.00 0.00 C ATOM 1916 CG MET A 125 18.492 -6.814 12.249 1.00 0.00 C ATOM 1917 SD MET A 125 19.140 -7.426 13.825 1.00 0.00 S ATOM 1918 CE MET A 125 17.547 -7.772 14.610 1.00 0.00 C ATOM 0 H MET A 125 16.825 -4.842 10.782 1.00 0.00 H new ATOM 0 HA MET A 125 17.327 -4.929 13.466 1.00 0.00 H new ATOM 0 HB2 MET A 125 19.071 -5.136 11.017 1.00 0.00 H new ATOM 0 HB3 MET A 125 19.826 -5.150 12.598 1.00 0.00 H new ATOM 0 HG2 MET A 125 17.407 -6.911 12.227 1.00 0.00 H new ATOM 0 HG3 MET A 125 18.882 -7.412 11.426 1.00 0.00 H new ATOM 0 HE1 MET A 125 17.714 -8.216 15.591 1.00 0.00 H new ATOM 0 HE2 MET A 125 16.987 -6.843 14.722 1.00 0.00 H new ATOM 0 HE3 MET A 125 16.979 -8.465 13.990 1.00 0.00 H new ATOM 1928 N GLU A 126 18.293 -2.136 12.112 1.00 0.00 N ATOM 1929 CA GLU A 126 18.803 -0.804 12.361 1.00 0.00 C ATOM 1930 C GLU A 126 17.652 0.142 12.712 1.00 0.00 C ATOM 1931 O GLU A 126 17.788 1.024 13.561 1.00 0.00 O ATOM 1932 CB GLU A 126 19.545 -0.350 11.101 1.00 0.00 C ATOM 1933 CG GLU A 126 18.802 0.776 10.381 1.00 0.00 C ATOM 1934 CD GLU A 126 19.538 1.135 9.095 1.00 0.00 C ATOM 1935 OE1 GLU A 126 19.374 0.417 8.122 1.00 0.00 O ATOM 1936 OE2 GLU A 126 20.255 2.122 9.102 1.00 0.00 O ATOM 0 H GLU A 126 17.873 -2.259 11.191 1.00 0.00 H new ATOM 0 HA GLU A 126 19.489 -0.798 13.208 1.00 0.00 H new ATOM 0 HB2 GLU A 126 20.546 -0.012 11.370 1.00 0.00 H new ATOM 0 HB3 GLU A 126 19.666 -1.197 10.425 1.00 0.00 H new ATOM 0 HG2 GLU A 126 17.782 0.465 10.153 1.00 0.00 H new ATOM 0 HG3 GLU A 126 18.732 1.651 11.028 1.00 0.00 H new ATOM 1943 N ARG A 127 16.526 -0.055 12.037 1.00 0.00 N ATOM 1944 CA ARG A 127 15.341 0.759 12.241 1.00 0.00 C ATOM 1945 C ARG A 127 15.710 2.219 12.452 1.00 0.00 C ATOM 1946 O ARG A 127 15.885 2.681 13.580 1.00 0.00 O ATOM 1947 CB ARG A 127 14.532 0.240 13.428 1.00 0.00 C ATOM 1948 CG ARG A 127 13.048 0.554 13.216 1.00 0.00 C ATOM 1949 CD ARG A 127 12.384 -0.604 12.462 1.00 0.00 C ATOM 1950 NE ARG A 127 11.002 -0.263 12.115 1.00 0.00 N ATOM 1951 CZ ARG A 127 9.947 -0.883 12.660 1.00 0.00 C ATOM 1952 NH1 ARG A 127 10.087 -1.990 13.333 1.00 0.00 N ATOM 1953 NH2 ARG A 127 8.753 -0.456 12.380 1.00 0.00 N ATOM 0 H ARG A 127 16.412 -0.785 11.333 1.00 0.00 H new ATOM 0 HA ARG A 127 14.728 0.690 11.342 1.00 0.00 H new ATOM 0 HB2 ARG A 127 14.675 -0.835 13.536 1.00 0.00 H new ATOM 0 HB3 ARG A 127 14.884 0.702 14.350 1.00 0.00 H new ATOM 0 HG2 ARG A 127 12.556 0.706 14.177 1.00 0.00 H new ATOM 0 HG3 ARG A 127 12.938 1.480 12.652 1.00 0.00 H new ATOM 0 HD2 ARG A 127 12.948 -0.828 11.557 1.00 0.00 H new ATOM 0 HD3 ARG A 127 12.400 -1.503 13.078 1.00 0.00 H new ATOM 0 HE ARG A 127 10.837 0.476 11.431 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.013 -2.400 13.453 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.270 -2.446 13.740 1.00 0.00 H new ATOM 0 HH21 ARG A 127 8.630 0.340 11.754 1.00 0.00 H new ATOM 0 HH22 ARG A 127 7.938 -0.916 12.786 1.00 0.00 H new ATOM 1967 N VAL A 128 15.814 2.939 11.347 1.00 0.00 N ATOM 1968 CA VAL A 128 16.146 4.352 11.392 1.00 0.00 C ATOM 1969 C VAL A 128 14.907 5.156 11.764 1.00 0.00 C ATOM 1970 O VAL A 128 14.980 6.122 12.523 1.00 0.00 O ATOM 1971 CB VAL A 128 16.666 4.787 10.028 1.00 0.00 C ATOM 1972 CG1 VAL A 128 17.826 3.896 9.629 1.00 0.00 C ATOM 1973 CG2 VAL A 128 15.545 4.655 8.995 1.00 0.00 C ATOM 0 H VAL A 128 15.673 2.567 10.408 1.00 0.00 H new ATOM 0 HA VAL A 128 16.917 4.528 12.142 1.00 0.00 H new ATOM 0 HB VAL A 128 17.000 5.824 10.074 1.00 0.00 H new ATOM 0 HG11 VAL A 128 18.202 4.203 8.653 1.00 0.00 H new ATOM 0 HG12 VAL A 128 18.622 3.983 10.368 1.00 0.00 H new ATOM 0 HG13 VAL A 128 17.489 2.861 9.578 1.00 0.00 H new ATOM 0 HG21 VAL A 128 15.913 4.965 8.017 1.00 0.00 H new ATOM 0 HG22 VAL A 128 15.216 3.617 8.946 1.00 0.00 H new ATOM 0 HG23 VAL A 128 14.707 5.288 9.285 1.00 0.00 H new ATOM 1983 N ILE A 129 13.764 4.727 11.237 1.00 0.00 N ATOM 1984 CA ILE A 129 12.495 5.384 11.529 1.00 0.00 C ATOM 1985 C ILE A 129 11.864 4.725 12.751 1.00 0.00 C ATOM 1986 O ILE A 129 12.145 3.569 13.047 1.00 0.00 O ATOM 1987 CB ILE A 129 11.560 5.293 10.314 1.00 0.00 C ATOM 1988 CG1 ILE A 129 10.212 5.965 10.618 1.00 0.00 C ATOM 1989 CG2 ILE A 129 11.321 3.825 9.962 1.00 0.00 C ATOM 1990 CD1 ILE A 129 10.417 7.450 10.932 1.00 0.00 C ATOM 0 H ILE A 129 13.691 3.929 10.607 1.00 0.00 H new ATOM 0 HA ILE A 129 12.666 6.439 11.742 1.00 0.00 H new ATOM 0 HB ILE A 129 12.030 5.806 9.475 1.00 0.00 H new ATOM 0 HG12 ILE A 129 9.543 5.856 9.765 1.00 0.00 H new ATOM 0 HG13 ILE A 129 9.734 5.470 11.463 1.00 0.00 H new ATOM 0 HG21 ILE A 129 10.657 3.761 9.100 1.00 0.00 H new ATOM 0 HG22 ILE A 129 12.272 3.348 9.724 1.00 0.00 H new ATOM 0 HG23 ILE A 129 10.863 3.317 10.811 1.00 0.00 H new ATOM 0 HD11 ILE A 129 9.454 7.913 11.145 1.00 0.00 H new ATOM 0 HD12 ILE A 129 11.069 7.552 11.800 1.00 0.00 H new ATOM 0 HD13 ILE A 129 10.875 7.943 10.075 1.00 0.00 H new ATOM 2002 N SER A 130 11.043 5.465 13.479 1.00 0.00 N ATOM 2003 CA SER A 130 10.429 4.916 14.684 1.00 0.00 C ATOM 2004 C SER A 130 9.042 4.347 14.412 1.00 0.00 C ATOM 2005 O SER A 130 8.228 4.953 13.715 1.00 0.00 O ATOM 2006 CB SER A 130 10.334 5.995 15.758 1.00 0.00 C ATOM 2007 OG SER A 130 9.199 6.810 15.506 1.00 0.00 O ATOM 0 H SER A 130 10.788 6.429 13.265 1.00 0.00 H new ATOM 0 HA SER A 130 11.064 4.100 15.029 1.00 0.00 H new ATOM 0 HB2 SER A 130 10.255 5.537 16.744 1.00 0.00 H new ATOM 0 HB3 SER A 130 11.239 6.603 15.760 1.00 0.00 H new ATOM 0 HG SER A 130 9.279 7.217 14.618 1.00 0.00 H new ATOM 2013 N TYR A 131 8.784 3.182 14.997 1.00 0.00 N ATOM 2014 CA TYR A 131 7.492 2.521 14.856 1.00 0.00 C ATOM 2015 C TYR A 131 6.390 3.479 15.284 1.00 0.00 C ATOM 2016 O TYR A 131 5.280 3.455 14.757 1.00 0.00 O ATOM 2017 CB TYR A 131 7.466 1.276 15.755 1.00 0.00 C ATOM 2018 CG TYR A 131 6.332 0.352 15.363 1.00 0.00 C ATOM 2019 CD1 TYR A 131 5.004 0.704 15.643 1.00 0.00 C ATOM 2020 CD2 TYR A 131 6.612 -0.865 14.730 1.00 0.00 C ATOM 2021 CE1 TYR A 131 3.961 -0.159 15.286 1.00 0.00 C ATOM 2022 CE2 TYR A 131 5.568 -1.728 14.375 1.00 0.00 C ATOM 2023 CZ TYR A 131 4.242 -1.374 14.651 1.00 0.00 C ATOM 2024 OH TYR A 131 3.214 -2.224 14.300 1.00 0.00 O ATOM 0 H TYR A 131 9.455 2.675 15.575 1.00 0.00 H new ATOM 0 HA TYR A 131 7.336 2.228 13.818 1.00 0.00 H new ATOM 0 HB2 TYR A 131 8.416 0.746 15.678 1.00 0.00 H new ATOM 0 HB3 TYR A 131 7.352 1.577 16.797 1.00 0.00 H new ATOM 0 HD1 TYR A 131 4.786 1.641 16.134 1.00 0.00 H new ATOM 0 HD2 TYR A 131 7.634 -1.139 14.515 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.938 0.113 15.501 1.00 0.00 H new ATOM 0 HE2 TYR A 131 5.786 -2.667 13.888 1.00 0.00 H new ATOM 0 HH TYR A 131 3.583 -3.022 13.868 1.00 0.00 H new ATOM 2034 N GLU A 132 6.727 4.319 16.251 1.00 0.00 N ATOM 2035 CA GLU A 132 5.793 5.301 16.788 1.00 0.00 C ATOM 2036 C GLU A 132 5.478 6.371 15.758 1.00 0.00 C ATOM 2037 O GLU A 132 4.346 6.480 15.291 1.00 0.00 O ATOM 2038 CB GLU A 132 6.403 5.945 18.019 1.00 0.00 C ATOM 2039 CG GLU A 132 6.716 4.857 19.034 1.00 0.00 C ATOM 2040 CD GLU A 132 8.206 4.855 19.349 1.00 0.00 C ATOM 2041 OE1 GLU A 132 8.975 4.545 18.453 1.00 0.00 O ATOM 2042 OE2 GLU A 132 8.556 5.162 20.476 1.00 0.00 O ATOM 0 H GLU A 132 7.650 4.341 16.685 1.00 0.00 H new ATOM 0 HA GLU A 132 4.864 4.794 17.050 1.00 0.00 H new ATOM 0 HB2 GLU A 132 7.311 6.485 17.752 1.00 0.00 H new ATOM 0 HB3 GLU A 132 5.713 6.673 18.446 1.00 0.00 H new ATOM 0 HG2 GLU A 132 6.143 5.023 19.946 1.00 0.00 H new ATOM 0 HG3 GLU A 132 6.417 3.885 18.642 1.00 0.00 H new ATOM 2049 N GLU A 133 6.488 7.156 15.407 1.00 0.00 N ATOM 2050 CA GLU A 133 6.308 8.210 14.423 1.00 0.00 C ATOM 2051 C GLU A 133 5.457 7.696 13.275 1.00 0.00 C ATOM 2052 O GLU A 133 4.581 8.398 12.779 1.00 0.00 O ATOM 2053 CB GLU A 133 7.662 8.666 13.895 1.00 0.00 C ATOM 2054 CG GLU A 133 8.425 9.400 15.000 1.00 0.00 C ATOM 2055 CD GLU A 133 9.924 9.382 14.707 1.00 0.00 C ATOM 2056 OE1 GLU A 133 10.404 8.372 14.218 1.00 0.00 O ATOM 2057 OE2 GLU A 133 10.570 10.382 14.976 1.00 0.00 O ATOM 0 H GLU A 133 7.432 7.083 15.786 1.00 0.00 H new ATOM 0 HA GLU A 133 5.807 9.056 14.894 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.238 7.806 13.551 1.00 0.00 H new ATOM 0 HB3 GLU A 133 7.526 9.323 13.036 1.00 0.00 H new ATOM 0 HG2 GLU A 133 8.074 10.429 15.073 1.00 0.00 H new ATOM 0 HG3 GLU A 133 8.229 8.928 15.963 1.00 0.00 H new ATOM 2064 N GLY A 134 5.720 6.456 12.872 1.00 0.00 N ATOM 2065 CA GLY A 134 4.987 5.831 11.796 1.00 0.00 C ATOM 2066 C GLY A 134 3.573 5.504 12.231 1.00 0.00 C ATOM 2067 O GLY A 134 2.628 5.583 11.445 1.00 0.00 O ATOM 0 H GLY A 134 6.444 5.867 13.284 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.963 6.495 10.932 1.00 0.00 H new ATOM 0 HA3 GLY A 134 5.497 4.920 11.483 1.00 0.00 H new ATOM 2071 N LYS A 135 3.440 5.154 13.496 1.00 0.00 N ATOM 2072 CA LYS A 135 2.137 4.831 14.057 1.00 0.00 C ATOM 2073 C LYS A 135 1.253 6.063 14.020 1.00 0.00 C ATOM 2074 O LYS A 135 0.164 6.039 13.454 1.00 0.00 O ATOM 2075 CB LYS A 135 2.280 4.351 15.502 1.00 0.00 C ATOM 2076 CG LYS A 135 0.982 3.670 15.943 1.00 0.00 C ATOM 2077 CD LYS A 135 0.797 3.845 17.452 1.00 0.00 C ATOM 2078 CE LYS A 135 -0.418 3.039 17.916 1.00 0.00 C ATOM 2079 NZ LYS A 135 -1.665 3.692 17.426 1.00 0.00 N ATOM 0 H LYS A 135 4.215 5.085 14.156 1.00 0.00 H new ATOM 0 HA LYS A 135 1.687 4.034 13.465 1.00 0.00 H new ATOM 0 HB2 LYS A 135 3.115 3.655 15.585 1.00 0.00 H new ATOM 0 HB3 LYS A 135 2.502 5.194 16.156 1.00 0.00 H new ATOM 0 HG2 LYS A 135 0.134 4.101 15.410 1.00 0.00 H new ATOM 0 HG3 LYS A 135 1.012 2.610 15.691 1.00 0.00 H new ATOM 0 HD2 LYS A 135 1.691 3.511 17.979 1.00 0.00 H new ATOM 0 HD3 LYS A 135 0.660 4.899 17.692 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -0.357 2.019 17.538 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -0.432 2.976 19.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -2.490 3.248 17.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -1.643 4.704 17.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -1.733 3.580 16.394 1.00 0.00 H new ATOM 2093 N ALA A 136 1.742 7.145 14.619 1.00 0.00 N ATOM 2094 CA ALA A 136 0.998 8.397 14.647 1.00 0.00 C ATOM 2095 C ALA A 136 0.643 8.831 13.231 1.00 0.00 C ATOM 2096 O ALA A 136 -0.415 9.413 12.994 1.00 0.00 O ATOM 2097 CB ALA A 136 1.839 9.482 15.318 1.00 0.00 C ATOM 0 H ALA A 136 2.646 7.179 15.089 1.00 0.00 H new ATOM 0 HA ALA A 136 0.079 8.247 15.213 1.00 0.00 H new ATOM 0 HB1 ALA A 136 1.279 10.417 15.337 1.00 0.00 H new ATOM 0 HB2 ALA A 136 2.076 9.180 16.338 1.00 0.00 H new ATOM 0 HB3 ALA A 136 2.763 9.624 14.758 1.00 0.00 H new ATOM 2103 N LEU A 137 1.531 8.531 12.289 1.00 0.00 N ATOM 2104 CA LEU A 137 1.314 8.873 10.906 1.00 0.00 C ATOM 2105 C LEU A 137 0.123 8.091 10.364 1.00 0.00 C ATOM 2106 O LEU A 137 -0.894 8.671 9.973 1.00 0.00 O ATOM 2107 CB LEU A 137 2.584 8.506 10.149 1.00 0.00 C ATOM 2108 CG LEU A 137 2.961 9.594 9.143 1.00 0.00 C ATOM 2109 CD1 LEU A 137 4.285 9.231 8.468 1.00 0.00 C ATOM 2110 CD2 LEU A 137 1.873 9.703 8.095 1.00 0.00 C ATOM 0 H LEU A 137 2.411 8.048 12.470 1.00 0.00 H new ATOM 0 HA LEU A 137 1.097 9.935 10.791 1.00 0.00 H new ATOM 0 HB2 LEU A 137 3.402 8.360 10.855 1.00 0.00 H new ATOM 0 HB3 LEU A 137 2.440 7.559 9.628 1.00 0.00 H new ATOM 0 HG LEU A 137 3.069 10.548 9.660 1.00 0.00 H new ATOM 0 HD11 LEU A 137 4.553 10.007 7.751 1.00 0.00 H new ATOM 0 HD12 LEU A 137 5.067 9.148 9.222 1.00 0.00 H new ATOM 0 HD13 LEU A 137 4.180 8.278 7.949 1.00 0.00 H new ATOM 0 HD21 LEU A 137 2.137 10.478 7.375 1.00 0.00 H new ATOM 0 HD22 LEU A 137 1.768 8.749 7.579 1.00 0.00 H new ATOM 0 HD23 LEU A 137 0.929 9.961 8.576 1.00 0.00 H new ATOM 2122 N ALA A 138 0.257 6.771 10.345 1.00 0.00 N ATOM 2123 CA ALA A 138 -0.814 5.922 9.848 1.00 0.00 C ATOM 2124 C ALA A 138 -2.116 6.221 10.588 1.00 0.00 C ATOM 2125 O ALA A 138 -3.194 6.179 10.000 1.00 0.00 O ATOM 2126 CB ALA A 138 -0.441 4.439 9.997 1.00 0.00 C ATOM 0 H ALA A 138 1.087 6.271 10.664 1.00 0.00 H new ATOM 0 HA ALA A 138 -0.959 6.135 8.789 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -1.255 3.820 9.620 1.00 0.00 H new ATOM 0 HB2 ALA A 138 0.466 4.233 9.428 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -0.269 4.211 11.049 1.00 0.00 H new ATOM 2132 N GLU A 139 -2.015 6.544 11.874 1.00 0.00 N ATOM 2133 CA GLU A 139 -3.195 6.866 12.659 1.00 0.00 C ATOM 2134 C GLU A 139 -3.777 8.204 12.201 1.00 0.00 C ATOM 2135 O GLU A 139 -4.983 8.432 12.295 1.00 0.00 O ATOM 2136 CB GLU A 139 -2.827 6.904 14.151 1.00 0.00 C ATOM 2137 CG GLU A 139 -3.537 8.058 14.854 1.00 0.00 C ATOM 2138 CD GLU A 139 -3.351 7.936 16.363 1.00 0.00 C ATOM 2139 OE1 GLU A 139 -2.349 8.427 16.858 1.00 0.00 O ATOM 2140 OE2 GLU A 139 -4.212 7.353 17.001 1.00 0.00 O ATOM 0 H GLU A 139 -1.135 6.589 12.388 1.00 0.00 H new ATOM 0 HA GLU A 139 -3.954 6.098 12.511 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -3.102 5.960 14.622 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -1.748 7.013 14.262 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -3.137 9.010 14.505 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -4.599 8.048 14.607 1.00 0.00 H new ATOM 2147 N SER A 140 -2.907 9.089 11.718 1.00 0.00 N ATOM 2148 CA SER A 140 -3.344 10.406 11.264 1.00 0.00 C ATOM 2149 C SER A 140 -4.270 10.282 10.059 1.00 0.00 C ATOM 2150 O SER A 140 -5.331 10.905 10.016 1.00 0.00 O ATOM 2151 CB SER A 140 -2.132 11.258 10.891 1.00 0.00 C ATOM 2152 OG SER A 140 -1.679 10.888 9.595 1.00 0.00 O ATOM 0 H SER A 140 -1.905 8.920 11.632 1.00 0.00 H new ATOM 0 HA SER A 140 -3.890 10.885 12.077 1.00 0.00 H new ATOM 0 HB2 SER A 140 -2.397 12.315 10.908 1.00 0.00 H new ATOM 0 HB3 SER A 140 -1.335 11.117 11.621 1.00 0.00 H new ATOM 0 HG SER A 140 -1.052 10.138 9.669 1.00 0.00 H new ATOM 2158 N TRP A 141 -3.872 9.468 9.088 1.00 0.00 N ATOM 2159 CA TRP A 141 -4.694 9.271 7.897 1.00 0.00 C ATOM 2160 C TRP A 141 -5.674 8.126 8.121 1.00 0.00 C ATOM 2161 O TRP A 141 -6.519 7.842 7.272 1.00 0.00 O ATOM 2162 CB TRP A 141 -3.823 8.936 6.686 1.00 0.00 C ATOM 2163 CG TRP A 141 -2.601 9.797 6.658 1.00 0.00 C ATOM 2164 CD1 TRP A 141 -1.330 9.334 6.696 1.00 0.00 C ATOM 2165 CD2 TRP A 141 -2.505 11.248 6.569 1.00 0.00 C ATOM 2166 NE1 TRP A 141 -0.461 10.406 6.636 1.00 0.00 N ATOM 2167 CE2 TRP A 141 -1.135 11.607 6.561 1.00 0.00 C ATOM 2168 CE3 TRP A 141 -3.460 12.278 6.499 1.00 0.00 C ATOM 2169 CZ2 TRP A 141 -0.729 12.940 6.484 1.00 0.00 C ATOM 2170 CZ3 TRP A 141 -3.054 13.620 6.424 1.00 0.00 C ATOM 2171 CH2 TRP A 141 -1.691 13.950 6.417 1.00 0.00 C ATOM 0 H TRP A 141 -2.999 8.940 9.099 1.00 0.00 H new ATOM 0 HA TRP A 141 -5.236 10.197 7.708 1.00 0.00 H new ATOM 0 HB2 TRP A 141 -3.533 7.886 6.720 1.00 0.00 H new ATOM 0 HB3 TRP A 141 -4.396 9.079 5.770 1.00 0.00 H new ATOM 0 HD1 TRP A 141 -1.042 8.295 6.762 1.00 0.00 H new ATOM 0 HE1 TRP A 141 0.555 10.320 6.646 1.00 0.00 H new ATOM 0 HE3 TRP A 141 -4.512 12.035 6.503 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 0.322 13.189 6.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 -3.796 14.403 6.371 1.00 0.00 H new ATOM 0 HH2 TRP A 141 -1.386 14.984 6.360 1.00 0.00 H new ATOM 2182 N ASN A 142 -5.534 7.458 9.259 1.00 0.00 N ATOM 2183 CA ASN A 142 -6.389 6.323 9.583 1.00 0.00 C ATOM 2184 C ASN A 142 -5.940 5.116 8.772 1.00 0.00 C ATOM 2185 O ASN A 142 -6.717 4.200 8.500 1.00 0.00 O ATOM 2186 CB ASN A 142 -7.858 6.641 9.287 1.00 0.00 C ATOM 2187 CG ASN A 142 -8.735 6.116 10.419 1.00 0.00 C ATOM 2188 OD1 ASN A 142 -9.711 5.406 10.175 1.00 0.00 O ATOM 2189 ND2 ASN A 142 -8.441 6.427 11.653 1.00 0.00 N ATOM 0 H ASN A 142 -4.839 7.681 9.971 1.00 0.00 H new ATOM 0 HA ASN A 142 -6.302 6.106 10.648 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -7.993 7.717 9.179 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -8.156 6.186 8.342 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -9.021 6.082 12.418 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -7.632 7.015 11.852 1.00 0.00 H new ATOM 2196 N ALA A 143 -4.667 5.135 8.400 1.00 0.00 N ATOM 2197 CA ALA A 143 -4.070 4.064 7.628 1.00 0.00 C ATOM 2198 C ALA A 143 -3.514 3.011 8.555 1.00 0.00 C ATOM 2199 O ALA A 143 -3.425 3.221 9.765 1.00 0.00 O ATOM 2200 CB ALA A 143 -2.933 4.617 6.776 1.00 0.00 C ATOM 0 H ALA A 143 -4.024 5.894 8.627 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.834 3.624 6.988 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -2.486 3.809 6.197 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -3.322 5.377 6.098 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -2.176 5.061 7.423 1.00 0.00 H new ATOM 2206 N ALA A 144 -3.143 1.881 7.984 1.00 0.00 N ATOM 2207 CA ALA A 144 -2.593 0.795 8.781 1.00 0.00 C ATOM 2208 C ALA A 144 -1.079 0.678 8.588 1.00 0.00 C ATOM 2209 O ALA A 144 -0.576 0.729 7.466 1.00 0.00 O ATOM 2210 CB ALA A 144 -3.289 -0.501 8.406 1.00 0.00 C ATOM 0 H ALA A 144 -3.210 1.689 6.984 1.00 0.00 H new ATOM 0 HA ALA A 144 -2.768 1.006 9.836 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -2.881 -1.318 9.000 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.358 -0.410 8.600 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.129 -0.707 7.348 1.00 0.00 H new ATOM 2216 N PHE A 145 -0.365 0.541 9.703 1.00 0.00 N ATOM 2217 CA PHE A 145 1.090 0.438 9.689 1.00 0.00 C ATOM 2218 C PHE A 145 1.511 -1.031 9.745 1.00 0.00 C ATOM 2219 O PHE A 145 1.102 -1.777 10.634 1.00 0.00 O ATOM 2220 CB PHE A 145 1.628 1.221 10.893 1.00 0.00 C ATOM 2221 CG PHE A 145 3.128 1.083 11.017 1.00 0.00 C ATOM 2222 CD1 PHE A 145 3.712 -0.123 11.433 1.00 0.00 C ATOM 2223 CD2 PHE A 145 3.935 2.183 10.726 1.00 0.00 C ATOM 2224 CE1 PHE A 145 5.101 -0.220 11.545 1.00 0.00 C ATOM 2225 CE2 PHE A 145 5.327 2.085 10.843 1.00 0.00 C ATOM 2226 CZ PHE A 145 5.909 0.881 11.248 1.00 0.00 C ATOM 0 H PHE A 145 -0.777 0.499 10.635 1.00 0.00 H new ATOM 0 HA PHE A 145 1.500 0.857 8.770 1.00 0.00 H new ATOM 0 HB2 PHE A 145 1.366 2.274 10.790 1.00 0.00 H new ATOM 0 HB3 PHE A 145 1.152 0.861 11.805 1.00 0.00 H new ATOM 0 HD1 PHE A 145 3.089 -0.974 11.666 1.00 0.00 H new ATOM 0 HD2 PHE A 145 3.485 3.112 10.410 1.00 0.00 H new ATOM 0 HE1 PHE A 145 5.552 -1.149 11.862 1.00 0.00 H new ATOM 0 HE2 PHE A 145 5.950 2.939 10.621 1.00 0.00 H new ATOM 0 HZ PHE A 145 6.983 0.801 11.331 1.00 0.00 H new ATOM 2236 N LEU A 146 2.278 -1.443 8.734 1.00 0.00 N ATOM 2237 CA LEU A 146 2.721 -2.824 8.567 1.00 0.00 C ATOM 2238 C LEU A 146 4.215 -2.876 8.259 1.00 0.00 C ATOM 2239 O LEU A 146 4.696 -2.057 7.511 1.00 0.00 O ATOM 2240 CB LEU A 146 1.956 -3.422 7.389 1.00 0.00 C ATOM 2241 CG LEU A 146 0.901 -4.413 7.866 1.00 0.00 C ATOM 2242 CD1 LEU A 146 1.561 -5.629 8.484 1.00 0.00 C ATOM 2243 CD2 LEU A 146 0.002 -3.742 8.876 1.00 0.00 C ATOM 0 H LEU A 146 2.612 -0.818 8.001 1.00 0.00 H new ATOM 0 HA LEU A 146 2.535 -3.380 9.486 1.00 0.00 H new ATOM 0 HB2 LEU A 146 1.479 -2.625 6.819 1.00 0.00 H new ATOM 0 HB3 LEU A 146 2.652 -3.923 6.716 1.00 0.00 H new ATOM 0 HG LEU A 146 0.307 -4.739 7.013 1.00 0.00 H new ATOM 0 HD11 LEU A 146 0.795 -6.328 8.820 1.00 0.00 H new ATOM 0 HD12 LEU A 146 2.195 -6.115 7.743 1.00 0.00 H new ATOM 0 HD13 LEU A 146 2.169 -5.320 9.335 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -0.753 -4.450 9.218 1.00 0.00 H new ATOM 0 HD22 LEU A 146 0.596 -3.407 9.726 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -0.487 -2.884 8.414 1.00 0.00 H new ATOM 2255 N GLU A 147 4.943 -3.830 8.837 1.00 0.00 N ATOM 2256 CA GLU A 147 6.387 -3.956 8.567 1.00 0.00 C ATOM 2257 C GLU A 147 6.706 -5.397 8.179 1.00 0.00 C ATOM 2258 O GLU A 147 6.601 -6.311 8.997 1.00 0.00 O ATOM 2259 CB GLU A 147 7.207 -3.544 9.799 1.00 0.00 C ATOM 2260 CG GLU A 147 8.707 -3.663 9.492 1.00 0.00 C ATOM 2261 CD GLU A 147 9.495 -2.591 10.250 1.00 0.00 C ATOM 2262 OE1 GLU A 147 9.206 -1.417 10.052 1.00 0.00 O ATOM 2263 OE2 GLU A 147 10.385 -2.960 11.012 1.00 0.00 O ATOM 0 H GLU A 147 4.570 -4.521 9.487 1.00 0.00 H new ATOM 0 HA GLU A 147 6.653 -3.292 7.745 1.00 0.00 H new ATOM 0 HB2 GLU A 147 6.965 -2.520 10.082 1.00 0.00 H new ATOM 0 HB3 GLU A 147 6.949 -4.178 10.647 1.00 0.00 H new ATOM 0 HG2 GLU A 147 9.065 -4.653 9.774 1.00 0.00 H new ATOM 0 HG3 GLU A 147 8.875 -3.557 8.420 1.00 0.00 H new ATOM 2270 N SER A 148 7.068 -5.591 6.912 1.00 0.00 N ATOM 2271 CA SER A 148 7.369 -6.924 6.402 1.00 0.00 C ATOM 2272 C SER A 148 8.591 -6.916 5.483 1.00 0.00 C ATOM 2273 O SER A 148 9.229 -5.884 5.294 1.00 0.00 O ATOM 2274 CB SER A 148 6.161 -7.438 5.621 1.00 0.00 C ATOM 2275 OG SER A 148 5.836 -6.504 4.600 1.00 0.00 O ATOM 0 H SER A 148 7.159 -4.844 6.223 1.00 0.00 H new ATOM 0 HA SER A 148 7.589 -7.572 7.250 1.00 0.00 H new ATOM 0 HB2 SER A 148 6.382 -8.411 5.184 1.00 0.00 H new ATOM 0 HB3 SER A 148 5.311 -7.575 6.290 1.00 0.00 H new ATOM 0 HG SER A 148 5.439 -6.976 3.839 1.00 0.00 H new ATOM 2281 N SER A 149 8.910 -8.083 4.919 1.00 0.00 N ATOM 2282 CA SER A 149 10.058 -8.201 4.017 1.00 0.00 C ATOM 2283 C SER A 149 9.722 -9.081 2.810 1.00 0.00 C ATOM 2284 O SER A 149 9.059 -10.108 2.952 1.00 0.00 O ATOM 2285 CB SER A 149 11.243 -8.811 4.765 1.00 0.00 C ATOM 2286 OG SER A 149 10.773 -9.453 5.943 1.00 0.00 O ATOM 0 H SER A 149 8.396 -8.951 5.068 1.00 0.00 H new ATOM 0 HA SER A 149 10.313 -7.202 3.663 1.00 0.00 H new ATOM 0 HB2 SER A 149 11.760 -9.528 4.128 1.00 0.00 H new ATOM 0 HB3 SER A 149 11.964 -8.035 5.022 1.00 0.00 H new ATOM 0 HG SER A 149 11.530 -9.847 6.425 1.00 0.00 H new ATOM 2292 N ALA A 150 10.199 -8.687 1.625 1.00 0.00 N ATOM 2293 CA ALA A 150 9.959 -9.464 0.421 1.00 0.00 C ATOM 2294 C ALA A 150 10.538 -10.859 0.588 1.00 0.00 C ATOM 2295 O ALA A 150 9.910 -11.856 0.232 1.00 0.00 O ATOM 2296 CB ALA A 150 10.616 -8.776 -0.772 1.00 0.00 C ATOM 0 H ALA A 150 10.749 -7.840 1.482 1.00 0.00 H new ATOM 0 HA ALA A 150 8.885 -9.538 0.249 1.00 0.00 H new ATOM 0 HB1 ALA A 150 10.435 -9.360 -1.674 1.00 0.00 H new ATOM 0 HB2 ALA A 150 10.194 -7.779 -0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 150 11.690 -8.697 -0.600 1.00 0.00 H new ATOM 2302 N LYS A 151 11.739 -10.915 1.146 1.00 0.00 N ATOM 2303 CA LYS A 151 12.407 -12.189 1.378 1.00 0.00 C ATOM 2304 C LYS A 151 11.634 -13.016 2.404 1.00 0.00 C ATOM 2305 O LYS A 151 12.084 -14.081 2.824 1.00 0.00 O ATOM 2306 CB LYS A 151 13.831 -11.945 1.884 1.00 0.00 C ATOM 2307 CG LYS A 151 14.726 -13.121 1.488 1.00 0.00 C ATOM 2308 CD LYS A 151 16.002 -13.098 2.333 1.00 0.00 C ATOM 2309 CE LYS A 151 15.792 -13.935 3.596 1.00 0.00 C ATOM 2310 NZ LYS A 151 16.002 -15.376 3.277 1.00 0.00 N ATOM 0 H LYS A 151 12.270 -10.097 1.446 1.00 0.00 H new ATOM 0 HA LYS A 151 12.445 -12.739 0.437 1.00 0.00 H new ATOM 0 HB2 LYS A 151 14.223 -11.019 1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 151 13.827 -11.827 2.968 1.00 0.00 H new ATOM 0 HG2 LYS A 151 14.196 -14.062 1.636 1.00 0.00 H new ATOM 0 HG3 LYS A 151 14.977 -13.060 0.429 1.00 0.00 H new ATOM 0 HD2 LYS A 151 16.839 -13.493 1.757 1.00 0.00 H new ATOM 0 HD3 LYS A 151 16.255 -12.072 2.601 1.00 0.00 H new ATOM 0 HE2 LYS A 151 16.486 -13.619 4.374 1.00 0.00 H new ATOM 0 HE3 LYS A 151 14.785 -13.780 3.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 15.859 -15.946 4.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 15.323 -15.673 2.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 16.971 -15.516 2.925 1.00 0.00 H new ATOM 2324 N GLU A 152 10.468 -12.512 2.807 1.00 0.00 N ATOM 2325 CA GLU A 152 9.640 -13.206 3.789 1.00 0.00 C ATOM 2326 C GLU A 152 8.171 -13.185 3.369 1.00 0.00 C ATOM 2327 O GLU A 152 7.575 -12.119 3.216 1.00 0.00 O ATOM 2328 CB GLU A 152 9.789 -12.536 5.156 1.00 0.00 C ATOM 2329 CG GLU A 152 10.086 -13.597 6.218 1.00 0.00 C ATOM 2330 CD GLU A 152 10.122 -12.954 7.600 1.00 0.00 C ATOM 2331 OE1 GLU A 152 10.770 -11.930 7.740 1.00 0.00 O ATOM 2332 OE2 GLU A 152 9.500 -13.495 8.500 1.00 0.00 O ATOM 0 H GLU A 152 10.078 -11.631 2.470 1.00 0.00 H new ATOM 0 HA GLU A 152 9.972 -14.243 3.849 1.00 0.00 H new ATOM 0 HB2 GLU A 152 10.594 -11.801 5.126 1.00 0.00 H new ATOM 0 HB3 GLU A 152 8.876 -11.998 5.410 1.00 0.00 H new ATOM 0 HG2 GLU A 152 9.324 -14.376 6.190 1.00 0.00 H new ATOM 0 HG3 GLU A 152 11.041 -14.078 6.006 1.00 0.00 H new ATOM 2339 N ASN A 153 7.594 -14.370 3.185 1.00 0.00 N ATOM 2340 CA ASN A 153 6.193 -14.480 2.784 1.00 0.00 C ATOM 2341 C ASN A 153 5.267 -14.238 3.968 1.00 0.00 C ATOM 2342 O ASN A 153 4.403 -13.362 3.921 1.00 0.00 O ATOM 2343 CB ASN A 153 5.923 -15.873 2.216 1.00 0.00 C ATOM 2344 CG ASN A 153 6.134 -15.875 0.709 1.00 0.00 C ATOM 2345 OD1 ASN A 153 6.954 -16.638 0.200 1.00 0.00 O ATOM 2346 ND2 ASN A 153 5.440 -15.061 -0.039 1.00 0.00 N ATOM 0 H ASN A 153 8.071 -15.263 3.306 1.00 0.00 H new ATOM 0 HA ASN A 153 5.999 -13.723 2.024 1.00 0.00 H new ATOM 0 HB2 ASN A 153 6.587 -16.600 2.685 1.00 0.00 H new ATOM 0 HB3 ASN A 153 4.902 -16.177 2.448 1.00 0.00 H new ATOM 0 HD21 ASN A 153 5.576 -15.056 -1.050 1.00 0.00 H new ATOM 0 HD22 ASN A 153 4.761 -14.430 0.387 1.00 0.00 H new ATOM 2353 N GLN A 154 5.449 -15.032 5.019 1.00 0.00 N ATOM 2354 CA GLN A 154 4.624 -14.915 6.217 1.00 0.00 C ATOM 2355 C GLN A 154 4.295 -13.456 6.510 1.00 0.00 C ATOM 2356 O GLN A 154 3.128 -13.077 6.583 1.00 0.00 O ATOM 2357 CB GLN A 154 5.358 -15.534 7.412 1.00 0.00 C ATOM 2358 CG GLN A 154 4.906 -14.861 8.712 1.00 0.00 C ATOM 2359 CD GLN A 154 5.290 -15.729 9.906 1.00 0.00 C ATOM 2360 OE1 GLN A 154 6.364 -16.330 9.918 1.00 0.00 O ATOM 2361 NE2 GLN A 154 4.471 -15.830 10.916 1.00 0.00 N ATOM 0 H GLN A 154 6.159 -15.762 5.065 1.00 0.00 H new ATOM 0 HA GLN A 154 3.689 -15.449 6.047 1.00 0.00 H new ATOM 0 HB2 GLN A 154 5.157 -16.604 7.458 1.00 0.00 H new ATOM 0 HB3 GLN A 154 6.435 -15.417 7.288 1.00 0.00 H new ATOM 0 HG2 GLN A 154 5.368 -13.878 8.802 1.00 0.00 H new ATOM 0 HG3 GLN A 154 3.827 -14.706 8.696 1.00 0.00 H new ATOM 0 HE21 GLN A 154 3.582 -15.331 10.903 1.00 0.00 H new ATOM 0 HE22 GLN A 154 4.720 -16.408 11.719 1.00 0.00 H new ATOM 2370 N THR A 155 5.323 -12.642 6.686 1.00 0.00 N ATOM 2371 CA THR A 155 5.109 -11.234 6.977 1.00 0.00 C ATOM 2372 C THR A 155 4.168 -10.620 5.941 1.00 0.00 C ATOM 2373 O THR A 155 3.176 -9.973 6.287 1.00 0.00 O ATOM 2374 CB THR A 155 6.440 -10.488 6.976 1.00 0.00 C ATOM 2375 OG1 THR A 155 7.032 -10.567 5.688 1.00 0.00 O ATOM 2376 CG2 THR A 155 7.378 -11.103 8.006 1.00 0.00 C ATOM 0 H THR A 155 6.301 -12.926 6.634 1.00 0.00 H new ATOM 0 HA THR A 155 4.655 -11.146 7.964 1.00 0.00 H new ATOM 0 HB THR A 155 6.263 -9.443 7.230 1.00 0.00 H new ATOM 0 HG1 THR A 155 6.933 -11.477 5.338 1.00 0.00 H new ATOM 0 HG21 THR A 155 8.327 -10.566 8.001 1.00 0.00 H new ATOM 0 HG22 THR A 155 6.927 -11.033 8.996 1.00 0.00 H new ATOM 0 HG23 THR A 155 7.552 -12.150 7.760 1.00 0.00 H new ATOM 2384 N ALA A 156 4.477 -10.845 4.669 1.00 0.00 N ATOM 2385 CA ALA A 156 3.648 -10.329 3.588 1.00 0.00 C ATOM 2386 C ALA A 156 2.197 -10.681 3.844 1.00 0.00 C ATOM 2387 O ALA A 156 1.340 -9.810 3.975 1.00 0.00 O ATOM 2388 CB ALA A 156 4.079 -10.958 2.271 1.00 0.00 C ATOM 0 H ALA A 156 5.291 -11.378 4.363 1.00 0.00 H new ATOM 0 HA ALA A 156 3.762 -9.246 3.539 1.00 0.00 H new ATOM 0 HB1 ALA A 156 3.458 -10.571 1.463 1.00 0.00 H new ATOM 0 HB2 ALA A 156 5.123 -10.713 2.075 1.00 0.00 H new ATOM 0 HB3 ALA A 156 3.965 -12.040 2.330 1.00 0.00 H new ATOM 2394 N VAL A 157 1.941 -11.977 3.921 1.00 0.00 N ATOM 2395 CA VAL A 157 0.593 -12.467 4.171 1.00 0.00 C ATOM 2396 C VAL A 157 -0.090 -11.600 5.224 1.00 0.00 C ATOM 2397 O VAL A 157 -1.210 -11.134 5.034 1.00 0.00 O ATOM 2398 CB VAL A 157 0.661 -13.918 4.652 1.00 0.00 C ATOM 2399 CG1 VAL A 157 -0.747 -14.457 4.911 1.00 0.00 C ATOM 2400 CG2 VAL A 157 1.343 -14.770 3.583 1.00 0.00 C ATOM 0 H VAL A 157 2.645 -12.707 3.815 1.00 0.00 H new ATOM 0 HA VAL A 157 0.014 -12.419 3.249 1.00 0.00 H new ATOM 0 HB VAL A 157 1.231 -13.960 5.580 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -0.684 -15.490 5.253 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -1.234 -13.851 5.675 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -1.328 -14.414 3.990 1.00 0.00 H new ATOM 0 HG21 VAL A 157 1.394 -15.805 3.921 1.00 0.00 H new ATOM 0 HG22 VAL A 157 0.771 -14.718 2.657 1.00 0.00 H new ATOM 0 HG23 VAL A 157 2.351 -14.395 3.408 1.00 0.00 H new ATOM 2410 N ASP A 158 0.597 -11.391 6.334 1.00 0.00 N ATOM 2411 CA ASP A 158 0.052 -10.578 7.414 1.00 0.00 C ATOM 2412 C ASP A 158 -0.375 -9.208 6.894 1.00 0.00 C ATOM 2413 O ASP A 158 -1.327 -8.612 7.397 1.00 0.00 O ATOM 2414 CB ASP A 158 1.100 -10.403 8.515 1.00 0.00 C ATOM 2415 CG ASP A 158 0.421 -10.343 9.879 1.00 0.00 C ATOM 2416 OD1 ASP A 158 -0.745 -9.987 9.923 1.00 0.00 O ATOM 2417 OD2 ASP A 158 1.076 -10.654 10.860 1.00 0.00 O ATOM 0 H ASP A 158 1.527 -11.769 6.513 1.00 0.00 H new ATOM 0 HA ASP A 158 -0.822 -11.087 7.820 1.00 0.00 H new ATOM 0 HB2 ASP A 158 1.808 -11.231 8.489 1.00 0.00 H new ATOM 0 HB3 ASP A 158 1.670 -9.490 8.343 1.00 0.00 H new ATOM 2422 N VAL A 159 0.344 -8.710 5.892 1.00 0.00 N ATOM 2423 CA VAL A 159 0.051 -7.413 5.319 1.00 0.00 C ATOM 2424 C VAL A 159 -1.186 -7.499 4.415 1.00 0.00 C ATOM 2425 O VAL A 159 -1.907 -6.517 4.233 1.00 0.00 O ATOM 2426 CB VAL A 159 1.288 -6.917 4.541 1.00 0.00 C ATOM 2427 CG1 VAL A 159 1.111 -5.457 4.172 1.00 0.00 C ATOM 2428 CG2 VAL A 159 2.555 -7.034 5.404 1.00 0.00 C ATOM 0 H VAL A 159 1.135 -9.192 5.464 1.00 0.00 H new ATOM 0 HA VAL A 159 -0.173 -6.698 6.110 1.00 0.00 H new ATOM 0 HB VAL A 159 1.390 -7.532 3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 159 1.987 -5.112 3.623 1.00 0.00 H new ATOM 0 HG12 VAL A 159 0.224 -5.344 3.548 1.00 0.00 H new ATOM 0 HG13 VAL A 159 0.994 -4.864 5.079 1.00 0.00 H new ATOM 0 HG21 VAL A 159 3.416 -6.679 4.837 1.00 0.00 H new ATOM 0 HG22 VAL A 159 2.439 -6.430 6.304 1.00 0.00 H new ATOM 0 HG23 VAL A 159 2.710 -8.076 5.684 1.00 0.00 H new ATOM 2438 N PHE A 160 -1.424 -8.688 3.872 1.00 0.00 N ATOM 2439 CA PHE A 160 -2.580 -8.930 2.995 1.00 0.00 C ATOM 2440 C PHE A 160 -3.887 -8.932 3.782 1.00 0.00 C ATOM 2441 O PHE A 160 -4.910 -8.426 3.318 1.00 0.00 O ATOM 2442 CB PHE A 160 -2.424 -10.278 2.288 1.00 0.00 C ATOM 2443 CG PHE A 160 -3.718 -11.061 2.374 1.00 0.00 C ATOM 2444 CD1 PHE A 160 -4.023 -11.795 3.528 1.00 0.00 C ATOM 2445 CD2 PHE A 160 -4.609 -11.058 1.294 1.00 0.00 C ATOM 2446 CE1 PHE A 160 -5.217 -12.523 3.601 1.00 0.00 C ATOM 2447 CE2 PHE A 160 -5.803 -11.789 1.368 1.00 0.00 C ATOM 2448 CZ PHE A 160 -6.106 -12.520 2.521 1.00 0.00 C ATOM 0 H PHE A 160 -0.833 -9.506 4.020 1.00 0.00 H new ATOM 0 HA PHE A 160 -2.615 -8.122 2.264 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -2.153 -10.121 1.244 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -1.614 -10.846 2.746 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -3.337 -11.799 4.362 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -4.376 -10.492 0.404 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -5.452 -13.087 4.492 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -6.489 -11.788 0.534 1.00 0.00 H new ATOM 0 HZ PHE A 160 -7.026 -13.082 2.578 1.00 0.00 H new ATOM 2458 N ARG A 161 -3.865 -9.518 4.963 1.00 0.00 N ATOM 2459 CA ARG A 161 -5.071 -9.570 5.776 1.00 0.00 C ATOM 2460 C ARG A 161 -5.307 -8.249 6.494 1.00 0.00 C ATOM 2461 O ARG A 161 -6.417 -7.717 6.485 1.00 0.00 O ATOM 2462 CB ARG A 161 -4.989 -10.709 6.785 1.00 0.00 C ATOM 2463 CG ARG A 161 -6.248 -10.711 7.655 1.00 0.00 C ATOM 2464 CD ARG A 161 -6.504 -12.124 8.180 1.00 0.00 C ATOM 2465 NE ARG A 161 -6.891 -13.008 7.086 1.00 0.00 N ATOM 2466 CZ ARG A 161 -8.162 -13.127 6.710 1.00 0.00 C ATOM 2467 NH1 ARG A 161 -9.092 -12.440 7.315 1.00 0.00 N ATOM 2468 NH2 ARG A 161 -8.478 -13.931 5.731 1.00 0.00 N ATOM 0 H ARG A 161 -3.044 -9.958 5.378 1.00 0.00 H new ATOM 0 HA ARG A 161 -5.914 -9.751 5.109 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -4.891 -11.663 6.266 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -4.103 -10.593 7.409 1.00 0.00 H new ATOM 0 HG2 ARG A 161 -6.128 -10.018 8.488 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -7.104 -10.367 7.075 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -5.607 -12.507 8.666 1.00 0.00 H new ATOM 0 HD3 ARG A 161 -7.290 -12.102 8.934 1.00 0.00 H new ATOM 0 HE ARG A 161 -6.173 -13.545 6.600 1.00 0.00 H new ATOM 0 HH11 ARG A 161 -8.846 -11.810 8.078 1.00 0.00 H new ATOM 0 HH12 ARG A 161 -10.065 -12.533 7.025 1.00 0.00 H new ATOM 0 HH21 ARG A 161 -7.751 -14.466 5.256 1.00 0.00 H new ATOM 0 HH22 ARG A 161 -9.452 -14.024 5.441 1.00 0.00 H new ATOM 2482 N ARG A 162 -4.263 -7.728 7.121 1.00 0.00 N ATOM 2483 CA ARG A 162 -4.375 -6.475 7.846 1.00 0.00 C ATOM 2484 C ARG A 162 -4.852 -5.354 6.933 1.00 0.00 C ATOM 2485 O ARG A 162 -5.628 -4.496 7.355 1.00 0.00 O ATOM 2486 CB ARG A 162 -3.024 -6.100 8.452 1.00 0.00 C ATOM 2487 CG ARG A 162 -2.646 -7.118 9.528 1.00 0.00 C ATOM 2488 CD ARG A 162 -3.095 -6.603 10.896 1.00 0.00 C ATOM 2489 NE ARG A 162 -2.406 -5.359 11.220 1.00 0.00 N ATOM 2490 CZ ARG A 162 -2.905 -4.509 12.111 1.00 0.00 C ATOM 2491 NH1 ARG A 162 -4.032 -4.780 12.710 1.00 0.00 N ATOM 2492 NH2 ARG A 162 -2.269 -3.404 12.387 1.00 0.00 N ATOM 0 H ARG A 162 -3.335 -8.151 7.142 1.00 0.00 H new ATOM 0 HA ARG A 162 -5.109 -6.610 8.641 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -2.260 -6.075 7.675 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -3.072 -5.100 8.883 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -3.116 -8.078 9.317 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -1.569 -7.283 9.525 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -4.173 -6.440 10.895 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -2.887 -7.352 11.660 1.00 0.00 H new ATOM 0 HE ARG A 162 -1.526 -5.138 10.755 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -4.529 -5.644 12.494 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -4.416 -4.128 13.394 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -1.388 -3.192 11.919 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -2.653 -2.752 13.071 1.00 0.00 H new ATOM 2506 N ILE A 163 -4.393 -5.350 5.681 1.00 0.00 N ATOM 2507 CA ILE A 163 -4.807 -4.306 4.760 1.00 0.00 C ATOM 2508 C ILE A 163 -6.280 -4.472 4.393 1.00 0.00 C ATOM 2509 O ILE A 163 -7.074 -3.567 4.631 1.00 0.00 O ATOM 2510 CB ILE A 163 -3.915 -4.295 3.513 1.00 0.00 C ATOM 2511 CG1 ILE A 163 -4.374 -3.166 2.564 1.00 0.00 C ATOM 2512 CG2 ILE A 163 -4.023 -5.635 2.813 1.00 0.00 C ATOM 2513 CD1 ILE A 163 -3.482 -3.095 1.318 1.00 0.00 C ATOM 0 H ILE A 163 -3.751 -6.042 5.294 1.00 0.00 H new ATOM 0 HA ILE A 163 -4.692 -3.341 5.254 1.00 0.00 H new ATOM 0 HB ILE A 163 -2.878 -4.120 3.800 1.00 0.00 H new ATOM 0 HG12 ILE A 163 -5.408 -3.336 2.265 1.00 0.00 H new ATOM 0 HG13 ILE A 163 -4.347 -2.211 3.089 1.00 0.00 H new ATOM 0 HG21 ILE A 163 -3.391 -5.634 1.925 1.00 0.00 H new ATOM 0 HG22 ILE A 163 -3.698 -6.426 3.489 1.00 0.00 H new ATOM 0 HG23 ILE A 163 -5.058 -5.811 2.521 1.00 0.00 H new ATOM 0 HD11 ILE A 163 -3.828 -2.292 0.668 1.00 0.00 H new ATOM 0 HD12 ILE A 163 -2.452 -2.901 1.618 1.00 0.00 H new ATOM 0 HD13 ILE A 163 -3.531 -4.042 0.781 1.00 0.00 H new ATOM 2525 N ILE A 164 -6.660 -5.623 3.833 1.00 0.00 N ATOM 2526 CA ILE A 164 -8.065 -5.832 3.484 1.00 0.00 C ATOM 2527 C ILE A 164 -8.959 -5.400 4.646 1.00 0.00 C ATOM 2528 O ILE A 164 -10.060 -4.882 4.447 1.00 0.00 O ATOM 2529 CB ILE A 164 -8.323 -7.287 3.149 1.00 0.00 C ATOM 2530 CG1 ILE A 164 -7.489 -7.662 1.928 1.00 0.00 C ATOM 2531 CG2 ILE A 164 -9.802 -7.473 2.809 1.00 0.00 C ATOM 2532 CD1 ILE A 164 -7.490 -9.175 1.779 1.00 0.00 C ATOM 0 H ILE A 164 -6.037 -6.401 3.617 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.297 -5.229 2.606 1.00 0.00 H new ATOM 0 HB ILE A 164 -8.058 -7.916 3.999 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.899 -7.194 1.033 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.469 -7.295 2.041 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -9.991 -8.519 2.567 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -10.411 -7.182 3.665 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -10.059 -6.850 1.952 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -6.897 -9.455 0.909 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -7.061 -9.629 2.672 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -8.513 -9.527 1.649 1.00 0.00 H new ATOM 2544 N LEU A 165 -8.475 -5.622 5.860 1.00 0.00 N ATOM 2545 CA LEU A 165 -9.231 -5.265 7.052 1.00 0.00 C ATOM 2546 C LEU A 165 -9.484 -3.761 7.110 1.00 0.00 C ATOM 2547 O LEU A 165 -10.630 -3.312 7.026 1.00 0.00 O ATOM 2548 CB LEU A 165 -8.458 -5.729 8.294 1.00 0.00 C ATOM 2549 CG LEU A 165 -9.282 -6.736 9.095 1.00 0.00 C ATOM 2550 CD1 LEU A 165 -10.586 -6.088 9.523 1.00 0.00 C ATOM 2551 CD2 LEU A 165 -9.561 -7.963 8.228 1.00 0.00 C ATOM 0 H LEU A 165 -7.566 -6.046 6.045 1.00 0.00 H new ATOM 0 HA LEU A 165 -10.201 -5.761 7.020 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.513 -6.182 7.993 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -8.215 -4.870 8.920 1.00 0.00 H new ATOM 0 HG LEU A 165 -8.731 -7.046 9.983 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -11.177 -6.803 10.095 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -10.373 -5.216 10.142 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -11.145 -5.779 8.640 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.149 -8.684 8.796 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -10.116 -7.662 7.339 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.617 -8.419 7.929 1.00 0.00 H new ATOM 2563 N GLU A 166 -8.420 -2.979 7.239 1.00 0.00 N ATOM 2564 CA GLU A 166 -8.580 -1.534 7.283 1.00 0.00 C ATOM 2565 C GLU A 166 -9.349 -1.090 6.057 1.00 0.00 C ATOM 2566 O GLU A 166 -10.206 -0.210 6.126 1.00 0.00 O ATOM 2567 CB GLU A 166 -7.212 -0.846 7.327 1.00 0.00 C ATOM 2568 CG GLU A 166 -7.365 0.587 7.844 1.00 0.00 C ATOM 2569 CD GLU A 166 -6.494 1.531 7.022 1.00 0.00 C ATOM 2570 OE1 GLU A 166 -5.378 1.153 6.707 1.00 0.00 O ATOM 2571 OE2 GLU A 166 -6.957 2.618 6.717 1.00 0.00 O ATOM 0 H GLU A 166 -7.459 -3.312 7.313 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.129 -1.256 8.183 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -6.535 -1.405 7.973 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -6.768 -0.837 6.332 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -8.409 0.895 7.783 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -7.079 0.636 8.895 1.00 0.00 H new ATOM 2578 N ALA A 167 -9.058 -1.737 4.942 1.00 0.00 N ATOM 2579 CA ALA A 167 -9.747 -1.435 3.706 1.00 0.00 C ATOM 2580 C ALA A 167 -11.241 -1.437 3.969 1.00 0.00 C ATOM 2581 O ALA A 167 -11.992 -0.641 3.403 1.00 0.00 O ATOM 2582 CB ALA A 167 -9.403 -2.488 2.653 1.00 0.00 C ATOM 0 H ALA A 167 -8.353 -2.470 4.870 1.00 0.00 H new ATOM 0 HA ALA A 167 -9.438 -0.457 3.338 1.00 0.00 H new ATOM 0 HB1 ALA A 167 -9.924 -2.257 1.724 1.00 0.00 H new ATOM 0 HB2 ALA A 167 -8.327 -2.488 2.476 1.00 0.00 H new ATOM 0 HB3 ALA A 167 -9.712 -3.471 3.007 1.00 0.00 H new ATOM 2588 N GLU A 168 -11.656 -2.335 4.854 1.00 0.00 N ATOM 2589 CA GLU A 168 -13.062 -2.444 5.219 1.00 0.00 C ATOM 2590 C GLU A 168 -13.499 -1.207 5.992 1.00 0.00 C ATOM 2591 O GLU A 168 -14.486 -0.560 5.644 1.00 0.00 O ATOM 2592 CB GLU A 168 -13.294 -3.694 6.069 1.00 0.00 C ATOM 2593 CG GLU A 168 -14.686 -4.258 5.775 1.00 0.00 C ATOM 2594 CD GLU A 168 -14.677 -5.006 4.446 1.00 0.00 C ATOM 2595 OE1 GLU A 168 -14.813 -4.358 3.422 1.00 0.00 O ATOM 2596 OE2 GLU A 168 -14.534 -6.218 4.472 1.00 0.00 O ATOM 0 H GLU A 168 -11.042 -2.995 5.330 1.00 0.00 H new ATOM 0 HA GLU A 168 -13.653 -2.522 4.307 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -12.533 -4.443 5.850 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -13.205 -3.449 7.127 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -14.992 -4.929 6.577 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -15.415 -3.449 5.741 1.00 0.00 H new ATOM 2603 N LYS A 169 -12.752 -0.884 7.044 1.00 0.00 N ATOM 2604 CA LYS A 169 -13.070 0.281 7.863 1.00 0.00 C ATOM 2605 C LYS A 169 -13.167 1.535 6.996 1.00 0.00 C ATOM 2606 O LYS A 169 -14.218 2.175 6.927 1.00 0.00 O ATOM 2607 CB LYS A 169 -11.995 0.480 8.933 1.00 0.00 C ATOM 2608 CG LYS A 169 -12.645 0.997 10.218 1.00 0.00 C ATOM 2609 CD LYS A 169 -11.586 1.675 11.091 1.00 0.00 C ATOM 2610 CE LYS A 169 -11.594 3.182 10.826 1.00 0.00 C ATOM 2611 NZ LYS A 169 -12.928 3.741 11.186 1.00 0.00 N ATOM 0 H LYS A 169 -11.930 -1.407 7.347 1.00 0.00 H new ATOM 0 HA LYS A 169 -14.032 0.110 8.345 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -11.480 -0.461 9.126 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -11.244 1.188 8.582 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -13.439 1.704 9.977 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -13.106 0.172 10.762 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -11.788 1.479 12.144 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -10.601 1.262 10.873 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -10.814 3.669 11.410 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -11.376 3.379 9.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -12.813 4.710 11.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -13.537 3.756 10.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -13.366 3.148 11.920 1.00 0.00 H new ATOM 2625 N ILE A 170 -12.066 1.881 6.337 1.00 0.00 N ATOM 2626 CA ILE A 170 -12.047 3.064 5.479 1.00 0.00 C ATOM 2627 C ILE A 170 -13.237 3.053 4.521 1.00 0.00 C ATOM 2628 O ILE A 170 -13.769 4.109 4.169 1.00 0.00 O ATOM 2629 CB ILE A 170 -10.746 3.111 4.670 1.00 0.00 C ATOM 2630 CG1 ILE A 170 -9.532 3.004 5.606 1.00 0.00 C ATOM 2631 CG2 ILE A 170 -10.673 4.420 3.881 1.00 0.00 C ATOM 2632 CD1 ILE A 170 -9.617 4.050 6.723 1.00 0.00 C ATOM 0 H ILE A 170 -11.185 1.368 6.378 1.00 0.00 H new ATOM 0 HA ILE A 170 -12.111 3.946 6.116 1.00 0.00 H new ATOM 0 HB ILE A 170 -10.734 2.269 3.978 1.00 0.00 H new ATOM 0 HG12 ILE A 170 -9.487 2.005 6.039 1.00 0.00 H new ATOM 0 HG13 ILE A 170 -8.614 3.146 5.037 1.00 0.00 H new ATOM 0 HG21 ILE A 170 -9.746 4.448 3.308 1.00 0.00 H new ATOM 0 HG22 ILE A 170 -11.522 4.483 3.201 1.00 0.00 H new ATOM 0 HG23 ILE A 170 -10.698 5.263 4.572 1.00 0.00 H new ATOM 0 HD11 ILE A 170 -8.748 3.958 7.375 1.00 0.00 H new ATOM 0 HD12 ILE A 170 -9.638 5.048 6.286 1.00 0.00 H new ATOM 0 HD13 ILE A 170 -10.525 3.889 7.304 1.00 0.00 H new ATOM 2644 N ASP A 171 -13.654 1.858 4.101 1.00 0.00 N ATOM 2645 CA ASP A 171 -14.783 1.744 3.185 1.00 0.00 C ATOM 2646 C ASP A 171 -16.062 2.200 3.872 1.00 0.00 C ATOM 2647 O ASP A 171 -16.897 2.873 3.268 1.00 0.00 O ATOM 2648 CB ASP A 171 -14.943 0.302 2.716 1.00 0.00 C ATOM 2649 CG ASP A 171 -16.392 -0.145 2.881 1.00 0.00 C ATOM 2650 OD1 ASP A 171 -16.794 -0.378 4.009 1.00 0.00 O ATOM 2651 OD2 ASP A 171 -17.078 -0.246 1.878 1.00 0.00 O ATOM 0 H ASP A 171 -13.233 0.970 4.376 1.00 0.00 H new ATOM 0 HA ASP A 171 -14.591 2.380 2.321 1.00 0.00 H new ATOM 0 HB2 ASP A 171 -14.644 0.216 1.671 1.00 0.00 H new ATOM 0 HB3 ASP A 171 -14.285 -0.351 3.290 1.00 0.00 H new ATOM 2656 N GLY A 172 -16.203 1.843 5.143 1.00 0.00 N ATOM 2657 CA GLY A 172 -17.379 2.239 5.905 1.00 0.00 C ATOM 2658 C GLY A 172 -17.451 3.757 5.998 1.00 0.00 C ATOM 2659 O GLY A 172 -18.534 4.342 5.997 1.00 0.00 O ATOM 0 H GLY A 172 -15.525 1.286 5.663 1.00 0.00 H new ATOM 0 HA2 GLY A 172 -18.279 1.852 5.427 1.00 0.00 H new ATOM 0 HA3 GLY A 172 -17.338 1.807 6.905 1.00 0.00 H new ATOM 2663 N ALA A 173 -16.283 4.390 6.069 1.00 0.00 N ATOM 2664 CA ALA A 173 -16.216 5.844 6.151 1.00 0.00 C ATOM 2665 C ALA A 173 -16.663 6.470 4.834 1.00 0.00 C ATOM 2666 O ALA A 173 -17.805 6.911 4.704 1.00 0.00 O ATOM 2667 CB ALA A 173 -14.787 6.284 6.471 1.00 0.00 C ATOM 0 H ALA A 173 -15.377 3.922 6.071 1.00 0.00 H new ATOM 0 HA ALA A 173 -16.882 6.179 6.946 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -14.746 7.372 6.530 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -14.480 5.857 7.425 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -14.115 5.938 5.685 1.00 0.00 H new ATOM 2673 N ALA A 174 -15.755 6.504 3.859 1.00 0.00 N ATOM 2674 CA ALA A 174 -16.066 7.075 2.552 1.00 0.00 C ATOM 2675 C ALA A 174 -17.486 6.713 2.126 1.00 0.00 C ATOM 2676 O ALA A 174 -18.194 7.529 1.537 1.00 0.00 O ATOM 2677 CB ALA A 174 -15.077 6.554 1.509 1.00 0.00 C ATOM 0 H ALA A 174 -14.805 6.145 3.950 1.00 0.00 H new ATOM 0 HA ALA A 174 -15.987 8.160 2.626 1.00 0.00 H new ATOM 0 HB1 ALA A 174 -15.314 6.984 0.536 1.00 0.00 H new ATOM 0 HB2 ALA A 174 -14.064 6.839 1.794 1.00 0.00 H new ATOM 0 HB3 ALA A 174 -15.146 5.468 1.453 1.00 0.00 H new