USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 783 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 46 GLN : amide:sc= -7.24! C(o=-7.5!,f=-20!) USER MOD Set 1.2: A 76 TYR OH : rot 180:sc= -0.3 USER MOD Single : A 1 GLY N :NH3+ -135:sc= 0.0523 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 44:sc= 0.489 USER MOD Single : A 9 SER OG : rot -59:sc= 0.169 USER MOD Single : A 19 THR OG1 : rot -81:sc= 0.468 USER MOD Single : A 26 HIS : no HE2:sc= -3.48! C(o=-3.5!,f=-4.7!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 100:sc= -0.0692 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.00315 USER MOD Single : A 63 THR OG1 : rot 44:sc= 0.953 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot -53:sc= -2.12! USER MOD Single : A 92 SER OG : rot -172:sc= -5.96! USER MOD Single : A 93 ASN : amide:sc= -1.12 K(o=-1.1,f=-5!) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.839 K(o=-0.84,f=-3.3!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot -78:sc= 0.901 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 24:sc= 1.12 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.891 21.947 -22.009 1.00 0.00 N ATOM 2 CA GLY A 1 11.197 22.449 -20.836 1.00 0.00 C ATOM 3 C GLY A 1 9.958 21.606 -20.528 1.00 0.00 C ATOM 4 O GLY A 1 9.918 20.418 -20.844 1.00 0.00 O ATOM 0 H1 GLY A 1 12.913 21.914 -21.820 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.549 20.990 -22.232 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.708 22.577 -22.816 1.00 0.00 H new ATOM 0 HA2 GLY A 1 11.870 22.439 -19.979 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.904 23.486 -20.999 1.00 0.00 H new ATOM 8 N SER A 2 8.978 22.254 -19.916 1.00 0.00 N ATOM 9 CA SER A 2 7.741 21.578 -19.562 1.00 0.00 C ATOM 10 C SER A 2 6.774 22.566 -18.907 1.00 0.00 C ATOM 11 O SER A 2 7.198 23.479 -18.200 1.00 0.00 O ATOM 12 CB SER A 2 8.007 20.396 -18.628 1.00 0.00 C ATOM 13 OG SER A 2 8.661 20.800 -17.429 1.00 0.00 O ATOM 0 H SER A 2 9.015 23.240 -19.656 1.00 0.00 H new ATOM 0 HA SER A 2 7.290 21.190 -20.475 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.063 19.910 -18.380 1.00 0.00 H new ATOM 0 HB3 SER A 2 8.620 19.657 -19.144 1.00 0.00 H new ATOM 0 HG SER A 2 8.811 20.017 -16.859 1.00 0.00 H new ATOM 19 N SER A 3 5.493 22.350 -19.165 1.00 0.00 N ATOM 20 CA SER A 3 4.462 23.210 -18.608 1.00 0.00 C ATOM 21 C SER A 3 3.856 22.562 -17.362 1.00 0.00 C ATOM 22 O SER A 3 3.157 23.220 -16.593 1.00 0.00 O ATOM 23 CB SER A 3 3.370 23.499 -19.640 1.00 0.00 C ATOM 24 OG SER A 3 3.443 24.833 -20.135 1.00 0.00 O ATOM 0 H SER A 3 5.145 21.592 -19.752 1.00 0.00 H new ATOM 0 HA SER A 3 4.922 24.158 -18.329 1.00 0.00 H new ATOM 0 HB2 SER A 3 3.461 22.799 -20.470 1.00 0.00 H new ATOM 0 HB3 SER A 3 2.392 23.333 -19.189 1.00 0.00 H new ATOM 0 HG SER A 3 2.731 24.977 -20.792 1.00 0.00 H new ATOM 30 N GLY A 4 4.147 21.279 -17.200 1.00 0.00 N ATOM 31 CA GLY A 4 3.639 20.535 -16.060 1.00 0.00 C ATOM 32 C GLY A 4 4.451 20.842 -14.800 1.00 0.00 C ATOM 33 O GLY A 4 5.441 21.570 -14.857 1.00 0.00 O ATOM 0 H GLY A 4 4.728 20.736 -17.839 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.592 20.788 -15.893 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.679 19.466 -16.271 1.00 0.00 H new ATOM 37 N SER A 5 4.001 20.271 -13.692 1.00 0.00 N ATOM 38 CA SER A 5 4.674 20.475 -12.420 1.00 0.00 C ATOM 39 C SER A 5 4.376 19.307 -11.478 1.00 0.00 C ATOM 40 O SER A 5 3.508 18.482 -11.760 1.00 0.00 O ATOM 41 CB SER A 5 4.248 21.796 -11.777 1.00 0.00 C ATOM 42 OG SER A 5 5.368 22.580 -11.375 1.00 0.00 O ATOM 0 H SER A 5 3.180 19.668 -13.649 1.00 0.00 H new ATOM 0 HA SER A 5 5.747 20.521 -12.604 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.643 22.364 -12.483 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.619 21.591 -10.911 1.00 0.00 H new ATOM 0 HG SER A 5 5.054 23.416 -10.971 1.00 0.00 H new ATOM 48 N SER A 6 5.113 19.273 -10.377 1.00 0.00 N ATOM 49 CA SER A 6 4.939 18.219 -9.392 1.00 0.00 C ATOM 50 C SER A 6 5.650 18.596 -8.091 1.00 0.00 C ATOM 51 O SER A 6 6.858 18.829 -8.084 1.00 0.00 O ATOM 52 CB SER A 6 5.466 16.882 -9.916 1.00 0.00 C ATOM 53 OG SER A 6 4.427 16.078 -10.469 1.00 0.00 O ATOM 0 H SER A 6 5.832 19.959 -10.146 1.00 0.00 H new ATOM 0 HA SER A 6 3.872 18.107 -9.197 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.226 17.065 -10.675 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.951 16.340 -9.104 1.00 0.00 H new ATOM 0 HG SER A 6 3.849 16.633 -11.033 1.00 0.00 H new ATOM 59 N GLY A 7 4.870 18.645 -7.021 1.00 0.00 N ATOM 60 CA GLY A 7 5.410 18.991 -5.717 1.00 0.00 C ATOM 61 C GLY A 7 4.792 18.122 -4.620 1.00 0.00 C ATOM 62 O GLY A 7 4.485 18.612 -3.534 1.00 0.00 O ATOM 0 H GLY A 7 3.869 18.451 -7.030 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.492 18.862 -5.722 1.00 0.00 H new ATOM 0 HA3 GLY A 7 5.215 20.042 -5.506 1.00 0.00 H new ATOM 66 N LEU A 8 4.626 16.847 -4.941 1.00 0.00 N ATOM 67 CA LEU A 8 4.050 15.906 -3.997 1.00 0.00 C ATOM 68 C LEU A 8 5.087 14.835 -3.653 1.00 0.00 C ATOM 69 O LEU A 8 5.523 14.086 -4.525 1.00 0.00 O ATOM 70 CB LEU A 8 2.736 15.338 -4.539 1.00 0.00 C ATOM 71 CG LEU A 8 2.093 14.225 -3.710 1.00 0.00 C ATOM 72 CD1 LEU A 8 1.483 14.784 -2.423 1.00 0.00 C ATOM 73 CD2 LEU A 8 1.069 13.446 -4.538 1.00 0.00 C ATOM 0 H LEU A 8 4.881 16.444 -5.843 1.00 0.00 H new ATOM 0 HA LEU A 8 3.792 16.411 -3.066 1.00 0.00 H new ATOM 0 HB2 LEU A 8 2.020 16.155 -4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 8 2.915 14.957 -5.545 1.00 0.00 H new ATOM 0 HG LEU A 8 2.873 13.522 -3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.032 13.973 -1.852 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.263 15.258 -1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 8 0.719 15.520 -2.672 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.627 12.661 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 8 0.286 14.123 -4.880 1.00 0.00 H new ATOM 0 HD23 LEU A 8 1.563 12.998 -5.400 1.00 0.00 H new ATOM 85 N SER A 9 5.452 14.797 -2.380 1.00 0.00 N ATOM 86 CA SER A 9 6.430 13.831 -1.910 1.00 0.00 C ATOM 87 C SER A 9 5.764 12.467 -1.712 1.00 0.00 C ATOM 88 O SER A 9 4.575 12.391 -1.407 1.00 0.00 O ATOM 89 CB SER A 9 7.084 14.297 -0.608 1.00 0.00 C ATOM 90 OG SER A 9 6.122 14.542 0.414 1.00 0.00 O ATOM 0 H SER A 9 5.088 15.420 -1.659 1.00 0.00 H new ATOM 0 HA SER A 9 7.212 13.741 -2.664 1.00 0.00 H new ATOM 0 HB2 SER A 9 7.791 13.541 -0.267 1.00 0.00 H new ATOM 0 HB3 SER A 9 7.655 15.207 -0.794 1.00 0.00 H new ATOM 0 HG SER A 9 5.493 15.231 0.113 1.00 0.00 H new ATOM 96 N PRO A 10 6.582 11.396 -1.897 1.00 0.00 N ATOM 97 CA PRO A 10 6.085 10.040 -1.741 1.00 0.00 C ATOM 98 C PRO A 10 5.903 9.689 -0.263 1.00 0.00 C ATOM 99 O PRO A 10 6.417 10.384 0.612 1.00 0.00 O ATOM 100 CB PRO A 10 7.112 9.162 -2.438 1.00 0.00 C ATOM 101 CG PRO A 10 8.372 10.005 -2.551 1.00 0.00 C ATOM 102 CD PRO A 10 7.996 11.448 -2.258 1.00 0.00 C ATOM 0 HA PRO A 10 5.097 9.901 -2.181 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.300 8.253 -1.867 1.00 0.00 H new ATOM 0 HB3 PRO A 10 6.759 8.853 -3.422 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.128 9.657 -1.847 1.00 0.00 H new ATOM 0 HG3 PRO A 10 8.801 9.918 -3.549 1.00 0.00 H new ATOM 0 HD2 PRO A 10 8.597 11.857 -1.446 1.00 0.00 H new ATOM 0 HD3 PRO A 10 8.160 12.084 -3.128 1.00 0.00 H new ATOM 110 N PRO A 11 5.150 8.582 -0.024 1.00 0.00 N ATOM 111 CA PRO A 11 4.893 8.130 1.333 1.00 0.00 C ATOM 112 C PRO A 11 6.131 7.459 1.931 1.00 0.00 C ATOM 113 O PRO A 11 7.129 7.261 1.240 1.00 0.00 O ATOM 114 CB PRO A 11 3.705 7.188 1.216 1.00 0.00 C ATOM 115 CG PRO A 11 3.635 6.786 -0.248 1.00 0.00 C ATOM 116 CD PRO A 11 4.525 7.734 -1.035 1.00 0.00 C ATOM 0 HA PRO A 11 4.668 8.951 2.014 1.00 0.00 H new ATOM 0 HB2 PRO A 11 3.835 6.315 1.855 1.00 0.00 H new ATOM 0 HB3 PRO A 11 2.784 7.679 1.531 1.00 0.00 H new ATOM 0 HG2 PRO A 11 3.966 5.756 -0.377 1.00 0.00 H new ATOM 0 HG3 PRO A 11 2.608 6.838 -0.609 1.00 0.00 H new ATOM 0 HD2 PRO A 11 5.272 7.189 -1.611 1.00 0.00 H new ATOM 0 HD3 PRO A 11 3.945 8.325 -1.744 1.00 0.00 H new ATOM 124 N ARG A 12 6.026 7.128 3.209 1.00 0.00 N ATOM 125 CA ARG A 12 7.125 6.483 3.908 1.00 0.00 C ATOM 126 C ARG A 12 6.589 5.582 5.022 1.00 0.00 C ATOM 127 O ARG A 12 5.391 5.312 5.086 1.00 0.00 O ATOM 128 CB ARG A 12 8.076 7.519 4.512 1.00 0.00 C ATOM 129 CG ARG A 12 7.834 8.904 3.909 1.00 0.00 C ATOM 130 CD ARG A 12 8.806 9.932 4.490 1.00 0.00 C ATOM 131 NE ARG A 12 8.719 11.198 3.727 1.00 0.00 N ATOM 132 CZ ARG A 12 9.482 12.273 3.967 1.00 0.00 C ATOM 133 NH1 ARG A 12 10.393 12.243 4.949 1.00 0.00 N ATOM 134 NH2 ARG A 12 9.334 13.378 3.224 1.00 0.00 N ATOM 0 H ARG A 12 5.197 7.294 3.779 1.00 0.00 H new ATOM 0 HA ARG A 12 7.673 5.882 3.183 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.936 7.560 5.592 1.00 0.00 H new ATOM 0 HB3 ARG A 12 9.108 7.217 4.335 1.00 0.00 H new ATOM 0 HG2 ARG A 12 7.951 8.859 2.826 1.00 0.00 H new ATOM 0 HG3 ARG A 12 6.808 9.216 4.106 1.00 0.00 H new ATOM 0 HD2 ARG A 12 8.573 10.113 5.539 1.00 0.00 H new ATOM 0 HD3 ARG A 12 9.824 9.544 4.452 1.00 0.00 H new ATOM 0 HE ARG A 12 8.036 11.255 2.972 1.00 0.00 H new ATOM 0 HH11 ARG A 12 10.506 11.402 5.514 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.974 13.062 5.131 1.00 0.00 H new ATOM 0 HH21 ARG A 12 8.641 13.401 2.476 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.915 14.197 3.406 1.00 0.00 H new ATOM 148 N GLY A 13 7.504 5.140 5.874 1.00 0.00 N ATOM 149 CA GLY A 13 7.138 4.275 6.982 1.00 0.00 C ATOM 150 C GLY A 13 6.105 3.234 6.547 1.00 0.00 C ATOM 151 O GLY A 13 5.231 2.857 7.327 1.00 0.00 O ATOM 0 H GLY A 13 8.497 5.365 5.819 1.00 0.00 H new ATOM 0 HA2 GLY A 13 8.026 3.773 7.365 1.00 0.00 H new ATOM 0 HA3 GLY A 13 6.734 4.874 7.798 1.00 0.00 H new ATOM 155 N LEU A 14 6.239 2.797 5.303 1.00 0.00 N ATOM 156 CA LEU A 14 5.328 1.807 4.755 1.00 0.00 C ATOM 157 C LEU A 14 5.711 0.422 5.281 1.00 0.00 C ATOM 158 O LEU A 14 6.866 0.012 5.177 1.00 0.00 O ATOM 159 CB LEU A 14 5.294 1.897 3.228 1.00 0.00 C ATOM 160 CG LEU A 14 3.916 1.755 2.578 1.00 0.00 C ATOM 161 CD1 LEU A 14 4.043 1.377 1.101 1.00 0.00 C ATOM 162 CD2 LEU A 14 3.046 0.762 3.351 1.00 0.00 C ATOM 0 H LEU A 14 6.965 3.111 4.659 1.00 0.00 H new ATOM 0 HA LEU A 14 4.308 2.004 5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 14 5.717 2.857 2.931 1.00 0.00 H new ATOM 0 HB3 LEU A 14 5.946 1.123 2.824 1.00 0.00 H new ATOM 0 HG LEU A 14 3.416 2.723 2.621 1.00 0.00 H new ATOM 0 HD11 LEU A 14 3.049 1.282 0.663 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.600 2.152 0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 14 4.570 0.427 1.013 1.00 0.00 H new ATOM 0 HD21 LEU A 14 2.072 0.679 2.869 1.00 0.00 H new ATOM 0 HD22 LEU A 14 3.530 -0.215 3.361 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.915 1.113 4.375 1.00 0.00 H new ATOM 174 N VAL A 15 4.719 -0.261 5.834 1.00 0.00 N ATOM 175 CA VAL A 15 4.938 -1.591 6.376 1.00 0.00 C ATOM 176 C VAL A 15 3.635 -2.390 6.296 1.00 0.00 C ATOM 177 O VAL A 15 2.575 -1.830 6.020 1.00 0.00 O ATOM 178 CB VAL A 15 5.492 -1.492 7.799 1.00 0.00 C ATOM 179 CG1 VAL A 15 6.994 -1.203 7.783 1.00 0.00 C ATOM 180 CG2 VAL A 15 4.738 -0.434 8.608 1.00 0.00 C ATOM 0 H VAL A 15 3.762 0.082 5.918 1.00 0.00 H new ATOM 0 HA VAL A 15 5.684 -2.125 5.788 1.00 0.00 H new ATOM 0 HB VAL A 15 5.342 -2.456 8.286 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.363 -1.137 8.807 1.00 0.00 H new ATOM 0 HG12 VAL A 15 7.514 -2.006 7.261 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.177 -0.259 7.270 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.151 -0.384 9.615 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.843 0.537 8.124 1.00 0.00 H new ATOM 0 HG23 VAL A 15 3.683 -0.701 8.662 1.00 0.00 H new ATOM 190 N ALA A 16 3.757 -3.686 6.542 1.00 0.00 N ATOM 191 CA ALA A 16 2.603 -4.567 6.501 1.00 0.00 C ATOM 192 C ALA A 16 2.546 -5.386 7.792 1.00 0.00 C ATOM 193 O ALA A 16 3.500 -5.395 8.569 1.00 0.00 O ATOM 194 CB ALA A 16 2.678 -5.450 5.254 1.00 0.00 C ATOM 0 H ALA A 16 4.638 -4.147 6.770 1.00 0.00 H new ATOM 0 HA ALA A 16 1.681 -3.989 6.436 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.812 -6.111 5.224 1.00 0.00 H new ATOM 0 HB2 ALA A 16 2.686 -4.822 4.363 1.00 0.00 H new ATOM 0 HB3 ALA A 16 3.589 -6.047 5.285 1.00 0.00 H new ATOM 200 N VAL A 17 1.418 -6.055 7.982 1.00 0.00 N ATOM 201 CA VAL A 17 1.224 -6.875 9.166 1.00 0.00 C ATOM 202 C VAL A 17 0.068 -7.848 8.923 1.00 0.00 C ATOM 203 O VAL A 17 -1.093 -7.442 8.888 1.00 0.00 O ATOM 204 CB VAL A 17 1.007 -5.983 10.390 1.00 0.00 C ATOM 205 CG1 VAL A 17 -0.228 -5.099 10.213 1.00 0.00 C ATOM 206 CG2 VAL A 17 0.904 -6.820 11.667 1.00 0.00 C ATOM 0 H VAL A 17 0.629 -6.046 7.336 1.00 0.00 H new ATOM 0 HA VAL A 17 2.114 -7.471 9.368 1.00 0.00 H new ATOM 0 HB VAL A 17 1.874 -5.330 10.486 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.359 -4.475 11.097 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -0.098 -4.464 9.337 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -1.109 -5.727 10.078 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.750 -6.162 12.522 1.00 0.00 H new ATOM 0 HG22 VAL A 17 0.064 -7.509 11.584 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.825 -7.386 11.806 1.00 0.00 H new ATOM 216 N ARG A 18 0.426 -9.113 8.762 1.00 0.00 N ATOM 217 CA ARG A 18 -0.566 -10.147 8.524 1.00 0.00 C ATOM 218 C ARG A 18 -1.412 -10.370 9.779 1.00 0.00 C ATOM 219 O ARG A 18 -0.874 -10.560 10.869 1.00 0.00 O ATOM 220 CB ARG A 18 0.097 -11.466 8.123 1.00 0.00 C ATOM 221 CG ARG A 18 -0.756 -12.222 7.103 1.00 0.00 C ATOM 222 CD ARG A 18 -0.992 -13.667 7.549 1.00 0.00 C ATOM 223 NE ARG A 18 -1.183 -14.536 6.366 1.00 0.00 N ATOM 224 CZ ARG A 18 -2.258 -14.494 5.568 1.00 0.00 C ATOM 225 NH1 ARG A 18 -3.246 -13.624 5.820 1.00 0.00 N ATOM 226 NH2 ARG A 18 -2.346 -15.321 4.517 1.00 0.00 N ATOM 0 H ARG A 18 1.390 -9.445 8.792 1.00 0.00 H new ATOM 0 HA ARG A 18 -1.204 -9.812 7.706 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.083 -11.268 7.702 1.00 0.00 H new ATOM 0 HB3 ARG A 18 0.246 -12.085 9.007 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -1.713 -11.716 6.977 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -0.261 -12.214 6.132 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -0.143 -14.019 8.136 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -1.869 -13.719 8.194 1.00 0.00 H new ATOM 0 HE ARG A 18 -0.450 -15.209 6.144 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -3.179 -12.994 6.619 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -4.065 -13.592 5.212 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -1.594 -15.983 4.324 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -3.165 -15.289 3.910 1.00 0.00 H new ATOM 240 N THR A 19 -2.722 -10.340 9.584 1.00 0.00 N ATOM 241 CA THR A 19 -3.648 -10.537 10.687 1.00 0.00 C ATOM 242 C THR A 19 -4.730 -11.547 10.301 1.00 0.00 C ATOM 243 O THR A 19 -4.679 -12.135 9.222 1.00 0.00 O ATOM 244 CB THR A 19 -4.207 -9.169 11.085 1.00 0.00 C ATOM 245 OG1 THR A 19 -5.407 -9.050 10.326 1.00 0.00 O ATOM 246 CG2 THR A 19 -3.336 -8.013 10.587 1.00 0.00 C ATOM 0 H THR A 19 -3.165 -10.182 8.679 1.00 0.00 H new ATOM 0 HA THR A 19 -3.145 -10.963 11.555 1.00 0.00 H new ATOM 0 HB THR A 19 -4.296 -9.116 12.170 1.00 0.00 H new ATOM 0 HG1 THR A 19 -5.191 -8.760 9.415 1.00 0.00 H new ATOM 0 HG21 THR A 19 -3.777 -7.066 10.896 1.00 0.00 H new ATOM 0 HG22 THR A 19 -2.336 -8.103 11.010 1.00 0.00 H new ATOM 0 HG23 THR A 19 -3.274 -8.046 9.499 1.00 0.00 H new ATOM 254 N PRO A 20 -5.710 -11.721 11.228 1.00 0.00 N ATOM 255 CA PRO A 20 -6.804 -12.649 10.996 1.00 0.00 C ATOM 256 C PRO A 20 -7.806 -12.076 9.993 1.00 0.00 C ATOM 257 O PRO A 20 -8.357 -12.808 9.172 1.00 0.00 O ATOM 258 CB PRO A 20 -7.410 -12.894 12.368 1.00 0.00 C ATOM 259 CG PRO A 20 -6.937 -11.745 13.243 1.00 0.00 C ATOM 260 CD PRO A 20 -5.803 -11.041 12.517 1.00 0.00 C ATOM 0 HA PRO A 20 -6.473 -13.586 10.549 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -8.498 -12.922 12.315 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -7.086 -13.853 12.773 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -7.755 -11.051 13.437 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -6.598 -12.116 14.210 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -6.013 -9.979 12.390 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -4.869 -11.117 13.073 1.00 0.00 H new ATOM 268 N ARG A 21 -8.014 -10.771 10.092 1.00 0.00 N ATOM 269 CA ARG A 21 -8.941 -10.091 9.203 1.00 0.00 C ATOM 270 C ARG A 21 -8.241 -9.709 7.898 1.00 0.00 C ATOM 271 O ARG A 21 -8.884 -9.243 6.958 1.00 0.00 O ATOM 272 CB ARG A 21 -9.506 -8.829 9.859 1.00 0.00 C ATOM 273 CG ARG A 21 -10.308 -9.176 11.115 1.00 0.00 C ATOM 274 CD ARG A 21 -11.579 -8.328 11.206 1.00 0.00 C ATOM 275 NE ARG A 21 -12.009 -8.212 12.617 1.00 0.00 N ATOM 276 CZ ARG A 21 -13.247 -7.869 12.999 1.00 0.00 C ATOM 277 NH1 ARG A 21 -14.184 -7.607 12.078 1.00 0.00 N ATOM 278 NH2 ARG A 21 -13.548 -7.788 14.302 1.00 0.00 N ATOM 0 H ARG A 21 -7.556 -10.166 10.774 1.00 0.00 H new ATOM 0 HA ARG A 21 -9.762 -10.776 8.992 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -8.691 -8.154 10.119 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -10.144 -8.301 9.150 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -10.572 -10.233 11.101 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -9.693 -9.012 12.000 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -11.396 -7.337 10.790 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -12.372 -8.781 10.611 1.00 0.00 H new ATOM 0 HE ARG A 21 -11.320 -8.405 13.344 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -13.955 -7.669 11.086 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -15.126 -7.346 12.369 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -12.835 -7.987 15.004 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -14.490 -7.527 14.592 1.00 0.00 H new ATOM 292 N GLY A 22 -6.933 -9.920 7.880 1.00 0.00 N ATOM 293 CA GLY A 22 -6.139 -9.604 6.705 1.00 0.00 C ATOM 294 C GLY A 22 -4.771 -9.045 7.102 1.00 0.00 C ATOM 295 O GLY A 22 -4.332 -9.216 8.238 1.00 0.00 O ATOM 0 H GLY A 22 -6.403 -10.306 8.661 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -6.008 -10.500 6.099 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -6.668 -8.877 6.089 1.00 0.00 H new ATOM 299 N VAL A 23 -4.136 -8.387 6.144 1.00 0.00 N ATOM 300 CA VAL A 23 -2.827 -7.801 6.379 1.00 0.00 C ATOM 301 C VAL A 23 -2.934 -6.277 6.303 1.00 0.00 C ATOM 302 O VAL A 23 -3.263 -5.726 5.253 1.00 0.00 O ATOM 303 CB VAL A 23 -1.810 -8.379 5.392 1.00 0.00 C ATOM 304 CG1 VAL A 23 -2.345 -9.655 4.739 1.00 0.00 C ATOM 305 CG2 VAL A 23 -1.422 -7.343 4.335 1.00 0.00 C ATOM 0 H VAL A 23 -4.503 -8.246 5.203 1.00 0.00 H new ATOM 0 HA VAL A 23 -2.470 -8.052 7.378 1.00 0.00 H new ATOM 0 HB VAL A 23 -0.911 -8.640 5.951 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -1.603 -10.046 4.042 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -2.548 -10.400 5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -3.266 -9.430 4.201 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -0.698 -7.779 3.646 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.310 -7.037 3.782 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -0.981 -6.474 4.822 1.00 0.00 H new ATOM 315 N LEU A 24 -2.650 -5.639 7.428 1.00 0.00 N ATOM 316 CA LEU A 24 -2.710 -4.189 7.502 1.00 0.00 C ATOM 317 C LEU A 24 -1.407 -3.600 6.957 1.00 0.00 C ATOM 318 O LEU A 24 -0.347 -4.214 7.074 1.00 0.00 O ATOM 319 CB LEU A 24 -3.039 -3.738 8.927 1.00 0.00 C ATOM 320 CG LEU A 24 -4.363 -2.993 9.105 1.00 0.00 C ATOM 321 CD1 LEU A 24 -4.755 -2.916 10.582 1.00 0.00 C ATOM 322 CD2 LEU A 24 -4.305 -1.609 8.455 1.00 0.00 C ATOM 0 H LEU A 24 -2.378 -6.099 8.296 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.518 -3.809 6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.050 -4.617 9.572 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -2.233 -3.095 9.279 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.143 -3.557 8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -5.700 -2.381 10.680 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.865 -3.924 10.982 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -3.980 -2.388 11.137 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.259 -1.101 8.596 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.510 -1.023 8.916 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.105 -1.716 7.389 1.00 0.00 H new ATOM 334 N LEU A 25 -1.528 -2.417 6.374 1.00 0.00 N ATOM 335 CA LEU A 25 -0.373 -1.738 5.810 1.00 0.00 C ATOM 336 C LEU A 25 -0.257 -0.342 6.425 1.00 0.00 C ATOM 337 O LEU A 25 -1.087 0.527 6.163 1.00 0.00 O ATOM 338 CB LEU A 25 -0.448 -1.733 4.282 1.00 0.00 C ATOM 339 CG LEU A 25 -0.516 -3.105 3.609 1.00 0.00 C ATOM 340 CD1 LEU A 25 -1.104 -2.997 2.201 1.00 0.00 C ATOM 341 CD2 LEU A 25 0.856 -3.783 3.606 1.00 0.00 C ATOM 0 H LEU A 25 -2.408 -1.911 6.280 1.00 0.00 H new ATOM 0 HA LEU A 25 0.543 -2.273 6.059 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -1.326 -1.160 3.983 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.424 -1.204 3.897 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.187 -3.737 4.191 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.141 -3.986 1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -2.112 -2.586 2.258 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.479 -2.342 1.595 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.780 -4.757 3.122 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.568 -3.162 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.199 -3.914 4.632 1.00 0.00 H new ATOM 353 N HIS A 26 0.780 -0.171 7.232 1.00 0.00 N ATOM 354 CA HIS A 26 1.015 1.105 7.887 1.00 0.00 C ATOM 355 C HIS A 26 2.055 1.903 7.097 1.00 0.00 C ATOM 356 O HIS A 26 3.124 1.387 6.773 1.00 0.00 O ATOM 357 CB HIS A 26 1.413 0.899 9.350 1.00 0.00 C ATOM 358 CG HIS A 26 0.693 -0.242 10.027 1.00 0.00 C ATOM 359 ND1 HIS A 26 1.028 -0.695 11.292 1.00 0.00 N ATOM 360 CD2 HIS A 26 -0.346 -1.018 9.603 1.00 0.00 C ATOM 361 CE1 HIS A 26 0.220 -1.698 11.604 1.00 0.00 C ATOM 362 NE2 HIS A 26 -0.630 -1.897 10.556 1.00 0.00 N ATOM 0 H HIS A 26 1.466 -0.894 7.447 1.00 0.00 H new ATOM 0 HA HIS A 26 0.093 1.687 7.900 1.00 0.00 H new ATOM 0 HB2 HIS A 26 2.487 0.719 9.402 1.00 0.00 H new ATOM 0 HB3 HIS A 26 1.216 1.818 9.902 1.00 0.00 H new ATOM 0 HD1 HIS A 26 1.770 -0.320 11.883 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -0.852 -0.932 8.653 1.00 0.00 H new ATOM 0 HE1 HIS A 26 0.232 -2.259 12.526 1.00 0.00 H new ATOM 370 N TRP A 27 1.705 3.148 6.810 1.00 0.00 N ATOM 371 CA TRP A 27 2.594 4.022 6.064 1.00 0.00 C ATOM 372 C TRP A 27 2.581 5.396 6.737 1.00 0.00 C ATOM 373 O TRP A 27 1.870 5.602 7.720 1.00 0.00 O ATOM 374 CB TRP A 27 2.198 4.076 4.587 1.00 0.00 C ATOM 375 CG TRP A 27 0.831 4.716 4.332 1.00 0.00 C ATOM 376 CD1 TRP A 27 0.519 6.019 4.323 1.00 0.00 C ATOM 377 CD2 TRP A 27 -0.403 4.024 4.048 1.00 0.00 C ATOM 378 NE1 TRP A 27 -0.820 6.217 4.055 1.00 0.00 N ATOM 379 CE2 TRP A 27 -1.398 4.965 3.883 1.00 0.00 C ATOM 380 CE3 TRP A 27 -0.669 2.648 3.935 1.00 0.00 C ATOM 381 CZ2 TRP A 27 -2.728 4.632 3.594 1.00 0.00 C ATOM 382 CZ3 TRP A 27 -2.002 2.332 3.646 1.00 0.00 C ATOM 383 CH2 TRP A 27 -3.016 3.267 3.477 1.00 0.00 C ATOM 0 H TRP A 27 0.818 3.572 7.081 1.00 0.00 H new ATOM 0 HA TRP A 27 3.614 3.637 6.078 1.00 0.00 H new ATOM 0 HB2 TRP A 27 2.957 4.634 4.038 1.00 0.00 H new ATOM 0 HB3 TRP A 27 2.194 3.063 4.185 1.00 0.00 H new ATOM 0 HD1 TRP A 27 1.227 6.815 4.503 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -1.297 7.116 3.994 1.00 0.00 H new ATOM 0 HE3 TRP A 27 0.094 1.895 4.061 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -3.490 5.387 3.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -2.260 1.288 3.547 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -4.022 2.942 3.256 1.00 0.00 H new ATOM 394 N ASP A 28 3.374 6.300 6.181 1.00 0.00 N ATOM 395 CA ASP A 28 3.463 7.648 6.716 1.00 0.00 C ATOM 396 C ASP A 28 3.026 8.647 5.643 1.00 0.00 C ATOM 397 O ASP A 28 3.256 8.427 4.455 1.00 0.00 O ATOM 398 CB ASP A 28 4.899 7.987 7.121 1.00 0.00 C ATOM 399 CG ASP A 28 5.134 8.110 8.628 1.00 0.00 C ATOM 400 OD1 ASP A 28 4.461 7.362 9.370 1.00 0.00 O ATOM 401 OD2 ASP A 28 5.981 8.949 9.003 1.00 0.00 O ATOM 0 H ASP A 28 3.961 6.125 5.365 1.00 0.00 H new ATOM 0 HA ASP A 28 2.818 7.706 7.593 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.563 7.218 6.727 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.182 8.927 6.646 1.00 0.00 H new ATOM 406 N PRO A 29 2.387 9.752 6.113 1.00 0.00 N ATOM 407 CA PRO A 29 1.916 10.786 5.207 1.00 0.00 C ATOM 408 C PRO A 29 3.079 11.635 4.691 1.00 0.00 C ATOM 409 O PRO A 29 4.044 11.878 5.415 1.00 0.00 O ATOM 410 CB PRO A 29 0.908 11.587 6.014 1.00 0.00 C ATOM 411 CG PRO A 29 1.193 11.266 7.472 1.00 0.00 C ATOM 412 CD PRO A 29 2.098 10.045 7.513 1.00 0.00 C ATOM 0 HA PRO A 29 1.453 10.378 4.308 1.00 0.00 H new ATOM 0 HB2 PRO A 29 1.013 12.655 5.821 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -0.113 11.314 5.746 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.673 12.113 7.963 1.00 0.00 H new ATOM 0 HG3 PRO A 29 0.264 11.071 8.008 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.012 10.248 8.072 1.00 0.00 H new ATOM 0 HD3 PRO A 29 1.606 9.203 8.000 1.00 0.00 H new ATOM 420 N PRO A 30 2.947 12.074 3.411 1.00 0.00 N ATOM 421 CA PRO A 30 3.976 12.891 2.790 1.00 0.00 C ATOM 422 C PRO A 30 3.934 14.324 3.322 1.00 0.00 C ATOM 423 O PRO A 30 3.012 15.078 3.013 1.00 0.00 O ATOM 424 CB PRO A 30 3.701 12.803 1.297 1.00 0.00 C ATOM 425 CG PRO A 30 2.264 12.326 1.166 1.00 0.00 C ATOM 426 CD PRO A 30 1.820 11.805 2.523 1.00 0.00 C ATOM 0 HA PRO A 30 4.983 12.542 3.017 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.836 13.772 0.817 1.00 0.00 H new ATOM 0 HB3 PRO A 30 4.389 12.109 0.813 1.00 0.00 H new ATOM 0 HG2 PRO A 30 1.619 13.142 0.841 1.00 0.00 H new ATOM 0 HG3 PRO A 30 2.189 11.542 0.413 1.00 0.00 H new ATOM 0 HD2 PRO A 30 0.917 12.311 2.865 1.00 0.00 H new ATOM 0 HD3 PRO A 30 1.593 10.740 2.483 1.00 0.00 H new ATOM 434 N GLU A 31 4.942 14.658 4.114 1.00 0.00 N ATOM 435 CA GLU A 31 5.032 15.988 4.693 1.00 0.00 C ATOM 436 C GLU A 31 4.973 17.050 3.593 1.00 0.00 C ATOM 437 O GLU A 31 4.436 18.137 3.803 1.00 0.00 O ATOM 438 CB GLU A 31 6.302 16.137 5.531 1.00 0.00 C ATOM 439 CG GLU A 31 6.434 17.559 6.079 1.00 0.00 C ATOM 440 CD GLU A 31 6.151 17.596 7.582 1.00 0.00 C ATOM 441 OE1 GLU A 31 6.871 16.883 8.314 1.00 0.00 O ATOM 442 OE2 GLU A 31 5.220 18.337 7.966 1.00 0.00 O ATOM 0 H GLU A 31 5.704 14.030 4.369 1.00 0.00 H new ATOM 0 HA GLU A 31 4.180 16.132 5.357 1.00 0.00 H new ATOM 0 HB2 GLU A 31 6.283 15.426 6.357 1.00 0.00 H new ATOM 0 HB3 GLU A 31 7.174 15.896 4.923 1.00 0.00 H new ATOM 0 HG2 GLU A 31 7.438 17.935 5.885 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.740 18.219 5.558 1.00 0.00 H new ATOM 449 N LEU A 32 5.532 16.699 2.444 1.00 0.00 N ATOM 450 CA LEU A 32 5.550 17.608 1.312 1.00 0.00 C ATOM 451 C LEU A 32 4.314 17.360 0.445 1.00 0.00 C ATOM 452 O LEU A 32 4.176 16.296 -0.156 1.00 0.00 O ATOM 453 CB LEU A 32 6.871 17.488 0.549 1.00 0.00 C ATOM 454 CG LEU A 32 7.978 18.458 0.966 1.00 0.00 C ATOM 455 CD1 LEU A 32 9.114 18.467 -0.058 1.00 0.00 C ATOM 456 CD2 LEU A 32 7.415 19.860 1.210 1.00 0.00 C ATOM 0 H LEU A 32 5.976 15.797 2.273 1.00 0.00 H new ATOM 0 HA LEU A 32 5.499 18.642 1.653 1.00 0.00 H new ATOM 0 HB2 LEU A 32 7.244 16.471 0.666 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.669 17.633 -0.512 1.00 0.00 H new ATOM 0 HG LEU A 32 8.399 18.111 1.910 1.00 0.00 H new ATOM 0 HD11 LEU A 32 9.887 19.165 0.263 1.00 0.00 H new ATOM 0 HD12 LEU A 32 9.539 17.466 -0.139 1.00 0.00 H new ATOM 0 HD13 LEU A 32 8.726 18.776 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.222 20.530 1.505 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.952 20.230 0.295 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.669 19.819 2.004 1.00 0.00 H new ATOM 468 N VAL A 33 3.446 18.361 0.407 1.00 0.00 N ATOM 469 CA VAL A 33 2.227 18.265 -0.376 1.00 0.00 C ATOM 470 C VAL A 33 2.020 19.568 -1.152 1.00 0.00 C ATOM 471 O VAL A 33 2.319 20.649 -0.647 1.00 0.00 O ATOM 472 CB VAL A 33 1.046 17.917 0.533 1.00 0.00 C ATOM 473 CG1 VAL A 33 -0.059 17.206 -0.251 1.00 0.00 C ATOM 474 CG2 VAL A 33 1.503 17.073 1.725 1.00 0.00 C ATOM 0 H VAL A 33 3.564 19.243 0.906 1.00 0.00 H new ATOM 0 HA VAL A 33 2.306 17.460 -1.107 1.00 0.00 H new ATOM 0 HB VAL A 33 0.635 18.849 0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -0.886 16.970 0.419 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -0.414 17.856 -1.051 1.00 0.00 H new ATOM 0 HG13 VAL A 33 0.335 16.285 -0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 33 0.645 16.839 2.355 1.00 0.00 H new ATOM 0 HG22 VAL A 33 1.952 16.147 1.365 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.238 17.631 2.305 1.00 0.00 H new ATOM 484 N PRO A 34 1.496 19.418 -2.398 1.00 0.00 N ATOM 485 CA PRO A 34 1.245 20.570 -3.248 1.00 0.00 C ATOM 486 C PRO A 34 0.006 21.336 -2.781 1.00 0.00 C ATOM 487 O PRO A 34 -0.247 22.450 -3.238 1.00 0.00 O ATOM 488 CB PRO A 34 1.098 20.000 -4.649 1.00 0.00 C ATOM 489 CG PRO A 34 0.809 18.518 -4.468 1.00 0.00 C ATOM 490 CD PRO A 34 1.129 18.153 -3.028 1.00 0.00 C ATOM 0 HA PRO A 34 2.051 21.303 -3.213 1.00 0.00 H new ATOM 0 HB2 PRO A 34 0.289 20.493 -5.188 1.00 0.00 H new ATOM 0 HB3 PRO A 34 2.007 20.152 -5.230 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -0.235 18.303 -4.693 1.00 0.00 H new ATOM 0 HG3 PRO A 34 1.412 17.925 -5.155 1.00 0.00 H new ATOM 0 HD2 PRO A 34 0.270 17.699 -2.534 1.00 0.00 H new ATOM 0 HD3 PRO A 34 1.945 17.432 -2.974 1.00 0.00 H new ATOM 498 N LYS A 35 -0.733 20.710 -1.877 1.00 0.00 N ATOM 499 CA LYS A 35 -1.939 21.319 -1.344 1.00 0.00 C ATOM 500 C LYS A 35 -2.729 20.272 -0.557 1.00 0.00 C ATOM 501 O LYS A 35 -2.582 20.163 0.659 1.00 0.00 O ATOM 502 CB LYS A 35 -2.744 21.984 -2.463 1.00 0.00 C ATOM 503 CG LYS A 35 -2.739 23.506 -2.312 1.00 0.00 C ATOM 504 CD LYS A 35 -3.670 24.161 -3.334 1.00 0.00 C ATOM 505 CE LYS A 35 -2.892 24.626 -4.567 1.00 0.00 C ATOM 506 NZ LYS A 35 -3.821 25.075 -5.628 1.00 0.00 N ATOM 0 H LYS A 35 -0.519 19.787 -1.500 1.00 0.00 H new ATOM 0 HA LYS A 35 -1.686 22.118 -0.647 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -2.324 21.710 -3.431 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -3.770 21.617 -2.445 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -3.052 23.776 -1.304 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -1.725 23.885 -2.443 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -4.443 23.453 -3.633 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -4.176 25.011 -2.877 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -2.221 25.441 -4.295 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -2.271 23.812 -4.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -3.276 25.387 -6.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -4.444 24.288 -5.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -4.396 25.866 -5.274 1.00 0.00 H new ATOM 520 N ARG A 36 -3.551 19.528 -1.283 1.00 0.00 N ATOM 521 CA ARG A 36 -4.365 18.493 -0.668 1.00 0.00 C ATOM 522 C ARG A 36 -4.094 17.141 -1.331 1.00 0.00 C ATOM 523 O ARG A 36 -3.650 17.085 -2.477 1.00 0.00 O ATOM 524 CB ARG A 36 -5.854 18.822 -0.785 1.00 0.00 C ATOM 525 CG ARG A 36 -6.288 18.886 -2.251 1.00 0.00 C ATOM 526 CD ARG A 36 -7.800 18.694 -2.384 1.00 0.00 C ATOM 527 NE ARG A 36 -8.405 19.875 -3.039 1.00 0.00 N ATOM 528 CZ ARG A 36 -9.708 20.182 -2.981 1.00 0.00 C ATOM 529 NH1 ARG A 36 -10.551 19.395 -2.299 1.00 0.00 N ATOM 530 NH2 ARG A 36 -10.168 21.274 -3.607 1.00 0.00 N ATOM 0 H ARG A 36 -3.671 19.621 -2.292 1.00 0.00 H new ATOM 0 HA ARG A 36 -4.098 18.444 0.388 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -6.439 18.066 -0.261 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.058 19.776 -0.300 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -6.001 19.847 -2.677 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -5.768 18.116 -2.822 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -8.011 17.797 -2.966 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -8.244 18.547 -1.400 1.00 0.00 H new ATOM 0 HE ARG A 36 -7.791 20.495 -3.568 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -10.201 18.563 -1.824 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -11.543 19.628 -2.254 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -9.526 21.872 -4.128 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -11.160 21.507 -3.563 1.00 0.00 H new ATOM 544 N LEU A 37 -4.373 16.084 -0.582 1.00 0.00 N ATOM 545 CA LEU A 37 -4.165 14.736 -1.083 1.00 0.00 C ATOM 546 C LEU A 37 -5.450 14.241 -1.750 1.00 0.00 C ATOM 547 O LEU A 37 -6.539 14.392 -1.198 1.00 0.00 O ATOM 548 CB LEU A 37 -3.661 13.821 0.035 1.00 0.00 C ATOM 549 CG LEU A 37 -2.411 12.999 -0.284 1.00 0.00 C ATOM 550 CD1 LEU A 37 -1.270 13.341 0.677 1.00 0.00 C ATOM 551 CD2 LEU A 37 -2.725 11.502 -0.290 1.00 0.00 C ATOM 0 H LEU A 37 -4.741 16.134 0.368 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.386 14.729 -1.845 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.455 14.433 0.913 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.464 13.135 0.306 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.077 13.262 -1.288 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.393 12.743 0.428 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -1.024 14.399 0.588 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.579 13.125 1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.819 10.941 -0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.098 11.204 0.690 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.483 11.292 -1.045 1.00 0.00 H new ATOM 563 N ASP A 38 -5.280 13.661 -2.929 1.00 0.00 N ATOM 564 CA ASP A 38 -6.413 13.143 -3.678 1.00 0.00 C ATOM 565 C ASP A 38 -6.619 11.668 -3.327 1.00 0.00 C ATOM 566 O ASP A 38 -7.721 11.140 -3.470 1.00 0.00 O ATOM 567 CB ASP A 38 -6.167 13.240 -5.185 1.00 0.00 C ATOM 568 CG ASP A 38 -7.404 13.013 -6.057 1.00 0.00 C ATOM 569 OD1 ASP A 38 -8.068 11.976 -5.841 1.00 0.00 O ATOM 570 OD2 ASP A 38 -7.656 13.881 -6.921 1.00 0.00 O ATOM 0 H ASP A 38 -4.375 13.538 -3.384 1.00 0.00 H new ATOM 0 HA ASP A 38 -7.290 13.735 -3.416 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -5.759 14.226 -5.409 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -5.407 12.510 -5.462 1.00 0.00 H new ATOM 575 N GLY A 39 -5.541 11.044 -2.874 1.00 0.00 N ATOM 576 CA GLY A 39 -5.591 9.640 -2.502 1.00 0.00 C ATOM 577 C GLY A 39 -4.313 8.915 -2.927 1.00 0.00 C ATOM 578 O GLY A 39 -3.530 9.441 -3.717 1.00 0.00 O ATOM 0 H GLY A 39 -4.629 11.485 -2.756 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -5.723 9.550 -1.424 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.455 9.167 -2.969 1.00 0.00 H new ATOM 582 N TYR A 40 -4.141 7.718 -2.385 1.00 0.00 N ATOM 583 CA TYR A 40 -2.971 6.915 -2.699 1.00 0.00 C ATOM 584 C TYR A 40 -3.345 5.725 -3.584 1.00 0.00 C ATOM 585 O TYR A 40 -4.519 5.516 -3.888 1.00 0.00 O ATOM 586 CB TYR A 40 -2.445 6.395 -1.360 1.00 0.00 C ATOM 587 CG TYR A 40 -2.028 7.497 -0.384 1.00 0.00 C ATOM 588 CD1 TYR A 40 -2.959 8.051 0.471 1.00 0.00 C ATOM 589 CD2 TYR A 40 -0.720 7.938 -0.360 1.00 0.00 C ATOM 590 CE1 TYR A 40 -2.566 9.088 1.389 1.00 0.00 C ATOM 591 CE2 TYR A 40 -0.327 8.976 0.558 1.00 0.00 C ATOM 592 CZ TYR A 40 -1.270 9.500 1.387 1.00 0.00 C ATOM 593 OH TYR A 40 -0.899 10.479 2.254 1.00 0.00 O ATOM 0 H TYR A 40 -4.792 7.285 -1.730 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.231 7.508 -3.237 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -3.215 5.782 -0.892 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -1.590 5.745 -1.545 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -3.982 7.707 0.451 1.00 0.00 H new ATOM 0 HD2 TYR A 40 0.008 7.505 -1.029 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -3.284 9.529 2.064 1.00 0.00 H new ATOM 0 HE2 TYR A 40 0.693 9.330 0.588 1.00 0.00 H new ATOM 0 HH TYR A 40 -0.459 10.077 3.032 1.00 0.00 H new ATOM 603 N VAL A 41 -2.325 4.974 -3.973 1.00 0.00 N ATOM 604 CA VAL A 41 -2.531 3.810 -4.818 1.00 0.00 C ATOM 605 C VAL A 41 -1.774 2.618 -4.229 1.00 0.00 C ATOM 606 O VAL A 41 -0.551 2.542 -4.335 1.00 0.00 O ATOM 607 CB VAL A 41 -2.121 4.128 -6.257 1.00 0.00 C ATOM 608 CG1 VAL A 41 -2.164 2.872 -7.129 1.00 0.00 C ATOM 609 CG2 VAL A 41 -2.997 5.235 -6.846 1.00 0.00 C ATOM 0 H VAL A 41 -1.353 5.149 -3.718 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.587 3.542 -4.848 1.00 0.00 H new ATOM 0 HB VAL A 41 -1.093 4.489 -6.240 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -1.868 3.126 -8.147 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -1.478 2.126 -6.727 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -3.176 2.468 -7.135 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.684 5.441 -7.870 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.039 4.915 -6.843 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.893 6.139 -6.246 1.00 0.00 H new ATOM 619 N LEU A 42 -2.532 1.717 -3.622 1.00 0.00 N ATOM 620 CA LEU A 42 -1.948 0.532 -3.017 1.00 0.00 C ATOM 621 C LEU A 42 -1.796 -0.556 -4.081 1.00 0.00 C ATOM 622 O LEU A 42 -2.788 -1.057 -4.608 1.00 0.00 O ATOM 623 CB LEU A 42 -2.766 0.093 -1.801 1.00 0.00 C ATOM 624 CG LEU A 42 -2.133 -0.986 -0.921 1.00 0.00 C ATOM 625 CD1 LEU A 42 -2.696 -2.368 -1.257 1.00 0.00 C ATOM 626 CD2 LEU A 42 -0.606 -0.950 -1.021 1.00 0.00 C ATOM 0 H LEU A 42 -3.546 1.784 -3.536 1.00 0.00 H new ATOM 0 HA LEU A 42 -0.949 0.750 -2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.961 0.970 -1.183 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -3.732 -0.272 -2.150 1.00 0.00 H new ATOM 0 HG LEU A 42 -2.393 -0.776 0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.229 -3.117 -0.617 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.774 -2.372 -1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.487 -2.602 -2.301 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.181 -1.727 -0.386 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -0.305 -1.121 -2.054 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.243 0.024 -0.694 1.00 0.00 H new ATOM 638 N GLU A 43 -0.545 -0.891 -4.365 1.00 0.00 N ATOM 639 CA GLU A 43 -0.250 -1.911 -5.357 1.00 0.00 C ATOM 640 C GLU A 43 0.567 -3.042 -4.728 1.00 0.00 C ATOM 641 O GLU A 43 1.653 -2.808 -4.201 1.00 0.00 O ATOM 642 CB GLU A 43 0.479 -1.311 -6.560 1.00 0.00 C ATOM 643 CG GLU A 43 -0.409 -1.331 -7.806 1.00 0.00 C ATOM 644 CD GLU A 43 -1.247 -0.055 -7.903 1.00 0.00 C ATOM 645 OE1 GLU A 43 -2.313 -0.025 -7.251 1.00 0.00 O ATOM 646 OE2 GLU A 43 -0.803 0.862 -8.626 1.00 0.00 O ATOM 0 H GLU A 43 0.275 -0.474 -3.925 1.00 0.00 H new ATOM 0 HA GLU A 43 -1.192 -2.326 -5.715 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.775 -0.286 -6.336 1.00 0.00 H new ATOM 0 HB3 GLU A 43 1.394 -1.872 -6.752 1.00 0.00 H new ATOM 0 HG2 GLU A 43 0.211 -1.432 -8.697 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -1.066 -2.200 -7.775 1.00 0.00 H new ATOM 653 N GLY A 44 0.012 -4.242 -4.805 1.00 0.00 N ATOM 654 CA GLY A 44 0.676 -5.410 -4.250 1.00 0.00 C ATOM 655 C GLY A 44 0.894 -6.478 -5.323 1.00 0.00 C ATOM 656 O GLY A 44 0.484 -6.304 -6.470 1.00 0.00 O ATOM 0 H GLY A 44 -0.890 -4.431 -5.243 1.00 0.00 H new ATOM 0 HA2 GLY A 44 1.635 -5.118 -3.822 1.00 0.00 H new ATOM 0 HA3 GLY A 44 0.077 -5.822 -3.438 1.00 0.00 H new ATOM 660 N ARG A 45 1.539 -7.561 -4.913 1.00 0.00 N ATOM 661 CA ARG A 45 1.816 -8.657 -5.825 1.00 0.00 C ATOM 662 C ARG A 45 2.537 -9.789 -5.090 1.00 0.00 C ATOM 663 O ARG A 45 3.292 -9.543 -4.151 1.00 0.00 O ATOM 664 CB ARG A 45 2.678 -8.192 -7.001 1.00 0.00 C ATOM 665 CG ARG A 45 4.034 -7.674 -6.515 1.00 0.00 C ATOM 666 CD ARG A 45 5.064 -7.692 -7.646 1.00 0.00 C ATOM 667 NE ARG A 45 6.416 -7.428 -7.104 1.00 0.00 N ATOM 668 CZ ARG A 45 7.513 -7.286 -7.859 1.00 0.00 C ATOM 669 NH1 ARG A 45 7.427 -7.383 -9.193 1.00 0.00 N ATOM 670 NH2 ARG A 45 8.699 -7.048 -7.281 1.00 0.00 N ATOM 0 H ARG A 45 1.877 -7.702 -3.961 1.00 0.00 H new ATOM 0 HA ARG A 45 0.862 -9.017 -6.209 1.00 0.00 H new ATOM 0 HB2 ARG A 45 2.828 -9.018 -7.696 1.00 0.00 H new ATOM 0 HB3 ARG A 45 2.159 -7.405 -7.549 1.00 0.00 H new ATOM 0 HG2 ARG A 45 3.924 -6.659 -6.134 1.00 0.00 H new ATOM 0 HG3 ARG A 45 4.387 -8.289 -5.687 1.00 0.00 H new ATOM 0 HD2 ARG A 45 5.047 -8.659 -8.149 1.00 0.00 H new ATOM 0 HD3 ARG A 45 4.809 -6.940 -8.393 1.00 0.00 H new ATOM 0 HE ARG A 45 6.518 -7.349 -6.092 1.00 0.00 H new ATOM 0 HH11 ARG A 45 6.525 -7.565 -9.634 1.00 0.00 H new ATOM 0 HH12 ARG A 45 8.263 -7.275 -9.767 1.00 0.00 H new ATOM 0 HH21 ARG A 45 8.766 -6.975 -6.266 1.00 0.00 H new ATOM 0 HH22 ARG A 45 9.534 -6.940 -7.856 1.00 0.00 H new ATOM 684 N GLN A 46 2.278 -11.006 -5.546 1.00 0.00 N ATOM 685 CA GLN A 46 2.893 -12.177 -4.943 1.00 0.00 C ATOM 686 C GLN A 46 3.798 -12.882 -5.955 1.00 0.00 C ATOM 687 O GLN A 46 3.678 -12.662 -7.160 1.00 0.00 O ATOM 688 CB GLN A 46 1.831 -13.135 -4.398 1.00 0.00 C ATOM 689 CG GLN A 46 1.397 -14.139 -5.468 1.00 0.00 C ATOM 690 CD GLN A 46 0.264 -15.031 -4.956 1.00 0.00 C ATOM 691 OE1 GLN A 46 0.234 -15.443 -3.808 1.00 0.00 O ATOM 692 NE2 GLN A 46 -0.663 -15.305 -5.869 1.00 0.00 N ATOM 0 H GLN A 46 1.651 -11.207 -6.325 1.00 0.00 H new ATOM 0 HA GLN A 46 3.506 -11.849 -4.103 1.00 0.00 H new ATOM 0 HB2 GLN A 46 2.226 -13.668 -3.533 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.966 -12.567 -4.055 1.00 0.00 H new ATOM 0 HG2 GLN A 46 1.070 -13.606 -6.361 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.247 -14.756 -5.759 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -0.577 -14.927 -6.813 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -1.460 -15.893 -5.626 1.00 0.00 H new ATOM 701 N GLY A 47 4.685 -13.714 -5.430 1.00 0.00 N ATOM 702 CA GLY A 47 5.610 -14.452 -6.272 1.00 0.00 C ATOM 703 C GLY A 47 6.227 -13.542 -7.337 1.00 0.00 C ATOM 704 O GLY A 47 6.636 -14.011 -8.398 1.00 0.00 O ATOM 0 H GLY A 47 4.783 -13.893 -4.431 1.00 0.00 H new ATOM 0 HA2 GLY A 47 6.399 -14.886 -5.658 1.00 0.00 H new ATOM 0 HA3 GLY A 47 5.089 -15.279 -6.753 1.00 0.00 H new ATOM 708 N SER A 48 6.274 -12.257 -7.017 1.00 0.00 N ATOM 709 CA SER A 48 6.833 -11.278 -7.933 1.00 0.00 C ATOM 710 C SER A 48 6.012 -11.239 -9.223 1.00 0.00 C ATOM 711 O SER A 48 6.568 -11.107 -10.312 1.00 0.00 O ATOM 712 CB SER A 48 8.298 -11.590 -8.245 1.00 0.00 C ATOM 713 OG SER A 48 9.136 -10.451 -8.066 1.00 0.00 O ATOM 0 H SER A 48 5.934 -11.871 -6.136 1.00 0.00 H new ATOM 0 HA SER A 48 6.792 -10.299 -7.455 1.00 0.00 H new ATOM 0 HB2 SER A 48 8.642 -12.398 -7.600 1.00 0.00 H new ATOM 0 HB3 SER A 48 8.382 -11.944 -9.272 1.00 0.00 H new ATOM 0 HG SER A 48 10.063 -10.691 -8.273 1.00 0.00 H new ATOM 719 N GLN A 49 4.703 -11.357 -9.058 1.00 0.00 N ATOM 720 CA GLN A 49 3.800 -11.337 -10.196 1.00 0.00 C ATOM 721 C GLN A 49 3.531 -9.896 -10.635 1.00 0.00 C ATOM 722 O GLN A 49 4.147 -8.962 -10.123 1.00 0.00 O ATOM 723 CB GLN A 49 2.494 -12.065 -9.872 1.00 0.00 C ATOM 724 CG GLN A 49 2.576 -13.540 -10.267 1.00 0.00 C ATOM 725 CD GLN A 49 1.543 -13.878 -11.344 1.00 0.00 C ATOM 726 OE1 GLN A 49 0.505 -14.465 -11.084 1.00 0.00 O ATOM 727 NE2 GLN A 49 1.883 -13.476 -12.565 1.00 0.00 N ATOM 0 H GLN A 49 4.246 -11.467 -8.153 1.00 0.00 H new ATOM 0 HA GLN A 49 4.276 -11.865 -11.022 1.00 0.00 H new ATOM 0 HB2 GLN A 49 2.282 -11.982 -8.806 1.00 0.00 H new ATOM 0 HB3 GLN A 49 1.668 -11.589 -10.400 1.00 0.00 H new ATOM 0 HG2 GLN A 49 3.577 -13.767 -10.634 1.00 0.00 H new ATOM 0 HG3 GLN A 49 2.409 -14.165 -9.390 1.00 0.00 H new ATOM 0 HE21 GLN A 49 2.767 -12.989 -12.714 1.00 0.00 H new ATOM 0 HE22 GLN A 49 1.260 -13.654 -13.353 1.00 0.00 H new ATOM 736 N GLY A 50 2.611 -9.761 -11.578 1.00 0.00 N ATOM 737 CA GLY A 50 2.253 -8.450 -12.092 1.00 0.00 C ATOM 738 C GLY A 50 1.593 -7.597 -11.006 1.00 0.00 C ATOM 739 O GLY A 50 0.633 -8.030 -10.370 1.00 0.00 O ATOM 0 H GLY A 50 2.102 -10.538 -12.000 1.00 0.00 H new ATOM 0 HA2 GLY A 50 3.145 -7.945 -12.464 1.00 0.00 H new ATOM 0 HA3 GLY A 50 1.573 -8.560 -12.937 1.00 0.00 H new ATOM 743 N TRP A 51 2.133 -6.401 -10.828 1.00 0.00 N ATOM 744 CA TRP A 51 1.609 -5.484 -9.830 1.00 0.00 C ATOM 745 C TRP A 51 0.100 -5.358 -10.051 1.00 0.00 C ATOM 746 O TRP A 51 -0.340 -4.831 -11.072 1.00 0.00 O ATOM 747 CB TRP A 51 2.335 -4.139 -9.886 1.00 0.00 C ATOM 748 CG TRP A 51 3.737 -4.162 -9.273 1.00 0.00 C ATOM 749 CD1 TRP A 51 4.916 -4.163 -9.909 1.00 0.00 C ATOM 750 CD2 TRP A 51 4.059 -4.188 -7.866 1.00 0.00 C ATOM 751 NE1 TRP A 51 5.971 -4.188 -9.019 1.00 0.00 N ATOM 752 CE2 TRP A 51 5.433 -4.203 -7.738 1.00 0.00 C ATOM 753 CE3 TRP A 51 3.218 -4.198 -6.740 1.00 0.00 C ATOM 754 CZ2 TRP A 51 6.087 -4.229 -6.500 1.00 0.00 C ATOM 755 CZ3 TRP A 51 3.886 -4.224 -5.510 1.00 0.00 C ATOM 756 CH2 TRP A 51 5.269 -4.240 -5.364 1.00 0.00 C ATOM 0 H TRP A 51 2.928 -6.045 -11.358 1.00 0.00 H new ATOM 0 HA TRP A 51 1.784 -5.867 -8.825 1.00 0.00 H new ATOM 0 HB2 TRP A 51 2.410 -3.821 -10.926 1.00 0.00 H new ATOM 0 HB3 TRP A 51 1.735 -3.392 -9.367 1.00 0.00 H new ATOM 0 HD1 TRP A 51 5.027 -4.146 -10.983 1.00 0.00 H new ATOM 0 HE1 TRP A 51 6.963 -4.194 -9.258 1.00 0.00 H new ATOM 0 HE3 TRP A 51 2.141 -4.187 -6.818 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 7.164 -4.240 -6.426 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 3.286 -4.232 -4.612 1.00 0.00 H new ATOM 0 HH2 TRP A 51 5.710 -4.261 -4.378 1.00 0.00 H new ATOM 767 N GLU A 52 -0.651 -5.851 -9.077 1.00 0.00 N ATOM 768 CA GLU A 52 -2.102 -5.800 -9.152 1.00 0.00 C ATOM 769 C GLU A 52 -2.639 -4.668 -8.274 1.00 0.00 C ATOM 770 O GLU A 52 -2.443 -4.674 -7.059 1.00 0.00 O ATOM 771 CB GLU A 52 -2.718 -7.143 -8.755 1.00 0.00 C ATOM 772 CG GLU A 52 -2.893 -7.239 -7.238 1.00 0.00 C ATOM 773 CD GLU A 52 -3.153 -8.683 -6.806 1.00 0.00 C ATOM 774 OE1 GLU A 52 -4.334 -9.089 -6.867 1.00 0.00 O ATOM 775 OE2 GLU A 52 -2.166 -9.349 -6.426 1.00 0.00 O ATOM 0 H GLU A 52 -0.282 -6.288 -8.232 1.00 0.00 H new ATOM 0 HA GLU A 52 -2.387 -5.598 -10.184 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -3.685 -7.263 -9.244 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -2.081 -7.956 -9.103 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.999 -6.862 -6.741 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -3.723 -6.607 -6.923 1.00 0.00 H new ATOM 782 N VAL A 53 -3.306 -3.725 -8.922 1.00 0.00 N ATOM 783 CA VAL A 53 -3.874 -2.589 -8.215 1.00 0.00 C ATOM 784 C VAL A 53 -4.868 -3.092 -7.167 1.00 0.00 C ATOM 785 O VAL A 53 -5.974 -3.510 -7.505 1.00 0.00 O ATOM 786 CB VAL A 53 -4.499 -1.612 -9.212 1.00 0.00 C ATOM 787 CG1 VAL A 53 -5.252 -0.495 -8.486 1.00 0.00 C ATOM 788 CG2 VAL A 53 -3.439 -1.036 -10.154 1.00 0.00 C ATOM 0 H VAL A 53 -3.466 -3.724 -9.929 1.00 0.00 H new ATOM 0 HA VAL A 53 -3.095 -2.039 -7.687 1.00 0.00 H new ATOM 0 HB VAL A 53 -5.219 -2.164 -9.816 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.687 0.186 -9.218 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -6.045 -0.928 -7.876 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -4.561 0.053 -7.846 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -3.910 -0.345 -10.853 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -2.685 -0.506 -9.572 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.966 -1.846 -10.709 1.00 0.00 H new ATOM 798 N LEU A 54 -4.439 -3.033 -5.915 1.00 0.00 N ATOM 799 CA LEU A 54 -5.278 -3.477 -4.815 1.00 0.00 C ATOM 800 C LEU A 54 -6.316 -2.397 -4.503 1.00 0.00 C ATOM 801 O LEU A 54 -7.513 -2.678 -4.451 1.00 0.00 O ATOM 802 CB LEU A 54 -4.419 -3.870 -3.611 1.00 0.00 C ATOM 803 CG LEU A 54 -3.355 -4.939 -3.866 1.00 0.00 C ATOM 804 CD1 LEU A 54 -2.400 -5.058 -2.677 1.00 0.00 C ATOM 805 CD2 LEU A 54 -3.999 -6.281 -4.220 1.00 0.00 C ATOM 0 H LEU A 54 -3.521 -2.684 -5.638 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.827 -4.377 -5.093 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -3.923 -2.975 -3.236 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.079 -4.224 -2.819 1.00 0.00 H new ATOM 0 HG LEU A 54 -2.761 -4.630 -4.726 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -1.654 -5.825 -2.885 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.902 -4.102 -2.513 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -2.963 -5.332 -1.784 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.220 -7.023 -4.396 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -4.633 -6.609 -3.396 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.603 -6.168 -5.120 1.00 0.00 H new ATOM 817 N ASP A 55 -5.821 -1.185 -4.304 1.00 0.00 N ATOM 818 CA ASP A 55 -6.691 -0.062 -3.999 1.00 0.00 C ATOM 819 C ASP A 55 -6.158 1.194 -4.692 1.00 0.00 C ATOM 820 O ASP A 55 -5.166 1.775 -4.256 1.00 0.00 O ATOM 821 CB ASP A 55 -6.731 0.211 -2.494 1.00 0.00 C ATOM 822 CG ASP A 55 -8.132 0.385 -1.906 1.00 0.00 C ATOM 823 OD1 ASP A 55 -8.709 1.472 -2.126 1.00 0.00 O ATOM 824 OD2 ASP A 55 -8.595 -0.572 -1.249 1.00 0.00 O ATOM 0 H ASP A 55 -4.828 -0.956 -4.348 1.00 0.00 H new ATOM 0 HA ASP A 55 -7.694 -0.308 -4.348 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -6.236 -0.611 -1.977 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -6.152 1.111 -2.288 1.00 0.00 H new ATOM 829 N PRO A 56 -6.859 1.585 -5.790 1.00 0.00 N ATOM 830 CA PRO A 56 -6.467 2.761 -6.548 1.00 0.00 C ATOM 831 C PRO A 56 -6.846 4.044 -5.806 1.00 0.00 C ATOM 832 O PRO A 56 -6.116 5.032 -5.854 1.00 0.00 O ATOM 833 CB PRO A 56 -7.173 2.619 -7.887 1.00 0.00 C ATOM 834 CG PRO A 56 -8.294 1.617 -7.663 1.00 0.00 C ATOM 835 CD PRO A 56 -8.039 0.921 -6.336 1.00 0.00 C ATOM 0 HA PRO A 56 -5.388 2.831 -6.686 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -7.568 3.578 -8.224 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -6.485 2.269 -8.656 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -9.260 2.122 -7.650 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -8.325 0.891 -8.475 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -8.894 1.019 -5.667 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -7.864 -0.146 -6.476 1.00 0.00 H new ATOM 843 N ALA A 57 -7.988 3.986 -5.136 1.00 0.00 N ATOM 844 CA ALA A 57 -8.473 5.131 -4.384 1.00 0.00 C ATOM 845 C ALA A 57 -8.373 4.833 -2.887 1.00 0.00 C ATOM 846 O ALA A 57 -9.144 4.033 -2.357 1.00 0.00 O ATOM 847 CB ALA A 57 -9.903 5.460 -4.819 1.00 0.00 C ATOM 0 H ALA A 57 -8.591 3.164 -5.098 1.00 0.00 H new ATOM 0 HA ALA A 57 -7.861 6.010 -4.586 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -10.266 6.319 -4.255 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -9.915 5.694 -5.884 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -10.548 4.602 -4.629 1.00 0.00 H new ATOM 853 N VAL A 58 -7.417 5.490 -2.247 1.00 0.00 N ATOM 854 CA VAL A 58 -7.207 5.305 -0.822 1.00 0.00 C ATOM 855 C VAL A 58 -7.241 6.667 -0.124 1.00 0.00 C ATOM 856 O VAL A 58 -6.568 7.604 -0.552 1.00 0.00 O ATOM 857 CB VAL A 58 -5.903 4.542 -0.580 1.00 0.00 C ATOM 858 CG1 VAL A 58 -5.406 4.746 0.852 1.00 0.00 C ATOM 859 CG2 VAL A 58 -6.072 3.054 -0.895 1.00 0.00 C ATOM 0 H VAL A 58 -6.779 6.151 -2.690 1.00 0.00 H new ATOM 0 HA VAL A 58 -8.006 4.700 -0.394 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.149 4.944 -1.257 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.478 4.193 0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.228 5.807 1.028 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -6.158 4.384 1.553 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -5.131 2.535 -0.715 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.847 2.632 -0.255 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.358 2.934 -1.940 1.00 0.00 H new ATOM 869 N ALA A 59 -8.030 6.733 0.937 1.00 0.00 N ATOM 870 CA ALA A 59 -8.160 7.964 1.698 1.00 0.00 C ATOM 871 C ALA A 59 -6.820 8.702 1.699 1.00 0.00 C ATOM 872 O ALA A 59 -5.807 8.156 2.135 1.00 0.00 O ATOM 873 CB ALA A 59 -8.650 7.642 3.111 1.00 0.00 C ATOM 0 H ALA A 59 -8.586 5.954 1.288 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.898 8.622 1.240 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -8.747 8.566 3.682 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -9.619 7.146 3.056 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -7.933 6.985 3.604 1.00 0.00 H new ATOM 879 N GLY A 60 -6.857 9.931 1.206 1.00 0.00 N ATOM 880 CA GLY A 60 -5.658 10.749 1.145 1.00 0.00 C ATOM 881 C GLY A 60 -5.178 11.125 2.548 1.00 0.00 C ATOM 882 O GLY A 60 -4.081 11.656 2.712 1.00 0.00 O ATOM 0 H GLY A 60 -7.699 10.380 0.845 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -4.871 10.208 0.620 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -5.860 11.654 0.571 1.00 0.00 H new ATOM 886 N THR A 61 -6.025 10.835 3.526 1.00 0.00 N ATOM 887 CA THR A 61 -5.701 11.137 4.910 1.00 0.00 C ATOM 888 C THR A 61 -5.438 9.846 5.689 1.00 0.00 C ATOM 889 O THR A 61 -4.989 9.888 6.833 1.00 0.00 O ATOM 890 CB THR A 61 -6.841 11.975 5.490 1.00 0.00 C ATOM 891 OG1 THR A 61 -7.995 11.155 5.324 1.00 0.00 O ATOM 892 CG2 THR A 61 -7.142 13.217 4.649 1.00 0.00 C ATOM 0 H THR A 61 -6.934 10.394 3.387 1.00 0.00 H new ATOM 0 HA THR A 61 -4.782 11.718 4.984 1.00 0.00 H new ATOM 0 HB THR A 61 -6.588 12.278 6.506 1.00 0.00 H new ATOM 0 HG1 THR A 61 -8.781 11.622 5.676 1.00 0.00 H new ATOM 0 HG21 THR A 61 -7.959 13.776 5.105 1.00 0.00 H new ATOM 0 HG22 THR A 61 -6.254 13.847 4.600 1.00 0.00 H new ATOM 0 HG23 THR A 61 -7.428 12.914 3.642 1.00 0.00 H new ATOM 900 N GLU A 62 -5.730 8.730 5.038 1.00 0.00 N ATOM 901 CA GLU A 62 -5.531 7.430 5.655 1.00 0.00 C ATOM 902 C GLU A 62 -4.041 7.183 5.904 1.00 0.00 C ATOM 903 O GLU A 62 -3.191 7.805 5.269 1.00 0.00 O ATOM 904 CB GLU A 62 -6.134 6.317 4.796 1.00 0.00 C ATOM 905 CG GLU A 62 -7.509 5.901 5.324 1.00 0.00 C ATOM 906 CD GLU A 62 -7.375 4.934 6.502 1.00 0.00 C ATOM 907 OE1 GLU A 62 -6.877 5.387 7.555 1.00 0.00 O ATOM 908 OE2 GLU A 62 -7.773 3.763 6.322 1.00 0.00 O ATOM 0 H GLU A 62 -6.103 8.699 4.089 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.047 7.423 6.615 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.224 6.657 3.764 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -5.467 5.455 4.790 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.065 6.785 5.636 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.082 5.430 4.525 1.00 0.00 H new ATOM 915 N THR A 63 -3.771 6.274 6.830 1.00 0.00 N ATOM 916 CA THR A 63 -2.400 5.938 7.171 1.00 0.00 C ATOM 917 C THR A 63 -2.234 4.421 7.282 1.00 0.00 C ATOM 918 O THR A 63 -1.182 3.936 7.697 1.00 0.00 O ATOM 919 CB THR A 63 -2.035 6.685 8.456 1.00 0.00 C ATOM 920 OG1 THR A 63 -3.266 6.771 9.168 1.00 0.00 O ATOM 921 CG2 THR A 63 -1.651 8.143 8.197 1.00 0.00 C ATOM 0 H THR A 63 -4.479 5.760 7.354 1.00 0.00 H new ATOM 0 HA THR A 63 -1.710 6.252 6.388 1.00 0.00 H new ATOM 0 HB THR A 63 -1.208 6.175 8.950 1.00 0.00 H new ATOM 0 HG1 THR A 63 -3.732 5.910 9.120 1.00 0.00 H new ATOM 0 HG21 THR A 63 -1.401 8.627 9.141 1.00 0.00 H new ATOM 0 HG22 THR A 63 -0.789 8.179 7.531 1.00 0.00 H new ATOM 0 HG23 THR A 63 -2.489 8.663 7.733 1.00 0.00 H new ATOM 929 N GLU A 64 -3.289 3.714 6.904 1.00 0.00 N ATOM 930 CA GLU A 64 -3.274 2.262 6.956 1.00 0.00 C ATOM 931 C GLU A 64 -4.219 1.683 5.901 1.00 0.00 C ATOM 932 O GLU A 64 -5.011 2.412 5.305 1.00 0.00 O ATOM 933 CB GLU A 64 -3.639 1.759 8.354 1.00 0.00 C ATOM 934 CG GLU A 64 -2.650 2.280 9.399 1.00 0.00 C ATOM 935 CD GLU A 64 -3.003 3.706 9.826 1.00 0.00 C ATOM 936 OE1 GLU A 64 -3.980 4.242 9.260 1.00 0.00 O ATOM 937 OE2 GLU A 64 -2.288 4.228 10.708 1.00 0.00 O ATOM 0 H GLU A 64 -4.160 4.120 6.561 1.00 0.00 H new ATOM 0 HA GLU A 64 -2.262 1.921 6.736 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -4.648 2.083 8.609 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -3.643 0.669 8.363 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -2.656 1.624 10.269 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -1.640 2.259 8.991 1.00 0.00 H new ATOM 944 N LEU A 65 -4.106 0.378 5.703 1.00 0.00 N ATOM 945 CA LEU A 65 -4.941 -0.307 4.731 1.00 0.00 C ATOM 946 C LEU A 65 -4.827 -1.818 4.942 1.00 0.00 C ATOM 947 O LEU A 65 -3.761 -2.321 5.292 1.00 0.00 O ATOM 948 CB LEU A 65 -4.590 0.144 3.312 1.00 0.00 C ATOM 949 CG LEU A 65 -5.753 0.198 2.319 1.00 0.00 C ATOM 950 CD1 LEU A 65 -5.733 -1.014 1.385 1.00 0.00 C ATOM 951 CD2 LEU A 65 -7.091 0.338 3.048 1.00 0.00 C ATOM 0 H LEU A 65 -3.449 -0.223 6.199 1.00 0.00 H new ATOM 0 HA LEU A 65 -5.989 -0.043 4.875 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -4.140 1.135 3.368 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -3.830 -0.530 2.915 1.00 0.00 H new ATOM 0 HG LEU A 65 -5.631 1.085 1.698 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.570 -0.951 0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.797 -1.028 0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -5.818 -1.928 1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.901 0.374 2.319 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.236 -0.516 3.709 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -7.091 1.256 3.636 1.00 0.00 H new ATOM 963 N LEU A 66 -5.941 -2.500 4.719 1.00 0.00 N ATOM 964 CA LEU A 66 -5.980 -3.943 4.881 1.00 0.00 C ATOM 965 C LEU A 66 -6.204 -4.599 3.516 1.00 0.00 C ATOM 966 O LEU A 66 -7.043 -4.147 2.737 1.00 0.00 O ATOM 967 CB LEU A 66 -7.020 -4.337 5.931 1.00 0.00 C ATOM 968 CG LEU A 66 -7.019 -5.807 6.357 1.00 0.00 C ATOM 969 CD1 LEU A 66 -6.316 -5.987 7.704 1.00 0.00 C ATOM 970 CD2 LEU A 66 -8.440 -6.374 6.373 1.00 0.00 C ATOM 0 H LEU A 66 -6.823 -2.080 4.427 1.00 0.00 H new ATOM 0 HA LEU A 66 -5.026 -4.310 5.259 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -6.863 -3.722 6.817 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -8.009 -4.092 5.544 1.00 0.00 H new ATOM 0 HG LEU A 66 -6.453 -6.376 5.619 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -6.329 -7.040 7.983 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -5.284 -5.646 7.624 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -6.833 -5.403 8.465 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -8.411 -7.420 6.679 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.050 -5.807 7.076 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.873 -6.300 5.375 1.00 0.00 H new ATOM 982 N VAL A 67 -5.441 -5.653 3.269 1.00 0.00 N ATOM 983 CA VAL A 67 -5.546 -6.375 2.013 1.00 0.00 C ATOM 984 C VAL A 67 -5.701 -7.870 2.300 1.00 0.00 C ATOM 985 O VAL A 67 -4.710 -8.590 2.412 1.00 0.00 O ATOM 986 CB VAL A 67 -4.341 -6.058 1.125 1.00 0.00 C ATOM 987 CG1 VAL A 67 -4.324 -6.954 -0.116 1.00 0.00 C ATOM 988 CG2 VAL A 67 -4.322 -4.579 0.734 1.00 0.00 C ATOM 0 H VAL A 67 -4.747 -6.025 3.918 1.00 0.00 H new ATOM 0 HA VAL A 67 -6.431 -6.057 1.462 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.438 -6.264 1.699 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.458 -6.708 -0.730 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.267 -7.999 0.190 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.235 -6.794 -0.693 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -3.456 -4.381 0.103 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.233 -4.336 0.187 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -4.264 -3.966 1.633 1.00 0.00 H new ATOM 998 N PRO A 68 -6.985 -8.303 2.413 1.00 0.00 N ATOM 999 CA PRO A 68 -7.282 -9.699 2.685 1.00 0.00 C ATOM 1000 C PRO A 68 -7.066 -10.559 1.438 1.00 0.00 C ATOM 1001 O PRO A 68 -7.078 -11.786 1.516 1.00 0.00 O ATOM 1002 CB PRO A 68 -8.723 -9.707 3.170 1.00 0.00 C ATOM 1003 CG PRO A 68 -9.324 -8.388 2.712 1.00 0.00 C ATOM 1004 CD PRO A 68 -8.183 -7.479 2.287 1.00 0.00 C ATOM 0 HA PRO A 68 -6.620 -10.131 3.436 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -9.271 -10.552 2.753 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -8.769 -9.802 4.255 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -10.012 -8.550 1.883 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -9.898 -7.930 3.518 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -8.316 -7.128 1.264 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -8.124 -6.595 2.922 1.00 0.00 H new ATOM 1012 N GLY A 69 -6.874 -9.880 0.316 1.00 0.00 N ATOM 1013 CA GLY A 69 -6.655 -10.566 -0.945 1.00 0.00 C ATOM 1014 C GLY A 69 -5.237 -11.136 -1.021 1.00 0.00 C ATOM 1015 O GLY A 69 -4.510 -10.876 -1.979 1.00 0.00 O ATOM 0 H GLY A 69 -6.866 -8.862 0.255 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -7.381 -11.372 -1.055 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -6.818 -9.875 -1.772 1.00 0.00 H new ATOM 1019 N LEU A 70 -4.886 -11.902 0.001 1.00 0.00 N ATOM 1020 CA LEU A 70 -3.568 -12.510 0.062 1.00 0.00 C ATOM 1021 C LEU A 70 -3.700 -14.022 -0.132 1.00 0.00 C ATOM 1022 O LEU A 70 -4.767 -14.590 0.093 1.00 0.00 O ATOM 1023 CB LEU A 70 -2.855 -12.116 1.357 1.00 0.00 C ATOM 1024 CG LEU A 70 -2.482 -10.639 1.495 1.00 0.00 C ATOM 1025 CD1 LEU A 70 -0.967 -10.445 1.397 1.00 0.00 C ATOM 1026 CD2 LEU A 70 -3.236 -9.785 0.473 1.00 0.00 C ATOM 0 H LEU A 70 -5.491 -12.116 0.794 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.939 -12.138 -0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -3.493 -12.389 2.197 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -1.945 -12.710 1.442 1.00 0.00 H new ATOM 0 HG LEU A 70 -2.787 -10.301 2.485 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.728 -9.386 1.498 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.476 -11.005 2.193 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -0.616 -10.805 0.430 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -2.953 -8.739 0.593 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.984 -10.116 -0.534 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.309 -9.890 0.632 1.00 0.00 H new ATOM 1038 N ILE A 71 -2.599 -14.631 -0.547 1.00 0.00 N ATOM 1039 CA ILE A 71 -2.578 -16.066 -0.773 1.00 0.00 C ATOM 1040 C ILE A 71 -1.877 -16.754 0.401 1.00 0.00 C ATOM 1041 O ILE A 71 -1.288 -16.089 1.251 1.00 0.00 O ATOM 1042 CB ILE A 71 -1.954 -16.385 -2.133 1.00 0.00 C ATOM 1043 CG1 ILE A 71 -2.667 -15.628 -3.255 1.00 0.00 C ATOM 1044 CG2 ILE A 71 -1.929 -17.894 -2.386 1.00 0.00 C ATOM 1045 CD1 ILE A 71 -3.572 -16.564 -4.059 1.00 0.00 C ATOM 0 H ILE A 71 -1.715 -14.157 -0.733 1.00 0.00 H new ATOM 0 HA ILE A 71 -3.594 -16.459 -0.813 1.00 0.00 H new ATOM 0 HB ILE A 71 -0.919 -16.044 -2.121 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -3.260 -14.817 -2.832 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.930 -15.172 -3.916 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.481 -18.092 -3.359 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.341 -18.383 -1.609 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.947 -18.283 -2.370 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -4.067 -16.001 -4.850 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -2.972 -17.360 -4.501 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -4.323 -16.999 -3.400 1.00 0.00 H new ATOM 1057 N LYS A 72 -1.966 -18.076 0.409 1.00 0.00 N ATOM 1058 CA LYS A 72 -1.348 -18.860 1.465 1.00 0.00 C ATOM 1059 C LYS A 72 0.166 -18.636 1.442 1.00 0.00 C ATOM 1060 O LYS A 72 0.629 -17.497 1.472 1.00 0.00 O ATOM 1061 CB LYS A 72 -1.754 -20.330 1.347 1.00 0.00 C ATOM 1062 CG LYS A 72 -1.369 -20.898 -0.021 1.00 0.00 C ATOM 1063 CD LYS A 72 -2.584 -21.509 -0.722 1.00 0.00 C ATOM 1064 CE LYS A 72 -2.860 -22.923 -0.206 1.00 0.00 C ATOM 1065 NZ LYS A 72 -2.694 -23.913 -1.293 1.00 0.00 N ATOM 0 H LYS A 72 -2.456 -18.624 -0.298 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.704 -18.532 2.442 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -1.270 -20.909 2.134 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -2.830 -20.427 1.495 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -0.946 -20.108 -0.641 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -0.595 -21.656 0.101 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -3.459 -20.880 -0.556 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -2.412 -21.538 -1.798 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -2.180 -23.157 0.613 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -3.872 -22.979 0.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.885 -24.867 -0.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.360 -23.699 -2.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.720 -23.870 -1.656 1.00 0.00 H new ATOM 1079 N ASP A 73 0.894 -19.741 1.388 1.00 0.00 N ATOM 1080 CA ASP A 73 2.346 -19.680 1.360 1.00 0.00 C ATOM 1081 C ASP A 73 2.793 -18.815 0.180 1.00 0.00 C ATOM 1082 O ASP A 73 3.079 -19.331 -0.899 1.00 0.00 O ATOM 1083 CB ASP A 73 2.953 -21.073 1.182 1.00 0.00 C ATOM 1084 CG ASP A 73 4.343 -21.256 1.794 1.00 0.00 C ATOM 1085 OD1 ASP A 73 4.972 -20.219 2.093 1.00 0.00 O ATOM 1086 OD2 ASP A 73 4.744 -22.430 1.949 1.00 0.00 O ATOM 0 H ASP A 73 0.506 -20.684 1.363 1.00 0.00 H new ATOM 0 HA ASP A 73 2.684 -19.258 2.307 1.00 0.00 H new ATOM 0 HB2 ASP A 73 2.278 -21.806 1.624 1.00 0.00 H new ATOM 0 HB3 ASP A 73 3.010 -21.295 0.116 1.00 0.00 H new ATOM 1091 N VAL A 74 2.840 -17.514 0.426 1.00 0.00 N ATOM 1092 CA VAL A 74 3.247 -16.572 -0.603 1.00 0.00 C ATOM 1093 C VAL A 74 3.760 -15.291 0.059 1.00 0.00 C ATOM 1094 O VAL A 74 3.600 -15.103 1.264 1.00 0.00 O ATOM 1095 CB VAL A 74 2.090 -16.322 -1.572 1.00 0.00 C ATOM 1096 CG1 VAL A 74 1.522 -17.641 -2.099 1.00 0.00 C ATOM 1097 CG2 VAL A 74 0.996 -15.479 -0.913 1.00 0.00 C ATOM 0 H VAL A 74 2.603 -17.090 1.323 1.00 0.00 H new ATOM 0 HA VAL A 74 4.065 -16.983 -1.195 1.00 0.00 H new ATOM 0 HB VAL A 74 2.480 -15.761 -2.422 1.00 0.00 H new ATOM 0 HG11 VAL A 74 0.701 -17.435 -2.786 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.304 -18.190 -2.623 1.00 0.00 H new ATOM 0 HG13 VAL A 74 1.156 -18.239 -1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.185 -15.316 -1.623 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.612 -16.002 -0.037 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.411 -14.518 -0.609 1.00 0.00 H new ATOM 1107 N LEU A 75 4.367 -14.443 -0.758 1.00 0.00 N ATOM 1108 CA LEU A 75 4.905 -13.186 -0.268 1.00 0.00 C ATOM 1109 C LEU A 75 4.334 -12.034 -1.097 1.00 0.00 C ATOM 1110 O LEU A 75 4.887 -11.679 -2.137 1.00 0.00 O ATOM 1111 CB LEU A 75 6.434 -13.229 -0.246 1.00 0.00 C ATOM 1112 CG LEU A 75 7.105 -12.605 0.979 1.00 0.00 C ATOM 1113 CD1 LEU A 75 6.144 -11.669 1.714 1.00 0.00 C ATOM 1114 CD2 LEU A 75 7.673 -13.685 1.903 1.00 0.00 C ATOM 0 H LEU A 75 4.498 -14.602 -1.757 1.00 0.00 H new ATOM 0 HA LEU A 75 4.599 -13.018 0.765 1.00 0.00 H new ATOM 0 HB2 LEU A 75 6.749 -14.270 -0.318 1.00 0.00 H new ATOM 0 HB3 LEU A 75 6.805 -12.722 -1.137 1.00 0.00 H new ATOM 0 HG LEU A 75 7.945 -12.000 0.637 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.646 -11.239 2.581 1.00 0.00 H new ATOM 0 HD12 LEU A 75 5.830 -10.870 1.043 1.00 0.00 H new ATOM 0 HD13 LEU A 75 5.270 -12.231 2.043 1.00 0.00 H new ATOM 0 HD21 LEU A 75 8.144 -13.215 2.766 1.00 0.00 H new ATOM 0 HD22 LEU A 75 6.867 -14.336 2.240 1.00 0.00 H new ATOM 0 HD23 LEU A 75 8.413 -14.274 1.362 1.00 0.00 H new ATOM 1126 N TYR A 76 3.234 -11.482 -0.606 1.00 0.00 N ATOM 1127 CA TYR A 76 2.582 -10.378 -1.289 1.00 0.00 C ATOM 1128 C TYR A 76 3.247 -9.046 -0.936 1.00 0.00 C ATOM 1129 O TYR A 76 3.430 -8.731 0.239 1.00 0.00 O ATOM 1130 CB TYR A 76 1.138 -10.363 -0.783 1.00 0.00 C ATOM 1131 CG TYR A 76 0.140 -11.032 -1.730 1.00 0.00 C ATOM 1132 CD1 TYR A 76 -0.033 -12.401 -1.696 1.00 0.00 C ATOM 1133 CD2 TYR A 76 -0.588 -10.267 -2.618 1.00 0.00 C ATOM 1134 CE1 TYR A 76 -0.972 -13.031 -2.587 1.00 0.00 C ATOM 1135 CE2 TYR A 76 -1.528 -10.896 -3.509 1.00 0.00 C ATOM 1136 CZ TYR A 76 -1.673 -12.247 -3.450 1.00 0.00 C ATOM 1137 OH TYR A 76 -2.561 -12.842 -4.292 1.00 0.00 O ATOM 0 H TYR A 76 2.778 -11.779 0.257 1.00 0.00 H new ATOM 0 HA TYR A 76 2.645 -10.504 -2.370 1.00 0.00 H new ATOM 0 HB2 TYR A 76 1.098 -10.864 0.184 1.00 0.00 H new ATOM 0 HB3 TYR A 76 0.832 -9.330 -0.620 1.00 0.00 H new ATOM 0 HD1 TYR A 76 0.536 -13.000 -1.001 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.453 -9.196 -2.645 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -1.117 -14.101 -2.571 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -2.105 -10.309 -4.208 1.00 0.00 H new ATOM 0 HH TYR A 76 -2.990 -12.160 -4.850 1.00 0.00 H new ATOM 1147 N GLU A 77 3.591 -8.299 -1.975 1.00 0.00 N ATOM 1148 CA GLU A 77 4.231 -7.008 -1.790 1.00 0.00 C ATOM 1149 C GLU A 77 3.180 -5.898 -1.725 1.00 0.00 C ATOM 1150 O GLU A 77 1.986 -6.161 -1.858 1.00 0.00 O ATOM 1151 CB GLU A 77 5.248 -6.737 -2.900 1.00 0.00 C ATOM 1152 CG GLU A 77 6.576 -7.441 -2.612 1.00 0.00 C ATOM 1153 CD GLU A 77 7.285 -7.827 -3.912 1.00 0.00 C ATOM 1154 OE1 GLU A 77 7.897 -6.920 -4.515 1.00 0.00 O ATOM 1155 OE2 GLU A 77 7.199 -9.021 -4.272 1.00 0.00 O ATOM 0 H GLU A 77 3.438 -8.564 -2.948 1.00 0.00 H new ATOM 0 HA GLU A 77 4.771 -7.024 -0.843 1.00 0.00 H new ATOM 0 HB2 GLU A 77 4.850 -7.081 -3.855 1.00 0.00 H new ATOM 0 HB3 GLU A 77 5.414 -5.664 -2.992 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.219 -6.786 -2.024 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.396 -8.334 -2.013 1.00 0.00 H new ATOM 1162 N PHE A 78 3.663 -4.681 -1.522 1.00 0.00 N ATOM 1163 CA PHE A 78 2.780 -3.530 -1.438 1.00 0.00 C ATOM 1164 C PHE A 78 3.554 -2.228 -1.656 1.00 0.00 C ATOM 1165 O PHE A 78 4.665 -2.071 -1.151 1.00 0.00 O ATOM 1166 CB PHE A 78 2.183 -3.526 -0.030 1.00 0.00 C ATOM 1167 CG PHE A 78 1.326 -4.753 0.287 1.00 0.00 C ATOM 1168 CD1 PHE A 78 0.164 -4.963 -0.388 1.00 0.00 C ATOM 1169 CD2 PHE A 78 1.727 -5.634 1.243 1.00 0.00 C ATOM 1170 CE1 PHE A 78 -0.631 -6.102 -0.094 1.00 0.00 C ATOM 1171 CE2 PHE A 78 0.931 -6.773 1.537 1.00 0.00 C ATOM 1172 CZ PHE A 78 -0.231 -6.983 0.862 1.00 0.00 C ATOM 0 H PHE A 78 4.654 -4.467 -1.413 1.00 0.00 H new ATOM 0 HA PHE A 78 2.009 -3.595 -2.206 1.00 0.00 H new ATOM 0 HB2 PHE A 78 2.993 -3.464 0.697 1.00 0.00 H new ATOM 0 HB3 PHE A 78 1.575 -2.630 0.093 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -0.154 -4.264 -1.147 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.650 -5.467 1.778 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.554 -6.269 -0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 78 1.248 -7.472 2.296 1.00 0.00 H new ATOM 0 HZ PHE A 78 -0.836 -7.849 1.085 1.00 0.00 H new ATOM 1182 N ARG A 79 2.937 -1.329 -2.408 1.00 0.00 N ATOM 1183 CA ARG A 79 3.554 -0.046 -2.698 1.00 0.00 C ATOM 1184 C ARG A 79 2.493 1.055 -2.745 1.00 0.00 C ATOM 1185 O ARG A 79 1.509 0.943 -3.474 1.00 0.00 O ATOM 1186 CB ARG A 79 4.300 -0.083 -4.034 1.00 0.00 C ATOM 1187 CG ARG A 79 3.321 -0.153 -5.207 1.00 0.00 C ATOM 1188 CD ARG A 79 4.029 -0.602 -6.487 1.00 0.00 C ATOM 1189 NE ARG A 79 3.567 0.212 -7.633 1.00 0.00 N ATOM 1190 CZ ARG A 79 4.007 0.057 -8.890 1.00 0.00 C ATOM 1191 NH1 ARG A 79 4.921 -0.882 -9.169 1.00 0.00 N ATOM 1192 NH2 ARG A 79 3.531 0.841 -9.867 1.00 0.00 N ATOM 0 H ARG A 79 2.016 -1.464 -2.825 1.00 0.00 H new ATOM 0 HA ARG A 79 4.268 0.166 -1.902 1.00 0.00 H new ATOM 0 HB2 ARG A 79 4.925 0.805 -4.130 1.00 0.00 H new ATOM 0 HB3 ARG A 79 4.965 -0.946 -4.059 1.00 0.00 H new ATOM 0 HG2 ARG A 79 2.514 -0.847 -4.971 1.00 0.00 H new ATOM 0 HG3 ARG A 79 2.865 0.825 -5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.108 -0.501 -6.370 1.00 0.00 H new ATOM 0 HD3 ARG A 79 3.826 -1.656 -6.674 1.00 0.00 H new ATOM 0 HE ARG A 79 2.871 0.936 -7.456 1.00 0.00 H new ATOM 0 HH11 ARG A 79 5.282 -1.479 -8.425 1.00 0.00 H new ATOM 0 HH12 ARG A 79 5.256 -1.000 -10.125 1.00 0.00 H new ATOM 0 HH21 ARG A 79 2.834 1.555 -9.654 1.00 0.00 H new ATOM 0 HH22 ARG A 79 3.865 0.724 -10.824 1.00 0.00 H new ATOM 1206 N LEU A 80 2.729 2.094 -1.958 1.00 0.00 N ATOM 1207 CA LEU A 80 1.806 3.215 -1.901 1.00 0.00 C ATOM 1208 C LEU A 80 2.375 4.381 -2.711 1.00 0.00 C ATOM 1209 O LEU A 80 3.562 4.689 -2.612 1.00 0.00 O ATOM 1210 CB LEU A 80 1.487 3.573 -0.448 1.00 0.00 C ATOM 1211 CG LEU A 80 0.041 3.978 -0.158 1.00 0.00 C ATOM 1212 CD1 LEU A 80 -0.941 2.956 -0.734 1.00 0.00 C ATOM 1213 CD2 LEU A 80 -0.177 4.202 1.340 1.00 0.00 C ATOM 0 H LEU A 80 3.546 2.183 -1.354 1.00 0.00 H new ATOM 0 HA LEU A 80 0.852 2.946 -2.356 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.736 2.717 0.179 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.140 4.391 -0.145 1.00 0.00 H new ATOM 0 HG LEU A 80 -0.154 4.928 -0.656 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.962 3.268 -0.514 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.807 2.891 -1.814 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.755 1.980 -0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -1.213 4.489 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 80 0.043 3.282 1.881 1.00 0.00 H new ATOM 0 HD23 LEU A 80 0.484 4.995 1.689 1.00 0.00 H new ATOM 1225 N VAL A 81 1.502 4.998 -3.493 1.00 0.00 N ATOM 1226 CA VAL A 81 1.903 6.124 -4.320 1.00 0.00 C ATOM 1227 C VAL A 81 0.927 7.283 -4.103 1.00 0.00 C ATOM 1228 O VAL A 81 -0.188 7.266 -4.621 1.00 0.00 O ATOM 1229 CB VAL A 81 1.999 5.690 -5.784 1.00 0.00 C ATOM 1230 CG1 VAL A 81 2.067 6.904 -6.712 1.00 0.00 C ATOM 1231 CG2 VAL A 81 3.198 4.765 -6.003 1.00 0.00 C ATOM 0 H VAL A 81 0.518 4.740 -3.572 1.00 0.00 H new ATOM 0 HA VAL A 81 2.894 6.475 -4.033 1.00 0.00 H new ATOM 0 HB VAL A 81 1.095 5.132 -6.028 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.135 6.568 -7.747 1.00 0.00 H new ATOM 0 HG12 VAL A 81 1.170 7.510 -6.585 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.945 7.501 -6.466 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.244 4.471 -7.052 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.115 5.288 -5.732 1.00 0.00 H new ATOM 0 HG23 VAL A 81 3.090 3.876 -5.381 1.00 0.00 H new ATOM 1241 N ALA A 82 1.384 8.262 -3.336 1.00 0.00 N ATOM 1242 CA ALA A 82 0.565 9.427 -3.045 1.00 0.00 C ATOM 1243 C ALA A 82 0.499 10.321 -4.284 1.00 0.00 C ATOM 1244 O ALA A 82 1.529 10.680 -4.852 1.00 0.00 O ATOM 1245 CB ALA A 82 1.135 10.159 -1.828 1.00 0.00 C ATOM 0 H ALA A 82 2.310 8.273 -2.908 1.00 0.00 H new ATOM 0 HA ALA A 82 -0.454 9.129 -2.799 1.00 0.00 H new ATOM 0 HB1 ALA A 82 0.522 11.033 -1.609 1.00 0.00 H new ATOM 0 HB2 ALA A 82 1.134 9.490 -0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.156 10.476 -2.040 1.00 0.00 H new ATOM 1251 N PHE A 83 -0.725 10.656 -4.668 1.00 0.00 N ATOM 1252 CA PHE A 83 -0.940 11.502 -5.830 1.00 0.00 C ATOM 1253 C PHE A 83 -1.929 12.625 -5.515 1.00 0.00 C ATOM 1254 O PHE A 83 -2.894 12.420 -4.780 1.00 0.00 O ATOM 1255 CB PHE A 83 -1.528 10.612 -6.928 1.00 0.00 C ATOM 1256 CG PHE A 83 -2.859 9.958 -6.552 1.00 0.00 C ATOM 1257 CD1 PHE A 83 -4.007 10.687 -6.580 1.00 0.00 C ATOM 1258 CD2 PHE A 83 -2.894 8.648 -6.189 1.00 0.00 C ATOM 1259 CE1 PHE A 83 -5.242 10.080 -6.231 1.00 0.00 C ATOM 1260 CE2 PHE A 83 -4.129 8.041 -5.840 1.00 0.00 C ATOM 1261 CZ PHE A 83 -5.277 8.769 -5.868 1.00 0.00 C ATOM 0 H PHE A 83 -1.578 10.357 -4.195 1.00 0.00 H new ATOM 0 HA PHE A 83 0.001 11.959 -6.137 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.670 11.209 -7.829 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.808 9.831 -7.173 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -3.979 11.728 -6.868 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.982 8.069 -6.166 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -6.154 10.659 -6.254 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -4.157 7.000 -5.552 1.00 0.00 H new ATOM 0 HZ PHE A 83 -6.216 8.307 -5.602 1.00 0.00 H new ATOM 1271 N ALA A 84 -1.656 13.788 -6.088 1.00 0.00 N ATOM 1272 CA ALA A 84 -2.511 14.945 -5.878 1.00 0.00 C ATOM 1273 C ALA A 84 -2.913 15.529 -7.233 1.00 0.00 C ATOM 1274 O ALA A 84 -2.088 16.119 -7.929 1.00 0.00 O ATOM 1275 CB ALA A 84 -1.784 15.963 -4.996 1.00 0.00 C ATOM 0 H ALA A 84 -0.855 13.954 -6.697 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.425 14.658 -5.359 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.424 16.831 -4.838 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.547 15.508 -4.035 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.862 16.277 -5.486 1.00 0.00 H new ATOM 1281 N GLY A 85 -4.182 15.345 -7.567 1.00 0.00 N ATOM 1282 CA GLY A 85 -4.704 15.847 -8.827 1.00 0.00 C ATOM 1283 C GLY A 85 -4.068 15.119 -10.013 1.00 0.00 C ATOM 1284 O GLY A 85 -4.489 14.020 -10.370 1.00 0.00 O ATOM 0 H GLY A 85 -4.864 14.856 -6.987 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -5.786 15.717 -8.854 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.509 16.917 -8.905 1.00 0.00 H new ATOM 1288 N SER A 86 -3.064 15.762 -10.591 1.00 0.00 N ATOM 1289 CA SER A 86 -2.365 15.190 -11.729 1.00 0.00 C ATOM 1290 C SER A 86 -0.933 14.825 -11.335 1.00 0.00 C ATOM 1291 O SER A 86 -0.136 14.421 -12.180 1.00 0.00 O ATOM 1292 CB SER A 86 -2.359 16.157 -12.915 1.00 0.00 C ATOM 1293 OG SER A 86 -3.419 15.887 -13.829 1.00 0.00 O ATOM 0 H SER A 86 -2.718 16.674 -10.292 1.00 0.00 H new ATOM 0 HA SER A 86 -2.892 14.286 -12.034 1.00 0.00 H new ATOM 0 HB2 SER A 86 -2.447 17.180 -12.549 1.00 0.00 H new ATOM 0 HB3 SER A 86 -1.404 16.086 -13.436 1.00 0.00 H new ATOM 0 HG SER A 86 -3.382 16.526 -14.571 1.00 0.00 H new ATOM 1299 N PHE A 87 -0.649 14.981 -10.050 1.00 0.00 N ATOM 1300 CA PHE A 87 0.674 14.673 -9.533 1.00 0.00 C ATOM 1301 C PHE A 87 0.705 13.281 -8.899 1.00 0.00 C ATOM 1302 O PHE A 87 -0.170 12.937 -8.106 1.00 0.00 O ATOM 1303 CB PHE A 87 0.989 15.717 -8.460 1.00 0.00 C ATOM 1304 CG PHE A 87 0.824 17.163 -8.931 1.00 0.00 C ATOM 1305 CD1 PHE A 87 0.886 17.458 -10.257 1.00 0.00 C ATOM 1306 CD2 PHE A 87 0.615 18.154 -8.023 1.00 0.00 C ATOM 1307 CE1 PHE A 87 0.733 18.800 -10.694 1.00 0.00 C ATOM 1308 CE2 PHE A 87 0.462 19.496 -8.460 1.00 0.00 C ATOM 1309 CZ PHE A 87 0.524 19.791 -9.786 1.00 0.00 C ATOM 0 H PHE A 87 -1.312 15.317 -9.352 1.00 0.00 H new ATOM 0 HA PHE A 87 1.403 14.690 -10.343 1.00 0.00 H new ATOM 0 HB2 PHE A 87 0.338 15.549 -7.602 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.013 15.572 -8.116 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.052 16.671 -10.978 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.565 17.920 -6.970 1.00 0.00 H new ATOM 0 HE1 PHE A 87 0.783 19.034 -11.747 1.00 0.00 H new ATOM 0 HE2 PHE A 87 0.296 20.283 -7.739 1.00 0.00 H new ATOM 0 HZ PHE A 87 0.407 20.812 -10.118 1.00 0.00 H new ATOM 1319 N VAL A 88 1.721 12.518 -9.272 1.00 0.00 N ATOM 1320 CA VAL A 88 1.877 11.171 -8.750 1.00 0.00 C ATOM 1321 C VAL A 88 3.237 11.051 -8.058 1.00 0.00 C ATOM 1322 O VAL A 88 4.271 11.333 -8.661 1.00 0.00 O ATOM 1323 CB VAL A 88 1.685 10.149 -9.872 1.00 0.00 C ATOM 1324 CG1 VAL A 88 2.295 8.798 -9.493 1.00 0.00 C ATOM 1325 CG2 VAL A 88 0.206 10.001 -10.232 1.00 0.00 C ATOM 0 H VAL A 88 2.445 12.807 -9.930 1.00 0.00 H new ATOM 0 HA VAL A 88 1.112 10.960 -8.003 1.00 0.00 H new ATOM 0 HB VAL A 88 2.209 10.518 -10.754 1.00 0.00 H new ATOM 0 HG11 VAL A 88 2.145 8.090 -10.308 1.00 0.00 H new ATOM 0 HG12 VAL A 88 3.363 8.919 -9.310 1.00 0.00 H new ATOM 0 HG13 VAL A 88 1.813 8.421 -8.591 1.00 0.00 H new ATOM 0 HG21 VAL A 88 0.098 9.269 -11.032 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -0.350 9.666 -9.356 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -0.185 10.962 -10.565 1.00 0.00 H new ATOM 1335 N SER A 89 3.191 10.633 -6.801 1.00 0.00 N ATOM 1336 CA SER A 89 4.406 10.473 -6.021 1.00 0.00 C ATOM 1337 C SER A 89 4.996 9.080 -6.252 1.00 0.00 C ATOM 1338 O SER A 89 4.334 8.206 -6.809 1.00 0.00 O ATOM 1339 CB SER A 89 4.138 10.696 -4.532 1.00 0.00 C ATOM 1340 OG SER A 89 3.505 9.570 -3.929 1.00 0.00 O ATOM 0 H SER A 89 2.331 10.400 -6.304 1.00 0.00 H new ATOM 0 HA SER A 89 5.125 11.224 -6.349 1.00 0.00 H new ATOM 0 HB2 SER A 89 5.079 10.900 -4.021 1.00 0.00 H new ATOM 0 HB3 SER A 89 3.509 11.577 -4.405 1.00 0.00 H new ATOM 0 HG SER A 89 2.706 9.330 -4.443 1.00 0.00 H new ATOM 1346 N ASP A 90 6.235 8.917 -5.811 1.00 0.00 N ATOM 1347 CA ASP A 90 6.921 7.645 -5.963 1.00 0.00 C ATOM 1348 C ASP A 90 6.304 6.621 -5.009 1.00 0.00 C ATOM 1349 O ASP A 90 5.765 6.985 -3.965 1.00 0.00 O ATOM 1350 CB ASP A 90 8.406 7.777 -5.619 1.00 0.00 C ATOM 1351 CG ASP A 90 9.076 6.487 -5.138 1.00 0.00 C ATOM 1352 OD1 ASP A 90 8.694 6.024 -4.042 1.00 0.00 O ATOM 1353 OD2 ASP A 90 9.953 5.994 -5.879 1.00 0.00 O ATOM 0 H ASP A 90 6.781 9.644 -5.349 1.00 0.00 H new ATOM 0 HA ASP A 90 6.817 7.327 -7.000 1.00 0.00 H new ATOM 0 HB2 ASP A 90 8.937 8.138 -6.500 1.00 0.00 H new ATOM 0 HB3 ASP A 90 8.518 8.537 -4.846 1.00 0.00 H new ATOM 1358 N PRO A 91 6.407 5.326 -5.412 1.00 0.00 N ATOM 1359 CA PRO A 91 5.865 4.246 -4.604 1.00 0.00 C ATOM 1360 C PRO A 91 6.750 3.973 -3.387 1.00 0.00 C ATOM 1361 O PRO A 91 7.786 3.320 -3.502 1.00 0.00 O ATOM 1362 CB PRO A 91 5.771 3.058 -5.548 1.00 0.00 C ATOM 1363 CG PRO A 91 6.691 3.379 -6.715 1.00 0.00 C ATOM 1364 CD PRO A 91 7.039 4.857 -6.641 1.00 0.00 C ATOM 0 HA PRO A 91 4.887 4.484 -4.185 1.00 0.00 H new ATOM 0 HB2 PRO A 91 6.078 2.138 -5.050 1.00 0.00 H new ATOM 0 HB3 PRO A 91 4.746 2.909 -5.888 1.00 0.00 H new ATOM 0 HG2 PRO A 91 7.595 2.771 -6.667 1.00 0.00 H new ATOM 0 HG3 PRO A 91 6.202 3.149 -7.661 1.00 0.00 H new ATOM 0 HD2 PRO A 91 8.118 5.009 -6.614 1.00 0.00 H new ATOM 0 HD3 PRO A 91 6.663 5.396 -7.510 1.00 0.00 H new ATOM 1372 N SER A 92 6.311 4.489 -2.248 1.00 0.00 N ATOM 1373 CA SER A 92 7.051 4.309 -1.011 1.00 0.00 C ATOM 1374 C SER A 92 7.621 2.891 -0.943 1.00 0.00 C ATOM 1375 O SER A 92 7.173 2.003 -1.666 1.00 0.00 O ATOM 1376 CB SER A 92 6.164 4.583 0.206 1.00 0.00 C ATOM 1377 OG SER A 92 5.019 3.735 0.234 1.00 0.00 O ATOM 0 H SER A 92 5.452 5.032 -2.156 1.00 0.00 H new ATOM 0 HA SER A 92 7.873 5.025 -0.997 1.00 0.00 H new ATOM 0 HB2 SER A 92 6.744 4.439 1.117 1.00 0.00 H new ATOM 0 HB3 SER A 92 5.843 5.625 0.194 1.00 0.00 H new ATOM 0 HG SER A 92 4.416 4.023 0.951 1.00 0.00 H new ATOM 1383 N ASN A 93 8.601 2.723 -0.067 1.00 0.00 N ATOM 1384 CA ASN A 93 9.237 1.428 0.104 1.00 0.00 C ATOM 1385 C ASN A 93 8.193 0.324 -0.073 1.00 0.00 C ATOM 1386 O ASN A 93 7.011 0.534 0.195 1.00 0.00 O ATOM 1387 CB ASN A 93 9.838 1.291 1.505 1.00 0.00 C ATOM 1388 CG ASN A 93 8.951 1.968 2.551 1.00 0.00 C ATOM 1389 OD1 ASN A 93 8.641 3.145 2.471 1.00 0.00 O ATOM 1390 ND2 ASN A 93 8.560 1.161 3.533 1.00 0.00 N ATOM 0 H ASN A 93 8.970 3.462 0.532 1.00 0.00 H new ATOM 0 HA ASN A 93 10.030 1.341 -0.639 1.00 0.00 H new ATOM 0 HB2 ASN A 93 9.957 0.236 1.752 1.00 0.00 H new ATOM 0 HB3 ASN A 93 10.833 1.737 1.523 1.00 0.00 H new ATOM 0 HD21 ASN A 93 7.964 1.518 4.280 1.00 0.00 H new ATOM 0 HD22 ASN A 93 8.856 0.185 3.539 1.00 0.00 H new ATOM 1397 N THR A 94 8.667 -0.829 -0.523 1.00 0.00 N ATOM 1398 CA THR A 94 7.790 -1.966 -0.739 1.00 0.00 C ATOM 1399 C THR A 94 7.587 -2.739 0.566 1.00 0.00 C ATOM 1400 O THR A 94 8.548 -3.021 1.280 1.00 0.00 O ATOM 1401 CB THR A 94 8.385 -2.816 -1.863 1.00 0.00 C ATOM 1402 OG1 THR A 94 8.904 -1.861 -2.783 1.00 0.00 O ATOM 1403 CG2 THR A 94 7.315 -3.562 -2.663 1.00 0.00 C ATOM 0 H THR A 94 9.648 -1.000 -0.744 1.00 0.00 H new ATOM 0 HA THR A 94 6.795 -1.645 -1.047 1.00 0.00 H new ATOM 0 HB THR A 94 9.088 -3.534 -1.441 1.00 0.00 H new ATOM 0 HG1 THR A 94 9.311 -2.327 -3.543 1.00 0.00 H new ATOM 0 HG21 THR A 94 7.791 -4.150 -3.448 1.00 0.00 H new ATOM 0 HG22 THR A 94 6.760 -4.225 -1.999 1.00 0.00 H new ATOM 0 HG23 THR A 94 6.630 -2.843 -3.113 1.00 0.00 H new ATOM 1411 N ALA A 95 6.331 -3.059 0.838 1.00 0.00 N ATOM 1412 CA ALA A 95 5.990 -3.794 2.045 1.00 0.00 C ATOM 1413 C ALA A 95 5.343 -5.126 1.660 1.00 0.00 C ATOM 1414 O ALA A 95 4.643 -5.212 0.652 1.00 0.00 O ATOM 1415 CB ALA A 95 5.080 -2.936 2.925 1.00 0.00 C ATOM 0 H ALA A 95 5.536 -2.823 0.244 1.00 0.00 H new ATOM 0 HA ALA A 95 6.886 -4.018 2.624 1.00 0.00 H new ATOM 0 HB1 ALA A 95 4.824 -3.487 3.830 1.00 0.00 H new ATOM 0 HB2 ALA A 95 5.597 -2.015 3.195 1.00 0.00 H new ATOM 0 HB3 ALA A 95 4.169 -2.693 2.378 1.00 0.00 H new ATOM 1421 N ASN A 96 5.600 -6.132 2.483 1.00 0.00 N ATOM 1422 CA ASN A 96 5.051 -7.455 2.241 1.00 0.00 C ATOM 1423 C ASN A 96 4.859 -8.175 3.578 1.00 0.00 C ATOM 1424 O ASN A 96 5.431 -7.775 4.590 1.00 0.00 O ATOM 1425 CB ASN A 96 5.999 -8.297 1.384 1.00 0.00 C ATOM 1426 CG ASN A 96 7.391 -7.664 1.324 1.00 0.00 C ATOM 1427 OD1 ASN A 96 7.595 -6.602 0.761 1.00 0.00 O ATOM 1428 ND2 ASN A 96 8.335 -8.375 1.934 1.00 0.00 N ATOM 0 H ASN A 96 6.181 -6.057 3.318 1.00 0.00 H new ATOM 0 HA ASN A 96 4.102 -7.335 1.718 1.00 0.00 H new ATOM 0 HB2 ASN A 96 6.071 -9.304 1.796 1.00 0.00 H new ATOM 0 HB3 ASN A 96 5.595 -8.393 0.376 1.00 0.00 H new ATOM 0 HD21 ASN A 96 9.298 -8.038 1.949 1.00 0.00 H new ATOM 0 HD22 ASN A 96 8.096 -9.257 2.387 1.00 0.00 H new ATOM 1435 N VAL A 97 4.050 -9.223 3.538 1.00 0.00 N ATOM 1436 CA VAL A 97 3.774 -10.002 4.733 1.00 0.00 C ATOM 1437 C VAL A 97 4.043 -11.481 4.447 1.00 0.00 C ATOM 1438 O VAL A 97 3.675 -11.989 3.389 1.00 0.00 O ATOM 1439 CB VAL A 97 2.346 -9.736 5.213 1.00 0.00 C ATOM 1440 CG1 VAL A 97 1.907 -8.312 4.865 1.00 0.00 C ATOM 1441 CG2 VAL A 97 1.373 -10.766 4.637 1.00 0.00 C ATOM 0 H VAL A 97 3.576 -9.551 2.696 1.00 0.00 H new ATOM 0 HA VAL A 97 4.437 -9.703 5.545 1.00 0.00 H new ATOM 0 HB VAL A 97 2.334 -9.835 6.298 1.00 0.00 H new ATOM 0 HG11 VAL A 97 0.888 -8.149 5.217 1.00 0.00 H new ATOM 0 HG12 VAL A 97 2.576 -7.598 5.345 1.00 0.00 H new ATOM 0 HG13 VAL A 97 1.944 -8.174 3.784 1.00 0.00 H new ATOM 0 HG21 VAL A 97 0.365 -10.554 4.994 1.00 0.00 H new ATOM 0 HG22 VAL A 97 1.391 -10.714 3.548 1.00 0.00 H new ATOM 0 HG23 VAL A 97 1.669 -11.765 4.958 1.00 0.00 H new ATOM 1451 N SER A 98 4.683 -12.130 5.408 1.00 0.00 N ATOM 1452 CA SER A 98 5.005 -13.540 5.272 1.00 0.00 C ATOM 1453 C SER A 98 3.805 -14.394 5.687 1.00 0.00 C ATOM 1454 O SER A 98 3.091 -14.051 6.628 1.00 0.00 O ATOM 1455 CB SER A 98 6.232 -13.908 6.110 1.00 0.00 C ATOM 1456 OG SER A 98 6.999 -14.946 5.506 1.00 0.00 O ATOM 0 H SER A 98 4.987 -11.705 6.284 1.00 0.00 H new ATOM 0 HA SER A 98 5.239 -13.737 4.226 1.00 0.00 H new ATOM 0 HB2 SER A 98 6.858 -13.026 6.244 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.912 -14.225 7.103 1.00 0.00 H new ATOM 0 HG SER A 98 7.774 -15.151 6.070 1.00 0.00 H new ATOM 1462 N THR A 99 3.620 -15.488 4.963 1.00 0.00 N ATOM 1463 CA THR A 99 2.518 -16.393 5.244 1.00 0.00 C ATOM 1464 C THR A 99 3.048 -17.786 5.590 1.00 0.00 C ATOM 1465 O THR A 99 2.324 -18.775 5.476 1.00 0.00 O ATOM 1466 CB THR A 99 1.578 -16.382 4.037 1.00 0.00 C ATOM 1467 OG1 THR A 99 2.417 -16.736 2.941 1.00 0.00 O ATOM 1468 CG2 THR A 99 1.085 -14.976 3.691 1.00 0.00 C ATOM 0 H THR A 99 4.214 -15.768 4.183 1.00 0.00 H new ATOM 0 HA THR A 99 1.952 -16.069 6.117 1.00 0.00 H new ATOM 0 HB THR A 99 0.722 -17.027 4.238 1.00 0.00 H new ATOM 0 HG1 THR A 99 2.943 -15.956 2.666 1.00 0.00 H new ATOM 0 HG21 THR A 99 0.422 -15.025 2.827 1.00 0.00 H new ATOM 0 HG22 THR A 99 0.544 -14.561 4.541 1.00 0.00 H new ATOM 0 HG23 THR A 99 1.938 -14.339 3.457 1.00 0.00 H new ATOM 1476 N SER A 100 4.305 -17.820 6.005 1.00 0.00 N ATOM 1477 CA SER A 100 4.940 -19.076 6.368 1.00 0.00 C ATOM 1478 C SER A 100 4.563 -19.458 7.801 1.00 0.00 C ATOM 1479 O SER A 100 4.483 -20.640 8.132 1.00 0.00 O ATOM 1480 CB SER A 100 6.460 -18.986 6.226 1.00 0.00 C ATOM 1481 OG SER A 100 7.118 -20.112 6.801 1.00 0.00 O ATOM 0 H SER A 100 4.902 -16.998 6.098 1.00 0.00 H new ATOM 0 HA SER A 100 4.584 -19.849 5.687 1.00 0.00 H new ATOM 0 HB2 SER A 100 6.722 -18.913 5.170 1.00 0.00 H new ATOM 0 HB3 SER A 100 6.816 -18.074 6.706 1.00 0.00 H new ATOM 0 HG SER A 100 8.087 -20.017 6.688 1.00 0.00 H new ATOM 1487 N GLY A 101 4.340 -18.435 8.613 1.00 0.00 N ATOM 1488 CA GLY A 101 3.973 -18.648 10.003 1.00 0.00 C ATOM 1489 C GLY A 101 2.574 -19.259 10.113 1.00 0.00 C ATOM 1490 O GLY A 101 2.337 -20.130 10.948 1.00 0.00 O ATOM 0 H GLY A 101 4.406 -17.456 8.335 1.00 0.00 H new ATOM 0 HA2 GLY A 101 4.700 -19.307 10.478 1.00 0.00 H new ATOM 0 HA3 GLY A 101 4.003 -17.700 10.540 1.00 0.00 H new ATOM 1494 N LEU A 102 1.684 -18.777 9.258 1.00 0.00 N ATOM 1495 CA LEU A 102 0.315 -19.264 9.249 1.00 0.00 C ATOM 1496 C LEU A 102 0.222 -20.494 8.344 1.00 0.00 C ATOM 1497 O LEU A 102 1.112 -20.739 7.530 1.00 0.00 O ATOM 1498 CB LEU A 102 -0.650 -18.142 8.862 1.00 0.00 C ATOM 1499 CG LEU A 102 -1.613 -18.451 7.714 1.00 0.00 C ATOM 1500 CD1 LEU A 102 -2.648 -17.336 7.551 1.00 0.00 C ATOM 1501 CD2 LEU A 102 -0.850 -18.720 6.416 1.00 0.00 C ATOM 0 H LEU A 102 1.884 -18.054 8.567 1.00 0.00 H new ATOM 0 HA LEU A 102 0.016 -19.580 10.249 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.237 -17.876 9.741 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -0.064 -17.263 8.592 1.00 0.00 H new ATOM 0 HG LEU A 102 -2.158 -19.362 7.961 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.320 -17.581 6.728 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -3.223 -17.236 8.472 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -2.139 -16.396 7.337 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.558 -18.937 5.616 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.261 -17.842 6.151 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -0.186 -19.573 6.554 1.00 0.00 H new ATOM 1513 N SER A 103 -0.862 -21.236 8.516 1.00 0.00 N ATOM 1514 CA SER A 103 -1.083 -22.434 7.724 1.00 0.00 C ATOM 1515 C SER A 103 0.049 -23.435 7.964 1.00 0.00 C ATOM 1516 O SER A 103 0.812 -23.746 7.050 1.00 0.00 O ATOM 1517 CB SER A 103 -1.189 -22.099 6.235 1.00 0.00 C ATOM 1518 OG SER A 103 -2.431 -21.479 5.915 1.00 0.00 O ATOM 0 H SER A 103 -1.597 -21.031 9.193 1.00 0.00 H new ATOM 0 HA SER A 103 -2.027 -22.881 8.035 1.00 0.00 H new ATOM 0 HB2 SER A 103 -0.370 -21.437 5.953 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.078 -23.011 5.649 1.00 0.00 H new ATOM 0 HG SER A 103 -2.459 -21.279 4.956 1.00 0.00 H new ATOM 1524 N GLY A 104 0.123 -23.912 9.198 1.00 0.00 N ATOM 1525 CA GLY A 104 1.150 -24.871 9.569 1.00 0.00 C ATOM 1526 C GLY A 104 0.972 -25.332 11.017 1.00 0.00 C ATOM 1527 O GLY A 104 0.010 -24.948 11.680 1.00 0.00 O ATOM 0 H GLY A 104 -0.511 -23.652 9.953 1.00 0.00 H new ATOM 0 HA2 GLY A 104 1.107 -25.732 8.902 1.00 0.00 H new ATOM 0 HA3 GLY A 104 2.135 -24.421 9.445 1.00 0.00 H new ATOM 1531 N PRO A 105 1.940 -26.169 11.477 1.00 0.00 N ATOM 1532 CA PRO A 105 1.900 -26.685 12.834 1.00 0.00 C ATOM 1533 C PRO A 105 2.304 -25.608 13.843 1.00 0.00 C ATOM 1534 O PRO A 105 1.788 -25.573 14.959 1.00 0.00 O ATOM 1535 CB PRO A 105 2.842 -27.878 12.829 1.00 0.00 C ATOM 1536 CG PRO A 105 3.726 -27.706 11.605 1.00 0.00 C ATOM 1537 CD PRO A 105 3.094 -26.644 10.720 1.00 0.00 C ATOM 0 HA PRO A 105 0.898 -26.987 13.140 1.00 0.00 H new ATOM 0 HB2 PRO A 105 3.439 -27.908 13.741 1.00 0.00 H new ATOM 0 HB3 PRO A 105 2.286 -28.814 12.781 1.00 0.00 H new ATOM 0 HG2 PRO A 105 4.732 -27.408 11.900 1.00 0.00 H new ATOM 0 HG3 PRO A 105 3.818 -28.648 11.065 1.00 0.00 H new ATOM 0 HD2 PRO A 105 3.793 -25.833 10.514 1.00 0.00 H new ATOM 0 HD3 PRO A 105 2.793 -27.058 9.758 1.00 0.00 H new ATOM 1545 N SER A 106 3.224 -24.756 13.414 1.00 0.00 N ATOM 1546 CA SER A 106 3.703 -23.681 14.266 1.00 0.00 C ATOM 1547 C SER A 106 4.019 -24.221 15.662 1.00 0.00 C ATOM 1548 O SER A 106 3.179 -24.164 16.559 1.00 0.00 O ATOM 1549 CB SER A 106 2.677 -22.550 14.355 1.00 0.00 C ATOM 1550 OG SER A 106 3.282 -21.268 14.210 1.00 0.00 O ATOM 0 H SER A 106 3.650 -24.789 12.488 1.00 0.00 H new ATOM 0 HA SER A 106 4.614 -23.276 13.825 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.922 -22.684 13.581 1.00 0.00 H new ATOM 0 HB3 SER A 106 2.163 -22.602 15.315 1.00 0.00 H new ATOM 0 HG SER A 106 2.594 -20.573 14.271 1.00 0.00 H new ATOM 1556 N SER A 107 5.233 -24.733 15.803 1.00 0.00 N ATOM 1557 CA SER A 107 5.671 -25.283 17.074 1.00 0.00 C ATOM 1558 C SER A 107 7.192 -25.176 17.195 1.00 0.00 C ATOM 1559 O SER A 107 7.923 -25.948 16.577 1.00 0.00 O ATOM 1560 CB SER A 107 5.228 -26.739 17.227 1.00 0.00 C ATOM 1561 OG SER A 107 5.894 -27.599 16.306 1.00 0.00 O ATOM 0 H SER A 107 5.927 -24.778 15.057 1.00 0.00 H new ATOM 0 HA SER A 107 5.208 -24.705 17.873 1.00 0.00 H new ATOM 0 HB2 SER A 107 5.428 -27.074 18.245 1.00 0.00 H new ATOM 0 HB3 SER A 107 4.151 -26.808 17.074 1.00 0.00 H new ATOM 0 HG SER A 107 6.739 -27.188 16.027 1.00 0.00 H new ATOM 1567 N GLY A 108 7.624 -24.212 17.995 1.00 0.00 N ATOM 1568 CA GLY A 108 9.045 -23.994 18.205 1.00 0.00 C ATOM 1569 C GLY A 108 9.587 -24.919 19.297 1.00 0.00 C ATOM 1570 O GLY A 108 10.001 -26.042 19.015 1.00 0.00 O ATOM 0 H GLY A 108 7.015 -23.573 18.506 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.585 -24.169 17.274 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.220 -22.955 18.484 1.00 0.00 H new TER 1574 GLY A 108