USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1145 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 26 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.136) USER MOD Set 1.2: A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0.151 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0.0428 USER MOD Single : A 13 GLN : amide:sc=-0.00338 K(o=-0.0034,f=-0.52) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 27 GLN : amide:sc= -1.66 K(o=-1.7,f=-0.75) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 25:sc= 0.525 USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 GLN : amide:sc=-0.00202 K(o=-0.002,f=-0.63) USER MOD Single : A 56 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.0738 USER MOD Single : A 68 MET CE :methyl 168:sc= -0.169 (180deg=-0.404) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl -119:sc= -0.0223 (180deg=-0.132) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -88:sc= 0.182 USER MOD Single : A 80 GLN : amide:sc= -0.388 X(o=-0.39,f=-0.16) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0426 USER MOD Single : A 88 MET CE :methyl 165:sc= -0.311 (180deg=-0.814) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS : no HE2:sc= -2.29 K(o=-2.3,f=-3.9!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HD1:sc=-0.00518 X(o=-0.0052,f=-0.0052) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 170:sc= 0 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -176:sc= -0.0393 (180deg=-0.093) USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.167 USER MOD Single : A 131 HIS : no HD1:sc= -0.0552 X(o=-0.055,f=-0.037) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 24.541 -26.920 -47.184 1.00 0.00 N ATOM 2 CA PRO A 1 23.081 -26.838 -47.008 1.00 0.00 C ATOM 3 C PRO A 1 22.741 -26.283 -45.623 1.00 0.00 C ATOM 4 O PRO A 1 23.161 -26.862 -44.623 1.00 0.00 O ATOM 5 CB PRO A 1 22.554 -28.270 -47.189 1.00 0.00 C ATOM 6 CG PRO A 1 23.742 -29.157 -46.787 1.00 0.00 C ATOM 7 CD PRO A 1 24.956 -28.332 -47.219 1.00 0.00 C ATOM 0 H2 PRO A 1 25.013 -26.436 -46.420 1.00 0.00 H new ATOM 0 H3 PRO A 1 24.816 -26.453 -48.048 1.00 0.00 H new ATOM 0 HA PRO A 1 22.621 -26.163 -47.729 1.00 0.00 H new ATOM 0 HB2 PRO A 1 21.685 -28.458 -46.559 1.00 0.00 H new ATOM 0 HB3 PRO A 1 22.248 -28.455 -48.219 1.00 0.00 H new ATOM 0 HG2 PRO A 1 23.751 -29.356 -45.715 1.00 0.00 H new ATOM 0 HG3 PRO A 1 23.712 -30.123 -47.291 1.00 0.00 H new ATOM 0 HD2 PRO A 1 25.799 -28.504 -46.550 1.00 0.00 H new ATOM 0 HD3 PRO A 1 25.280 -28.616 -48.220 1.00 0.00 H new ATOM 15 N ALA A 2 22.044 -25.143 -45.555 1.00 0.00 N ATOM 16 CA ALA A 2 21.652 -24.545 -44.285 1.00 0.00 C ATOM 17 C ALA A 2 20.586 -25.447 -43.655 1.00 0.00 C ATOM 18 O ALA A 2 19.601 -25.773 -44.316 1.00 0.00 O ATOM 19 CB ALA A 2 21.111 -23.130 -44.518 1.00 0.00 C ATOM 0 H ALA A 2 21.741 -24.617 -46.374 1.00 0.00 H new ATOM 0 HA ALA A 2 22.507 -24.462 -43.614 1.00 0.00 H new ATOM 0 HB1 ALA A 2 20.820 -22.690 -43.564 1.00 0.00 H new ATOM 0 HB2 ALA A 2 21.884 -22.516 -44.980 1.00 0.00 H new ATOM 0 HB3 ALA A 2 20.243 -23.176 -45.176 1.00 0.00 H new ATOM 25 N ALA A 3 20.819 -25.895 -42.425 1.00 0.00 N ATOM 26 CA ALA A 3 19.944 -26.752 -41.638 1.00 0.00 C ATOM 27 C ALA A 3 20.339 -26.581 -40.166 1.00 0.00 C ATOM 28 O ALA A 3 21.254 -25.810 -39.877 1.00 0.00 O ATOM 29 CB ALA A 3 20.107 -28.214 -42.086 1.00 0.00 C ATOM 0 H ALA A 3 21.674 -25.654 -41.923 1.00 0.00 H new ATOM 0 HA ALA A 3 18.898 -26.480 -41.777 1.00 0.00 H new ATOM 0 HB1 ALA A 3 19.450 -28.851 -41.494 1.00 0.00 H new ATOM 0 HB2 ALA A 3 19.845 -28.303 -43.140 1.00 0.00 H new ATOM 0 HB3 ALA A 3 21.141 -28.526 -41.942 1.00 0.00 H new ATOM 35 N SER A 4 19.626 -27.271 -39.271 1.00 0.00 N ATOM 36 CA SER A 4 19.789 -27.317 -37.815 1.00 0.00 C ATOM 37 C SER A 4 20.467 -26.076 -37.198 1.00 0.00 C ATOM 38 O SER A 4 21.617 -26.165 -36.761 1.00 0.00 O ATOM 39 CB SER A 4 20.532 -28.613 -37.469 1.00 0.00 C ATOM 40 OG SER A 4 19.875 -29.724 -38.066 1.00 0.00 O ATOM 0 H SER A 4 18.853 -27.863 -39.573 1.00 0.00 H new ATOM 0 HA SER A 4 18.796 -27.305 -37.366 1.00 0.00 H new ATOM 0 HB2 SER A 4 21.562 -28.557 -37.821 1.00 0.00 H new ATOM 0 HB3 SER A 4 20.572 -28.742 -36.387 1.00 0.00 H new ATOM 0 HG SER A 4 20.356 -30.548 -37.842 1.00 0.00 H new ATOM 46 N PRO A 5 19.783 -24.917 -37.159 1.00 0.00 N ATOM 47 CA PRO A 5 20.354 -23.706 -36.590 1.00 0.00 C ATOM 48 C PRO A 5 20.534 -23.857 -35.075 1.00 0.00 C ATOM 49 O PRO A 5 19.780 -24.570 -34.408 1.00 0.00 O ATOM 50 CB PRO A 5 19.372 -22.586 -36.946 1.00 0.00 C ATOM 51 CG PRO A 5 18.034 -23.314 -37.063 1.00 0.00 C ATOM 52 CD PRO A 5 18.430 -24.675 -37.632 1.00 0.00 C ATOM 0 HA PRO A 5 21.347 -23.490 -36.985 1.00 0.00 H new ATOM 0 HB2 PRO A 5 19.344 -21.816 -36.175 1.00 0.00 H new ATOM 0 HB3 PRO A 5 19.645 -22.094 -37.879 1.00 0.00 H new ATOM 0 HG2 PRO A 5 17.541 -23.409 -36.096 1.00 0.00 H new ATOM 0 HG3 PRO A 5 17.344 -22.787 -37.722 1.00 0.00 H new ATOM 0 HD2 PRO A 5 17.750 -25.456 -37.291 1.00 0.00 H new ATOM 0 HD3 PRO A 5 18.390 -24.671 -38.721 1.00 0.00 H new ATOM 60 N SER A 6 21.537 -23.170 -34.534 1.00 0.00 N ATOM 61 CA SER A 6 21.866 -23.174 -33.122 1.00 0.00 C ATOM 62 C SER A 6 20.742 -22.498 -32.327 1.00 0.00 C ATOM 63 O SER A 6 20.270 -21.420 -32.691 1.00 0.00 O ATOM 64 CB SER A 6 23.227 -22.482 -32.905 1.00 0.00 C ATOM 65 OG SER A 6 23.664 -21.732 -34.034 1.00 0.00 O ATOM 0 H SER A 6 22.158 -22.580 -35.087 1.00 0.00 H new ATOM 0 HA SER A 6 21.955 -24.198 -32.760 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.156 -21.819 -32.043 1.00 0.00 H new ATOM 0 HB3 SER A 6 23.977 -23.237 -32.667 1.00 0.00 H new ATOM 0 HG SER A 6 24.529 -21.317 -33.836 1.00 0.00 H new ATOM 71 N ALA A 7 20.308 -23.134 -31.239 1.00 0.00 N ATOM 72 CA ALA A 7 19.263 -22.654 -30.347 1.00 0.00 C ATOM 73 C ALA A 7 19.561 -23.169 -28.936 1.00 0.00 C ATOM 74 O ALA A 7 20.475 -23.972 -28.744 1.00 0.00 O ATOM 75 CB ALA A 7 17.897 -23.152 -30.842 1.00 0.00 C ATOM 0 H ALA A 7 20.692 -24.033 -30.947 1.00 0.00 H new ATOM 0 HA ALA A 7 19.237 -21.564 -30.332 1.00 0.00 H new ATOM 0 HB1 ALA A 7 17.115 -22.792 -30.174 1.00 0.00 H new ATOM 0 HB2 ALA A 7 17.716 -22.776 -31.849 1.00 0.00 H new ATOM 0 HB3 ALA A 7 17.890 -24.242 -30.855 1.00 0.00 H new ATOM 81 N LEU A 8 18.805 -22.698 -27.943 1.00 0.00 N ATOM 82 CA LEU A 8 18.934 -23.086 -26.540 1.00 0.00 C ATOM 83 C LEU A 8 17.543 -23.190 -25.922 1.00 0.00 C ATOM 84 O LEU A 8 16.559 -22.760 -26.534 1.00 0.00 O ATOM 85 CB LEU A 8 19.870 -22.124 -25.778 1.00 0.00 C ATOM 86 CG LEU A 8 19.424 -20.647 -25.661 1.00 0.00 C ATOM 87 CD1 LEU A 8 18.354 -20.400 -24.585 1.00 0.00 C ATOM 88 CD2 LEU A 8 20.647 -19.789 -25.313 1.00 0.00 C ATOM 0 H LEU A 8 18.064 -22.015 -28.099 1.00 0.00 H new ATOM 0 HA LEU A 8 19.404 -24.067 -26.467 1.00 0.00 H new ATOM 0 HB2 LEU A 8 20.009 -22.516 -24.770 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.845 -22.145 -26.265 1.00 0.00 H new ATOM 0 HG LEU A 8 18.984 -20.382 -26.622 1.00 0.00 H new ATOM 0 HD11 LEU A 8 18.095 -19.341 -24.566 1.00 0.00 H new ATOM 0 HD12 LEU A 8 17.465 -20.987 -24.815 1.00 0.00 H new ATOM 0 HD13 LEU A 8 18.743 -20.696 -23.611 1.00 0.00 H new ATOM 0 HD21 LEU A 8 20.346 -18.745 -25.228 1.00 0.00 H new ATOM 0 HD22 LEU A 8 21.069 -20.124 -24.365 1.00 0.00 H new ATOM 0 HD23 LEU A 8 21.396 -19.888 -26.099 1.00 0.00 H new ATOM 100 N LYS A 9 17.453 -23.784 -24.730 1.00 0.00 N ATOM 101 CA LYS A 9 16.221 -23.983 -23.969 1.00 0.00 C ATOM 102 C LYS A 9 16.516 -23.819 -22.479 1.00 0.00 C ATOM 103 O LYS A 9 17.678 -23.651 -22.106 1.00 0.00 O ATOM 104 CB LYS A 9 15.614 -25.363 -24.297 1.00 0.00 C ATOM 105 CG LYS A 9 15.008 -25.345 -25.706 1.00 0.00 C ATOM 106 CD LYS A 9 13.949 -26.420 -25.936 1.00 0.00 C ATOM 107 CE LYS A 9 13.149 -26.023 -27.182 1.00 0.00 C ATOM 108 NZ LYS A 9 11.862 -26.734 -27.235 1.00 0.00 N ATOM 0 H LYS A 9 18.273 -24.155 -24.250 1.00 0.00 H new ATOM 0 HA LYS A 9 15.481 -23.233 -24.248 1.00 0.00 H new ATOM 0 HB2 LYS A 9 16.383 -26.133 -24.232 1.00 0.00 H new ATOM 0 HB3 LYS A 9 14.847 -25.616 -23.565 1.00 0.00 H new ATOM 0 HG2 LYS A 9 14.564 -24.366 -25.888 1.00 0.00 H new ATOM 0 HG3 LYS A 9 15.807 -25.473 -26.436 1.00 0.00 H new ATOM 0 HD2 LYS A 9 14.417 -27.395 -26.076 1.00 0.00 H new ATOM 0 HD3 LYS A 9 13.293 -26.503 -25.070 1.00 0.00 H new ATOM 0 HE2 LYS A 9 12.974 -24.947 -27.178 1.00 0.00 H new ATOM 0 HE3 LYS A 9 13.729 -26.248 -28.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.341 -26.446 -28.088 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 12.033 -27.759 -27.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 11.301 -26.499 -26.391 1.00 0.00 H new ATOM 122 N GLY A 10 15.486 -23.901 -21.634 1.00 0.00 N ATOM 123 CA GLY A 10 15.596 -23.755 -20.194 1.00 0.00 C ATOM 124 C GLY A 10 14.973 -22.419 -19.834 1.00 0.00 C ATOM 125 O GLY A 10 15.242 -21.400 -20.486 1.00 0.00 O ATOM 0 H GLY A 10 14.531 -24.075 -21.947 1.00 0.00 H new ATOM 0 HA2 GLY A 10 15.083 -24.570 -19.684 1.00 0.00 H new ATOM 0 HA3 GLY A 10 16.640 -23.790 -19.881 1.00 0.00 H new ATOM 129 N VAL A 11 14.152 -22.402 -18.790 1.00 0.00 N ATOM 130 CA VAL A 11 13.444 -21.232 -18.305 1.00 0.00 C ATOM 131 C VAL A 11 13.601 -21.214 -16.786 1.00 0.00 C ATOM 132 O VAL A 11 12.774 -21.753 -16.044 1.00 0.00 O ATOM 133 CB VAL A 11 11.980 -21.287 -18.797 1.00 0.00 C ATOM 134 CG1 VAL A 11 11.184 -20.053 -18.351 1.00 0.00 C ATOM 135 CG2 VAL A 11 11.862 -21.420 -20.320 1.00 0.00 C ATOM 0 H VAL A 11 13.956 -23.238 -18.239 1.00 0.00 H new ATOM 0 HA VAL A 11 13.846 -20.295 -18.691 1.00 0.00 H new ATOM 0 HB VAL A 11 11.561 -22.183 -18.339 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.160 -20.129 -18.716 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.178 -19.998 -17.262 1.00 0.00 H new ATOM 0 HG13 VAL A 11 11.648 -19.154 -18.757 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.810 -21.453 -20.602 1.00 0.00 H new ATOM 0 HG22 VAL A 11 12.339 -20.564 -20.798 1.00 0.00 H new ATOM 0 HG23 VAL A 11 12.354 -22.337 -20.644 1.00 0.00 H new ATOM 145 N SER A 12 14.658 -20.553 -16.317 1.00 0.00 N ATOM 146 CA SER A 12 15.011 -20.419 -14.910 1.00 0.00 C ATOM 147 C SER A 12 14.096 -19.468 -14.108 1.00 0.00 C ATOM 148 O SER A 12 14.558 -18.844 -13.155 1.00 0.00 O ATOM 149 CB SER A 12 16.504 -20.058 -14.816 1.00 0.00 C ATOM 150 OG SER A 12 16.940 -19.081 -15.764 1.00 0.00 O ATOM 0 H SER A 12 15.317 -20.078 -16.934 1.00 0.00 H new ATOM 0 HA SER A 12 14.840 -21.379 -14.422 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.713 -19.689 -13.812 1.00 0.00 H new ATOM 0 HB3 SER A 12 17.093 -20.965 -14.951 1.00 0.00 H new ATOM 0 HG SER A 12 17.896 -18.906 -15.638 1.00 0.00 H new ATOM 156 N GLN A 13 12.824 -19.327 -14.487 1.00 0.00 N ATOM 157 CA GLN A 13 11.861 -18.452 -13.818 1.00 0.00 C ATOM 158 C GLN A 13 11.623 -18.930 -12.380 1.00 0.00 C ATOM 159 O GLN A 13 12.005 -18.251 -11.427 1.00 0.00 O ATOM 160 CB GLN A 13 10.589 -18.280 -14.677 1.00 0.00 C ATOM 161 CG GLN A 13 9.736 -19.546 -14.894 1.00 0.00 C ATOM 162 CD GLN A 13 8.693 -19.418 -16.007 1.00 0.00 C ATOM 163 OE1 GLN A 13 8.519 -18.374 -16.637 1.00 0.00 O ATOM 164 NE2 GLN A 13 8.006 -20.510 -16.286 1.00 0.00 N ATOM 0 H GLN A 13 12.428 -19.828 -15.283 1.00 0.00 H new ATOM 0 HA GLN A 13 12.266 -17.444 -13.722 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.962 -17.520 -14.211 1.00 0.00 H new ATOM 0 HB3 GLN A 13 10.884 -17.895 -15.653 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.398 -20.381 -15.126 1.00 0.00 H new ATOM 0 HG3 GLN A 13 9.228 -19.792 -13.962 1.00 0.00 H new ATOM 0 HE21 GLN A 13 8.166 -21.364 -15.751 1.00 0.00 H new ATOM 0 HE22 GLN A 13 7.315 -20.500 -17.036 1.00 0.00 H new ATOM 173 N ALA A 14 11.124 -20.162 -12.216 1.00 0.00 N ATOM 174 CA ALA A 14 10.856 -20.760 -10.910 1.00 0.00 C ATOM 175 C ALA A 14 12.157 -20.992 -10.128 1.00 0.00 C ATOM 176 O ALA A 14 12.136 -21.324 -8.942 1.00 0.00 O ATOM 177 CB ALA A 14 10.103 -22.078 -11.110 1.00 0.00 C ATOM 0 H ALA A 14 10.894 -20.775 -12.998 1.00 0.00 H new ATOM 0 HA ALA A 14 10.243 -20.075 -10.324 1.00 0.00 H new ATOM 0 HB1 ALA A 14 9.899 -22.531 -10.140 1.00 0.00 H new ATOM 0 HB2 ALA A 14 9.162 -21.885 -11.626 1.00 0.00 H new ATOM 0 HB3 ALA A 14 10.711 -22.757 -11.707 1.00 0.00 H new ATOM 183 N LEU A 15 13.300 -20.888 -10.803 1.00 0.00 N ATOM 184 CA LEU A 15 14.630 -21.049 -10.249 1.00 0.00 C ATOM 185 C LEU A 15 14.948 -19.815 -9.408 1.00 0.00 C ATOM 186 O LEU A 15 15.332 -19.932 -8.248 1.00 0.00 O ATOM 187 CB LEU A 15 15.624 -21.206 -11.422 1.00 0.00 C ATOM 188 CG LEU A 15 16.733 -22.245 -11.244 1.00 0.00 C ATOM 189 CD1 LEU A 15 17.531 -21.988 -9.968 1.00 0.00 C ATOM 190 CD2 LEU A 15 16.141 -23.655 -11.313 1.00 0.00 C ATOM 0 H LEU A 15 13.317 -20.678 -11.801 1.00 0.00 H new ATOM 0 HA LEU A 15 14.701 -21.931 -9.612 1.00 0.00 H new ATOM 0 HB2 LEU A 15 15.057 -21.462 -12.317 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.090 -20.238 -11.606 1.00 0.00 H new ATOM 0 HG LEU A 15 17.448 -22.156 -12.062 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.312 -22.742 -9.869 1.00 0.00 H new ATOM 0 HD12 LEU A 15 17.986 -20.999 -10.017 1.00 0.00 H new ATOM 0 HD13 LEU A 15 16.866 -22.039 -9.106 1.00 0.00 H new ATOM 0 HD21 LEU A 15 16.936 -24.390 -11.186 1.00 0.00 H new ATOM 0 HD22 LEU A 15 15.402 -23.779 -10.521 1.00 0.00 H new ATOM 0 HD23 LEU A 15 15.663 -23.802 -12.281 1.00 0.00 H new ATOM 202 N LEU A 16 14.759 -18.629 -9.992 1.00 0.00 N ATOM 203 CA LEU A 16 15.017 -17.329 -9.384 1.00 0.00 C ATOM 204 C LEU A 16 14.152 -17.025 -8.166 1.00 0.00 C ATOM 205 O LEU A 16 14.597 -16.227 -7.350 1.00 0.00 O ATOM 206 CB LEU A 16 14.875 -16.237 -10.456 1.00 0.00 C ATOM 207 CG LEU A 16 16.021 -16.248 -11.488 1.00 0.00 C ATOM 208 CD1 LEU A 16 15.634 -15.431 -12.720 1.00 0.00 C ATOM 209 CD2 LEU A 16 17.332 -15.684 -10.932 1.00 0.00 C ATOM 0 H LEU A 16 14.406 -18.550 -10.945 1.00 0.00 H new ATOM 0 HA LEU A 16 16.037 -17.351 -8.999 1.00 0.00 H new ATOM 0 HB2 LEU A 16 13.926 -16.368 -10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 16 14.841 -15.262 -9.970 1.00 0.00 H new ATOM 0 HG LEU A 16 16.182 -17.294 -11.748 1.00 0.00 H new ATOM 0 HD11 LEU A 16 16.453 -15.448 -13.440 1.00 0.00 H new ATOM 0 HD12 LEU A 16 14.742 -15.860 -13.175 1.00 0.00 H new ATOM 0 HD13 LEU A 16 15.431 -14.401 -12.425 1.00 0.00 H new ATOM 0 HD21 LEU A 16 18.100 -15.718 -11.705 1.00 0.00 H new ATOM 0 HD22 LEU A 16 17.180 -14.651 -10.618 1.00 0.00 H new ATOM 0 HD23 LEU A 16 17.651 -16.280 -10.077 1.00 0.00 H new ATOM 221 N GLU A 17 13.015 -17.700 -7.957 1.00 0.00 N ATOM 222 CA GLU A 17 12.116 -17.473 -6.809 1.00 0.00 C ATOM 223 C GLU A 17 12.805 -17.645 -5.437 1.00 0.00 C ATOM 224 O GLU A 17 12.198 -17.374 -4.396 1.00 0.00 O ATOM 225 CB GLU A 17 10.887 -18.390 -6.897 1.00 0.00 C ATOM 226 CG GLU A 17 9.894 -18.037 -8.013 1.00 0.00 C ATOM 227 CD GLU A 17 9.173 -16.697 -7.807 1.00 0.00 C ATOM 228 OE1 GLU A 17 8.653 -16.429 -6.700 1.00 0.00 O ATOM 229 OE2 GLU A 17 9.084 -15.917 -8.783 1.00 0.00 O ATOM 0 H GLU A 17 12.685 -18.431 -8.587 1.00 0.00 H new ATOM 0 HA GLU A 17 11.807 -16.430 -6.873 1.00 0.00 H new ATOM 0 HB2 GLU A 17 11.227 -19.415 -7.044 1.00 0.00 H new ATOM 0 HB3 GLU A 17 10.362 -18.362 -5.942 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.427 -18.009 -8.964 1.00 0.00 H new ATOM 0 HG3 GLU A 17 9.150 -18.830 -8.088 1.00 0.00 H new ATOM 236 N ARG A 18 14.041 -18.160 -5.386 1.00 0.00 N ATOM 237 CA ARG A 18 14.762 -18.294 -4.119 1.00 0.00 C ATOM 238 C ARG A 18 15.222 -16.910 -3.639 1.00 0.00 C ATOM 239 O ARG A 18 15.489 -16.723 -2.453 1.00 0.00 O ATOM 240 CB ARG A 18 15.964 -19.268 -4.224 1.00 0.00 C ATOM 241 CG ARG A 18 17.311 -18.717 -4.752 1.00 0.00 C ATOM 242 CD ARG A 18 17.440 -18.662 -6.280 1.00 0.00 C ATOM 243 NE ARG A 18 17.736 -19.992 -6.824 1.00 0.00 N ATOM 244 CZ ARG A 18 18.929 -20.590 -6.911 1.00 0.00 C ATOM 245 NH1 ARG A 18 20.054 -19.891 -6.792 1.00 0.00 N ATOM 246 NH2 ARG A 18 18.963 -21.899 -7.113 1.00 0.00 N ATOM 0 H ARG A 18 14.557 -18.488 -6.203 1.00 0.00 H new ATOM 0 HA ARG A 18 14.077 -18.723 -3.388 1.00 0.00 H new ATOM 0 HB2 ARG A 18 16.141 -19.686 -3.233 1.00 0.00 H new ATOM 0 HB3 ARG A 18 15.667 -20.094 -4.870 1.00 0.00 H new ATOM 0 HG2 ARG A 18 17.455 -17.712 -4.355 1.00 0.00 H new ATOM 0 HG3 ARG A 18 18.118 -19.335 -4.357 1.00 0.00 H new ATOM 0 HD2 ARG A 18 16.515 -18.284 -6.715 1.00 0.00 H new ATOM 0 HD3 ARG A 18 18.231 -17.966 -6.558 1.00 0.00 H new ATOM 0 HE ARG A 18 16.939 -20.522 -7.177 1.00 0.00 H new ATOM 0 HH11 ARG A 18 20.014 -18.884 -6.632 1.00 0.00 H new ATOM 0 HH12 ARG A 18 20.956 -20.361 -6.861 1.00 0.00 H new ATOM 0 HH21 ARG A 18 18.093 -22.425 -7.198 1.00 0.00 H new ATOM 0 HH22 ARG A 18 19.859 -22.381 -7.183 1.00 0.00 H new ATOM 260 N ILE A 19 15.366 -15.946 -4.557 1.00 0.00 N ATOM 261 CA ILE A 19 15.831 -14.596 -4.276 1.00 0.00 C ATOM 262 C ILE A 19 15.034 -13.937 -3.158 1.00 0.00 C ATOM 263 O ILE A 19 15.668 -13.304 -2.317 1.00 0.00 O ATOM 264 CB ILE A 19 15.964 -13.772 -5.574 1.00 0.00 C ATOM 265 CG1 ILE A 19 17.080 -14.380 -6.451 1.00 0.00 C ATOM 266 CG2 ILE A 19 16.328 -12.306 -5.261 1.00 0.00 C ATOM 267 CD1 ILE A 19 17.013 -13.935 -7.903 1.00 0.00 C ATOM 0 H ILE A 19 15.154 -16.096 -5.543 1.00 0.00 H new ATOM 0 HA ILE A 19 16.843 -14.648 -3.875 1.00 0.00 H new ATOM 0 HB ILE A 19 15.007 -13.797 -6.096 1.00 0.00 H new ATOM 0 HG12 ILE A 19 18.049 -14.102 -6.037 1.00 0.00 H new ATOM 0 HG13 ILE A 19 17.015 -15.467 -6.408 1.00 0.00 H new ATOM 0 HG21 ILE A 19 16.416 -11.746 -6.192 1.00 0.00 H new ATOM 0 HG22 ILE A 19 15.548 -11.862 -4.643 1.00 0.00 H new ATOM 0 HG23 ILE A 19 17.277 -12.273 -4.727 1.00 0.00 H new ATOM 0 HD11 ILE A 19 17.825 -14.398 -8.463 1.00 0.00 H new ATOM 0 HD12 ILE A 19 16.058 -14.237 -8.332 1.00 0.00 H new ATOM 0 HD13 ILE A 19 17.108 -12.850 -7.956 1.00 0.00 H new ATOM 279 N ARG A 20 13.718 -14.156 -3.052 1.00 0.00 N ATOM 280 CA ARG A 20 12.914 -13.567 -1.979 1.00 0.00 C ATOM 281 C ARG A 20 13.550 -13.863 -0.616 1.00 0.00 C ATOM 282 O ARG A 20 13.674 -12.972 0.216 1.00 0.00 O ATOM 283 CB ARG A 20 11.443 -14.021 -2.093 1.00 0.00 C ATOM 284 CG ARG A 20 11.199 -15.533 -1.899 1.00 0.00 C ATOM 285 CD ARG A 20 10.635 -15.885 -0.513 1.00 0.00 C ATOM 286 NE ARG A 20 9.182 -15.671 -0.472 1.00 0.00 N ATOM 287 CZ ARG A 20 8.328 -16.064 0.479 1.00 0.00 C ATOM 288 NH1 ARG A 20 8.760 -16.525 1.651 1.00 0.00 N ATOM 289 NH2 ARG A 20 7.030 -15.993 0.227 1.00 0.00 N ATOM 0 H ARG A 20 13.188 -14.739 -3.699 1.00 0.00 H new ATOM 0 HA ARG A 20 12.901 -12.482 -2.080 1.00 0.00 H new ATOM 0 HB2 ARG A 20 10.855 -13.478 -1.354 1.00 0.00 H new ATOM 0 HB3 ARG A 20 11.067 -13.733 -3.074 1.00 0.00 H new ATOM 0 HG2 ARG A 20 10.507 -15.884 -2.665 1.00 0.00 H new ATOM 0 HG3 ARG A 20 12.137 -16.067 -2.048 1.00 0.00 H new ATOM 0 HD2 ARG A 20 10.861 -16.925 -0.277 1.00 0.00 H new ATOM 0 HD3 ARG A 20 11.119 -15.273 0.248 1.00 0.00 H new ATOM 0 HE ARG A 20 8.778 -15.164 -1.260 1.00 0.00 H new ATOM 0 HH11 ARG A 20 9.761 -16.584 1.838 1.00 0.00 H new ATOM 0 HH12 ARG A 20 8.090 -16.819 2.362 1.00 0.00 H new ATOM 0 HH21 ARG A 20 6.704 -15.645 -0.675 1.00 0.00 H new ATOM 0 HH22 ARG A 20 6.356 -16.286 0.935 1.00 0.00 H new ATOM 303 N ALA A 21 13.991 -15.101 -0.379 1.00 0.00 N ATOM 304 CA ALA A 21 14.620 -15.475 0.877 1.00 0.00 C ATOM 305 C ALA A 21 16.059 -14.937 0.937 1.00 0.00 C ATOM 306 O ALA A 21 16.519 -14.543 2.014 1.00 0.00 O ATOM 307 CB ALA A 21 14.556 -16.991 1.040 1.00 0.00 C ATOM 0 H ALA A 21 13.920 -15.864 -1.052 1.00 0.00 H new ATOM 0 HA ALA A 21 14.083 -15.026 1.713 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.027 -17.276 1.981 1.00 0.00 H new ATOM 0 HB2 ALA A 21 13.515 -17.313 1.043 1.00 0.00 H new ATOM 0 HB3 ALA A 21 15.081 -17.468 0.213 1.00 0.00 H new ATOM 313 N LYS A 22 16.787 -14.902 -0.191 1.00 0.00 N ATOM 314 CA LYS A 22 18.162 -14.383 -0.241 1.00 0.00 C ATOM 315 C LYS A 22 18.210 -12.901 0.120 1.00 0.00 C ATOM 316 O LYS A 22 19.208 -12.422 0.660 1.00 0.00 O ATOM 317 CB LYS A 22 18.795 -14.545 -1.619 1.00 0.00 C ATOM 318 CG LYS A 22 19.030 -16.006 -2.026 1.00 0.00 C ATOM 319 CD LYS A 22 20.066 -16.054 -3.152 1.00 0.00 C ATOM 320 CE LYS A 22 19.522 -15.469 -4.463 1.00 0.00 C ATOM 321 NZ LYS A 22 20.588 -14.992 -5.367 1.00 0.00 N ATOM 0 H LYS A 22 16.439 -15.232 -1.091 1.00 0.00 H new ATOM 0 HA LYS A 22 18.723 -14.971 0.486 1.00 0.00 H new ATOM 0 HB2 LYS A 22 18.154 -14.070 -2.361 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.748 -14.016 -1.635 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.379 -16.583 -1.170 1.00 0.00 H new ATOM 0 HG3 LYS A 22 18.095 -16.459 -2.356 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.955 -15.500 -2.850 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.374 -17.086 -3.317 1.00 0.00 H new ATOM 0 HE2 LYS A 22 18.931 -16.228 -4.976 1.00 0.00 H new ATOM 0 HE3 LYS A 22 18.850 -14.642 -4.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 20.162 -14.608 -6.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 21.138 -14.247 -4.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 21.216 -15.784 -5.611 1.00 0.00 H new ATOM 335 N GLU A 23 17.165 -12.148 -0.207 1.00 0.00 N ATOM 336 CA GLU A 23 17.116 -10.736 0.142 1.00 0.00 C ATOM 337 C GLU A 23 16.657 -10.601 1.601 1.00 0.00 C ATOM 338 O GLU A 23 17.212 -9.776 2.319 1.00 0.00 O ATOM 339 CB GLU A 23 16.333 -9.879 -0.867 1.00 0.00 C ATOM 340 CG GLU A 23 14.821 -10.106 -0.939 1.00 0.00 C ATOM 341 CD GLU A 23 14.145 -9.098 -1.875 1.00 0.00 C ATOM 342 OE1 GLU A 23 14.250 -7.870 -1.645 1.00 0.00 O ATOM 343 OE2 GLU A 23 13.408 -9.523 -2.799 1.00 0.00 O ATOM 0 H GLU A 23 16.346 -12.491 -0.710 1.00 0.00 H new ATOM 0 HA GLU A 23 18.119 -10.315 0.072 1.00 0.00 H new ATOM 0 HB2 GLU A 23 16.508 -8.830 -0.629 1.00 0.00 H new ATOM 0 HB3 GLU A 23 16.750 -10.055 -1.858 1.00 0.00 H new ATOM 0 HG2 GLU A 23 14.620 -11.119 -1.288 1.00 0.00 H new ATOM 0 HG3 GLU A 23 14.392 -10.022 0.059 1.00 0.00 H new ATOM 350 N VAL A 24 15.747 -11.449 2.099 1.00 0.00 N ATOM 351 CA VAL A 24 15.250 -11.384 3.477 1.00 0.00 C ATOM 352 C VAL A 24 16.369 -11.463 4.511 1.00 0.00 C ATOM 353 O VAL A 24 16.480 -10.589 5.365 1.00 0.00 O ATOM 354 CB VAL A 24 14.095 -12.393 3.670 1.00 0.00 C ATOM 355 CG1 VAL A 24 13.775 -12.745 5.129 1.00 0.00 C ATOM 356 CG2 VAL A 24 12.818 -11.822 3.037 1.00 0.00 C ATOM 0 H VAL A 24 15.333 -12.204 1.552 1.00 0.00 H new ATOM 0 HA VAL A 24 14.822 -10.398 3.658 1.00 0.00 H new ATOM 0 HB VAL A 24 14.434 -13.312 3.192 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.952 -13.459 5.159 1.00 0.00 H new ATOM 0 HG12 VAL A 24 14.655 -13.186 5.598 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.491 -11.841 5.668 1.00 0.00 H new ATOM 0 HG21 VAL A 24 11.999 -12.529 3.169 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.564 -10.878 3.519 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.983 -11.654 1.973 1.00 0.00 H new ATOM 366 N GLN A 25 17.256 -12.448 4.413 1.00 0.00 N ATOM 367 CA GLN A 25 18.387 -12.601 5.336 1.00 0.00 C ATOM 368 C GLN A 25 19.316 -11.369 5.367 1.00 0.00 C ATOM 369 O GLN A 25 20.181 -11.263 6.242 1.00 0.00 O ATOM 370 CB GLN A 25 19.164 -13.858 4.938 1.00 0.00 C ATOM 371 CG GLN A 25 19.659 -13.784 3.484 1.00 0.00 C ATOM 372 CD GLN A 25 21.170 -13.572 3.392 1.00 0.00 C ATOM 373 OE1 GLN A 25 21.647 -12.484 3.073 1.00 0.00 O ATOM 374 NE2 GLN A 25 21.966 -14.575 3.716 1.00 0.00 N ATOM 0 H GLN A 25 17.215 -13.167 3.691 1.00 0.00 H new ATOM 0 HA GLN A 25 17.992 -12.696 6.348 1.00 0.00 H new ATOM 0 HB2 GLN A 25 20.016 -13.986 5.606 1.00 0.00 H new ATOM 0 HB3 GLN A 25 18.527 -14.734 5.061 1.00 0.00 H new ATOM 0 HG2 GLN A 25 19.392 -14.705 2.965 1.00 0.00 H new ATOM 0 HG3 GLN A 25 19.149 -12.969 2.971 1.00 0.00 H new ATOM 0 HE21 GLN A 25 21.569 -15.477 3.980 1.00 0.00 H new ATOM 0 HE22 GLN A 25 22.978 -14.448 3.702 1.00 0.00 H new ATOM 383 N LYS A 26 19.212 -10.479 4.374 1.00 0.00 N ATOM 384 CA LYS A 26 19.976 -9.247 4.259 1.00 0.00 C ATOM 385 C LYS A 26 19.130 -8.132 4.850 1.00 0.00 C ATOM 386 O LYS A 26 19.661 -7.352 5.625 1.00 0.00 O ATOM 387 CB LYS A 26 20.386 -9.014 2.804 1.00 0.00 C ATOM 388 CG LYS A 26 21.175 -7.712 2.641 1.00 0.00 C ATOM 389 CD LYS A 26 21.769 -7.631 1.233 1.00 0.00 C ATOM 390 CE LYS A 26 22.930 -8.605 1.002 1.00 0.00 C ATOM 391 NZ LYS A 26 24.090 -8.311 1.866 1.00 0.00 N ATOM 0 H LYS A 26 18.563 -10.610 3.598 1.00 0.00 H new ATOM 0 HA LYS A 26 20.913 -9.292 4.815 1.00 0.00 H new ATOM 0 HB2 LYS A 26 20.991 -9.852 2.457 1.00 0.00 H new ATOM 0 HB3 LYS A 26 19.496 -8.982 2.176 1.00 0.00 H new ATOM 0 HG2 LYS A 26 20.522 -6.857 2.819 1.00 0.00 H new ATOM 0 HG3 LYS A 26 21.971 -7.665 3.384 1.00 0.00 H new ATOM 0 HD2 LYS A 26 20.984 -7.834 0.504 1.00 0.00 H new ATOM 0 HD3 LYS A 26 22.117 -6.614 1.052 1.00 0.00 H new ATOM 0 HE2 LYS A 26 22.589 -9.623 1.189 1.00 0.00 H new ATOM 0 HE3 LYS A 26 23.237 -8.559 -0.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 24.913 -8.855 1.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 24.307 -7.295 1.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 23.868 -8.575 2.847 1.00 0.00 H new ATOM 405 N GLN A 27 17.836 -8.081 4.528 1.00 0.00 N ATOM 406 CA GLN A 27 16.891 -7.093 5.045 1.00 0.00 C ATOM 407 C GLN A 27 16.839 -7.165 6.578 1.00 0.00 C ATOM 408 O GLN A 27 16.571 -6.159 7.231 1.00 0.00 O ATOM 409 CB GLN A 27 15.510 -7.315 4.412 1.00 0.00 C ATOM 410 CG GLN A 27 15.491 -7.052 2.897 1.00 0.00 C ATOM 411 CD GLN A 27 15.366 -5.573 2.559 1.00 0.00 C ATOM 412 OE1 GLN A 27 14.308 -5.130 2.143 1.00 0.00 O ATOM 413 NE2 GLN A 27 16.419 -4.781 2.685 1.00 0.00 N ATOM 0 H GLN A 27 17.406 -8.744 3.883 1.00 0.00 H new ATOM 0 HA GLN A 27 17.223 -6.090 4.776 1.00 0.00 H new ATOM 0 HB2 GLN A 27 15.191 -8.340 4.601 1.00 0.00 H new ATOM 0 HB3 GLN A 27 14.785 -6.661 4.897 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.405 -7.446 2.452 1.00 0.00 H new ATOM 0 HG3 GLN A 27 14.659 -7.595 2.449 1.00 0.00 H new ATOM 0 HE21 GLN A 27 17.301 -5.157 3.033 1.00 0.00 H new ATOM 0 HE22 GLN A 27 16.348 -3.795 2.434 1.00 0.00 H new ATOM 422 N LEU A 28 17.186 -8.324 7.145 1.00 0.00 N ATOM 423 CA LEU A 28 17.252 -8.617 8.569 1.00 0.00 C ATOM 424 C LEU A 28 18.287 -7.718 9.280 1.00 0.00 C ATOM 425 O LEU A 28 18.313 -7.666 10.515 1.00 0.00 O ATOM 426 CB LEU A 28 17.610 -10.111 8.677 1.00 0.00 C ATOM 427 CG LEU A 28 17.509 -10.748 10.071 1.00 0.00 C ATOM 428 CD1 LEU A 28 16.062 -10.783 10.566 1.00 0.00 C ATOM 429 CD2 LEU A 28 18.034 -12.186 10.001 1.00 0.00 C ATOM 0 H LEU A 28 17.444 -9.132 6.579 1.00 0.00 H new ATOM 0 HA LEU A 28 16.303 -8.411 9.065 1.00 0.00 H new ATOM 0 HB2 LEU A 28 16.959 -10.666 8.002 1.00 0.00 H new ATOM 0 HB3 LEU A 28 18.630 -10.243 8.316 1.00 0.00 H new ATOM 0 HG LEU A 28 18.100 -10.148 10.763 1.00 0.00 H new ATOM 0 HD11 LEU A 28 16.027 -11.240 11.555 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.672 -9.767 10.622 1.00 0.00 H new ATOM 0 HD13 LEU A 28 15.455 -11.367 9.875 1.00 0.00 H new ATOM 0 HD21 LEU A 28 17.966 -12.646 10.987 1.00 0.00 H new ATOM 0 HD22 LEU A 28 17.436 -12.758 9.291 1.00 0.00 H new ATOM 0 HD23 LEU A 28 19.074 -12.178 9.675 1.00 0.00 H new ATOM 441 N ALA A 29 19.156 -7.029 8.529 1.00 0.00 N ATOM 442 CA ALA A 29 20.197 -6.116 8.983 1.00 0.00 C ATOM 443 C ALA A 29 20.118 -4.816 8.171 1.00 0.00 C ATOM 444 O ALA A 29 19.807 -4.833 6.975 1.00 0.00 O ATOM 445 CB ALA A 29 21.569 -6.769 8.777 1.00 0.00 C ATOM 0 H ALA A 29 19.143 -7.106 7.512 1.00 0.00 H new ATOM 0 HA ALA A 29 20.057 -5.893 10.041 1.00 0.00 H new ATOM 0 HB1 ALA A 29 22.350 -6.089 9.116 1.00 0.00 H new ATOM 0 HB2 ALA A 29 21.621 -7.695 9.350 1.00 0.00 H new ATOM 0 HB3 ALA A 29 21.712 -6.988 7.719 1.00 0.00 H new ATOM 451 N ARG A 30 20.411 -3.663 8.780 1.00 0.00 N ATOM 452 CA ARG A 30 20.368 -2.398 8.054 1.00 0.00 C ATOM 453 C ARG A 30 21.734 -2.156 7.442 1.00 0.00 C ATOM 454 O ARG A 30 22.691 -1.868 8.162 1.00 0.00 O ATOM 455 CB ARG A 30 19.936 -1.238 8.947 1.00 0.00 C ATOM 456 CG ARG A 30 19.697 0.007 8.075 1.00 0.00 C ATOM 457 CD ARG A 30 19.256 1.207 8.905 1.00 0.00 C ATOM 458 NE ARG A 30 20.362 1.728 9.716 1.00 0.00 N ATOM 459 CZ ARG A 30 21.234 2.668 9.342 1.00 0.00 C ATOM 460 NH1 ARG A 30 21.115 3.314 8.185 1.00 0.00 N ATOM 461 NH2 ARG A 30 22.251 2.950 10.138 1.00 0.00 N ATOM 0 H ARG A 30 20.677 -3.583 9.761 1.00 0.00 H new ATOM 0 HA ARG A 30 19.617 -2.459 7.266 1.00 0.00 H new ATOM 0 HB2 ARG A 30 19.026 -1.498 9.488 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.703 -1.032 9.694 1.00 0.00 H new ATOM 0 HG2 ARG A 30 20.612 0.254 7.537 1.00 0.00 H new ATOM 0 HG3 ARG A 30 18.937 -0.215 7.326 1.00 0.00 H new ATOM 0 HD2 ARG A 30 18.884 1.991 8.246 1.00 0.00 H new ATOM 0 HD3 ARG A 30 18.430 0.919 9.555 1.00 0.00 H new ATOM 0 HE ARG A 30 20.475 1.337 10.651 1.00 0.00 H new ATOM 0 HH11 ARG A 30 20.342 3.096 7.556 1.00 0.00 H new ATOM 0 HH12 ARG A 30 21.797 4.027 7.927 1.00 0.00 H new ATOM 0 HH21 ARG A 30 22.360 2.453 11.022 1.00 0.00 H new ATOM 0 HH22 ARG A 30 22.927 3.665 9.868 1.00 0.00 H new ATOM 475 N MET A 31 21.836 -2.274 6.127 1.00 0.00 N ATOM 476 CA MET A 31 23.044 -2.069 5.348 1.00 0.00 C ATOM 477 C MET A 31 22.668 -1.205 4.144 1.00 0.00 C ATOM 478 O MET A 31 21.488 -0.964 3.893 1.00 0.00 O ATOM 479 CB MET A 31 23.627 -3.440 4.957 1.00 0.00 C ATOM 480 CG MET A 31 24.398 -4.071 6.131 1.00 0.00 C ATOM 481 SD MET A 31 24.199 -5.858 6.401 1.00 0.00 S ATOM 482 CE MET A 31 24.613 -6.539 4.782 1.00 0.00 C ATOM 0 H MET A 31 21.037 -2.528 5.546 1.00 0.00 H new ATOM 0 HA MET A 31 23.822 -1.551 5.909 1.00 0.00 H new ATOM 0 HB2 MET A 31 22.822 -4.106 4.647 1.00 0.00 H new ATOM 0 HB3 MET A 31 24.292 -3.325 4.101 1.00 0.00 H new ATOM 0 HG2 MET A 31 25.459 -3.869 5.984 1.00 0.00 H new ATOM 0 HG3 MET A 31 24.099 -3.557 7.045 1.00 0.00 H new ATOM 0 HE1 MET A 31 24.530 -7.625 4.812 1.00 0.00 H new ATOM 0 HE2 MET A 31 23.926 -6.143 4.034 1.00 0.00 H new ATOM 0 HE3 MET A 31 25.634 -6.260 4.520 1.00 0.00 H new ATOM 492 N THR A 32 23.682 -0.755 3.409 1.00 0.00 N ATOM 493 CA THR A 32 23.605 0.081 2.219 1.00 0.00 C ATOM 494 C THR A 32 22.526 -0.490 1.284 1.00 0.00 C ATOM 495 O THR A 32 22.580 -1.667 0.907 1.00 0.00 O ATOM 496 CB THR A 32 25.040 0.172 1.648 1.00 0.00 C ATOM 497 OG1 THR A 32 25.315 1.380 0.973 1.00 0.00 O ATOM 498 CG2 THR A 32 25.448 -0.999 0.750 1.00 0.00 C ATOM 0 H THR A 32 24.647 -0.983 3.649 1.00 0.00 H new ATOM 0 HA THR A 32 23.283 1.106 2.404 1.00 0.00 H new ATOM 0 HB THR A 32 25.646 0.130 2.553 1.00 0.00 H new ATOM 0 HG1 THR A 32 26.237 1.367 0.642 1.00 0.00 H new ATOM 0 HG21 THR A 32 26.468 -0.848 0.397 1.00 0.00 H new ATOM 0 HG22 THR A 32 25.394 -1.928 1.317 1.00 0.00 H new ATOM 0 HG23 THR A 32 24.773 -1.055 -0.104 1.00 0.00 H new ATOM 506 N ARG A 33 21.517 0.313 0.950 1.00 0.00 N ATOM 507 CA ARG A 33 20.403 -0.080 0.098 1.00 0.00 C ATOM 508 C ARG A 33 20.001 1.107 -0.774 1.00 0.00 C ATOM 509 O ARG A 33 20.214 2.253 -0.377 1.00 0.00 O ATOM 510 CB ARG A 33 19.267 -0.555 1.026 1.00 0.00 C ATOM 511 CG ARG A 33 19.282 -2.061 1.339 1.00 0.00 C ATOM 512 CD ARG A 33 19.094 -2.906 0.074 1.00 0.00 C ATOM 513 NE ARG A 33 18.410 -4.183 0.340 1.00 0.00 N ATOM 514 CZ ARG A 33 18.700 -5.361 -0.221 1.00 0.00 C ATOM 515 NH1 ARG A 33 19.891 -5.586 -0.767 1.00 0.00 N ATOM 516 NH2 ARG A 33 17.781 -6.321 -0.233 1.00 0.00 N ATOM 0 H ARG A 33 21.453 1.278 1.274 1.00 0.00 H new ATOM 0 HA ARG A 33 20.662 -0.894 -0.580 1.00 0.00 H new ATOM 0 HB2 ARG A 33 19.326 -0.002 1.963 1.00 0.00 H new ATOM 0 HB3 ARG A 33 18.311 -0.302 0.567 1.00 0.00 H new ATOM 0 HG2 ARG A 33 20.227 -2.324 1.815 1.00 0.00 H new ATOM 0 HG3 ARG A 33 18.490 -2.292 2.052 1.00 0.00 H new ATOM 0 HD2 ARG A 33 18.520 -2.336 -0.657 1.00 0.00 H new ATOM 0 HD3 ARG A 33 20.068 -3.106 -0.372 1.00 0.00 H new ATOM 0 HE ARG A 33 17.645 -4.167 1.014 1.00 0.00 H new ATOM 0 HH11 ARG A 33 20.601 -4.854 -0.762 1.00 0.00 H new ATOM 0 HH12 ARG A 33 20.095 -6.491 -1.191 1.00 0.00 H new ATOM 0 HH21 ARG A 33 16.865 -6.155 0.183 1.00 0.00 H new ATOM 0 HH22 ARG A 33 17.992 -7.224 -0.659 1.00 0.00 H new ATOM 530 N CYS A 34 19.462 0.814 -1.965 1.00 0.00 N ATOM 531 CA CYS A 34 19.018 1.779 -2.967 1.00 0.00 C ATOM 532 C CYS A 34 17.880 1.167 -3.806 1.00 0.00 C ATOM 533 O CYS A 34 16.758 1.662 -3.692 1.00 0.00 O ATOM 534 CB CYS A 34 20.187 2.259 -3.855 1.00 0.00 C ATOM 535 SG CYS A 34 21.219 3.515 -3.042 1.00 0.00 S ATOM 0 H CYS A 34 19.319 -0.150 -2.266 1.00 0.00 H new ATOM 0 HA CYS A 34 18.637 2.662 -2.455 1.00 0.00 H new ATOM 0 HB2 CYS A 34 20.807 1.404 -4.124 1.00 0.00 H new ATOM 0 HB3 CYS A 34 19.788 2.668 -4.783 1.00 0.00 H new ATOM 0 HG CYS A 34 21.123 3.387 -1.752 1.00 0.00 H new ATOM 541 N PRO A 35 18.093 0.077 -4.584 1.00 0.00 N ATOM 542 CA PRO A 35 17.047 -0.534 -5.410 1.00 0.00 C ATOM 543 C PRO A 35 15.917 -1.133 -4.573 1.00 0.00 C ATOM 544 O PRO A 35 14.865 -1.491 -5.101 1.00 0.00 O ATOM 545 CB PRO A 35 17.738 -1.578 -6.294 1.00 0.00 C ATOM 546 CG PRO A 35 18.964 -1.958 -5.471 1.00 0.00 C ATOM 547 CD PRO A 35 19.341 -0.633 -4.810 1.00 0.00 C ATOM 0 HA PRO A 35 16.558 0.221 -6.025 1.00 0.00 H new ATOM 0 HB2 PRO A 35 17.095 -2.438 -6.483 1.00 0.00 H new ATOM 0 HB3 PRO A 35 18.014 -1.167 -7.265 1.00 0.00 H new ATOM 0 HG2 PRO A 35 18.736 -2.729 -4.735 1.00 0.00 H new ATOM 0 HG3 PRO A 35 19.769 -2.343 -6.096 1.00 0.00 H new ATOM 0 HD2 PRO A 35 19.868 -0.802 -3.871 1.00 0.00 H new ATOM 0 HD3 PRO A 35 20.008 -0.055 -5.450 1.00 0.00 H new ATOM 555 N GLU A 36 16.107 -1.259 -3.257 1.00 0.00 N ATOM 556 CA GLU A 36 15.083 -1.774 -2.367 1.00 0.00 C ATOM 557 C GLU A 36 13.913 -0.769 -2.334 1.00 0.00 C ATOM 558 O GLU A 36 12.819 -1.127 -1.906 1.00 0.00 O ATOM 559 CB GLU A 36 15.720 -2.124 -1.013 1.00 0.00 C ATOM 560 CG GLU A 36 14.739 -2.419 0.130 1.00 0.00 C ATOM 561 CD GLU A 36 14.123 -1.166 0.771 1.00 0.00 C ATOM 562 OE1 GLU A 36 14.658 -0.046 0.572 1.00 0.00 O ATOM 563 OE2 GLU A 36 13.154 -1.281 1.557 1.00 0.00 O ATOM 0 H GLU A 36 16.976 -1.005 -2.787 1.00 0.00 H new ATOM 0 HA GLU A 36 14.648 -2.711 -2.715 1.00 0.00 H new ATOM 0 HB2 GLU A 36 16.362 -2.994 -1.149 1.00 0.00 H new ATOM 0 HB3 GLU A 36 16.363 -1.297 -0.711 1.00 0.00 H new ATOM 0 HG2 GLU A 36 13.936 -3.051 -0.249 1.00 0.00 H new ATOM 0 HG3 GLU A 36 15.257 -2.990 0.900 1.00 0.00 H new ATOM 570 N GLN A 37 14.105 0.475 -2.816 1.00 0.00 N ATOM 571 CA GLN A 37 13.034 1.473 -2.858 1.00 0.00 C ATOM 572 C GLN A 37 11.842 0.932 -3.668 1.00 0.00 C ATOM 573 O GLN A 37 10.714 1.356 -3.425 1.00 0.00 O ATOM 574 CB GLN A 37 13.537 2.826 -3.394 1.00 0.00 C ATOM 575 CG GLN A 37 14.191 3.639 -2.266 1.00 0.00 C ATOM 576 CD GLN A 37 14.836 4.942 -2.739 1.00 0.00 C ATOM 577 OE1 GLN A 37 14.227 5.762 -3.421 1.00 0.00 O ATOM 578 NE2 GLN A 37 16.078 5.197 -2.361 1.00 0.00 N ATOM 0 H GLN A 37 14.998 0.807 -3.181 1.00 0.00 H new ATOM 0 HA GLN A 37 12.692 1.659 -1.840 1.00 0.00 H new ATOM 0 HB2 GLN A 37 14.256 2.662 -4.197 1.00 0.00 H new ATOM 0 HB3 GLN A 37 12.706 3.387 -3.821 1.00 0.00 H new ATOM 0 HG2 GLN A 37 13.437 3.870 -1.513 1.00 0.00 H new ATOM 0 HG3 GLN A 37 14.949 3.025 -1.780 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.588 4.519 -1.795 1.00 0.00 H new ATOM 0 HE22 GLN A 37 16.525 6.071 -2.636 1.00 0.00 H new ATOM 587 N GLU A 38 12.069 -0.040 -4.564 1.00 0.00 N ATOM 588 CA GLU A 38 11.068 -0.704 -5.392 1.00 0.00 C ATOM 589 C GLU A 38 9.923 -1.220 -4.512 1.00 0.00 C ATOM 590 O GLU A 38 8.763 -1.176 -4.907 1.00 0.00 O ATOM 591 CB GLU A 38 11.762 -1.886 -6.081 1.00 0.00 C ATOM 592 CG GLU A 38 10.861 -2.713 -7.008 1.00 0.00 C ATOM 593 CD GLU A 38 11.611 -3.954 -7.488 1.00 0.00 C ATOM 594 OE1 GLU A 38 12.613 -3.807 -8.217 1.00 0.00 O ATOM 595 OE2 GLU A 38 11.245 -5.085 -7.072 1.00 0.00 O ATOM 0 H GLU A 38 13.009 -0.399 -4.735 1.00 0.00 H new ATOM 0 HA GLU A 38 10.653 -0.013 -6.126 1.00 0.00 H new ATOM 0 HB2 GLU A 38 12.604 -1.507 -6.660 1.00 0.00 H new ATOM 0 HB3 GLU A 38 12.172 -2.544 -5.315 1.00 0.00 H new ATOM 0 HG2 GLU A 38 9.953 -3.007 -6.481 1.00 0.00 H new ATOM 0 HG3 GLU A 38 10.552 -2.111 -7.862 1.00 0.00 H new ATOM 602 N LEU A 39 10.230 -1.714 -3.308 1.00 0.00 N ATOM 603 CA LEU A 39 9.243 -2.229 -2.372 1.00 0.00 C ATOM 604 C LEU A 39 8.229 -1.149 -2.031 1.00 0.00 C ATOM 605 O LEU A 39 7.045 -1.459 -1.925 1.00 0.00 O ATOM 606 CB LEU A 39 9.906 -2.714 -1.068 1.00 0.00 C ATOM 607 CG LEU A 39 10.988 -3.791 -1.234 1.00 0.00 C ATOM 608 CD1 LEU A 39 11.469 -4.259 0.134 1.00 0.00 C ATOM 609 CD2 LEU A 39 10.480 -5.013 -1.995 1.00 0.00 C ATOM 0 H LEU A 39 11.187 -1.765 -2.958 1.00 0.00 H new ATOM 0 HA LEU A 39 8.746 -3.072 -2.852 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.349 -1.854 -0.565 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.129 -3.103 -0.410 1.00 0.00 H new ATOM 0 HG LEU A 39 11.798 -3.335 -1.803 1.00 0.00 H new ATOM 0 HD11 LEU A 39 12.236 -5.023 0.008 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.885 -3.414 0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.630 -4.676 0.692 1.00 0.00 H new ATOM 0 HD21 LEU A 39 11.283 -5.745 -2.086 1.00 0.00 H new ATOM 0 HD22 LEU A 39 9.644 -5.457 -1.454 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.150 -4.711 -2.989 1.00 0.00 H new ATOM 621 N ARG A 40 8.704 0.079 -1.805 1.00 0.00 N ATOM 622 CA ARG A 40 7.900 1.242 -1.453 1.00 0.00 C ATOM 623 C ARG A 40 7.020 1.618 -2.636 1.00 0.00 C ATOM 624 O ARG A 40 5.832 1.874 -2.441 1.00 0.00 O ATOM 625 CB ARG A 40 8.796 2.415 -1.013 1.00 0.00 C ATOM 626 CG ARG A 40 9.996 2.041 -0.119 1.00 0.00 C ATOM 627 CD ARG A 40 9.676 1.141 1.081 1.00 0.00 C ATOM 628 NE ARG A 40 8.754 1.785 2.029 1.00 0.00 N ATOM 629 CZ ARG A 40 8.583 1.443 3.307 1.00 0.00 C ATOM 630 NH1 ARG A 40 9.249 0.417 3.832 1.00 0.00 N ATOM 631 NH2 ARG A 40 7.730 2.132 4.050 1.00 0.00 N ATOM 0 H ARG A 40 9.699 0.294 -1.866 1.00 0.00 H new ATOM 0 HA ARG A 40 7.259 0.999 -0.606 1.00 0.00 H new ATOM 0 HB2 ARG A 40 9.173 2.915 -1.905 1.00 0.00 H new ATOM 0 HB3 ARG A 40 8.180 3.138 -0.479 1.00 0.00 H new ATOM 0 HG2 ARG A 40 10.743 1.541 -0.736 1.00 0.00 H new ATOM 0 HG3 ARG A 40 10.451 2.960 0.251 1.00 0.00 H new ATOM 0 HD2 ARG A 40 9.237 0.208 0.727 1.00 0.00 H new ATOM 0 HD3 ARG A 40 10.601 0.882 1.596 1.00 0.00 H new ATOM 0 HE ARG A 40 8.195 2.563 1.678 1.00 0.00 H new ATOM 0 HH11 ARG A 40 9.899 -0.118 3.256 1.00 0.00 H new ATOM 0 HH12 ARG A 40 9.109 0.166 4.811 1.00 0.00 H new ATOM 0 HH21 ARG A 40 7.214 2.912 3.643 1.00 0.00 H new ATOM 0 HH22 ARG A 40 7.589 1.882 5.029 1.00 0.00 H new ATOM 645 N LEU A 41 7.592 1.619 -3.844 1.00 0.00 N ATOM 646 CA LEU A 41 6.862 1.937 -5.067 1.00 0.00 C ATOM 647 C LEU A 41 5.722 0.935 -5.172 1.00 0.00 C ATOM 648 O LEU A 41 4.567 1.334 -5.259 1.00 0.00 O ATOM 649 CB LEU A 41 7.770 1.894 -6.309 1.00 0.00 C ATOM 650 CG LEU A 41 9.022 2.778 -6.195 1.00 0.00 C ATOM 651 CD1 LEU A 41 9.855 2.698 -7.468 1.00 0.00 C ATOM 652 CD2 LEU A 41 8.693 4.238 -5.889 1.00 0.00 C ATOM 0 H LEU A 41 8.576 1.398 -3.998 1.00 0.00 H new ATOM 0 HA LEU A 41 6.478 2.956 -5.024 1.00 0.00 H new ATOM 0 HB2 LEU A 41 8.079 0.864 -6.486 1.00 0.00 H new ATOM 0 HB3 LEU A 41 7.194 2.207 -7.179 1.00 0.00 H new ATOM 0 HG LEU A 41 9.595 2.389 -5.353 1.00 0.00 H new ATOM 0 HD11 LEU A 41 10.737 3.331 -7.366 1.00 0.00 H new ATOM 0 HD12 LEU A 41 10.166 1.667 -7.635 1.00 0.00 H new ATOM 0 HD13 LEU A 41 9.259 3.039 -8.315 1.00 0.00 H new ATOM 0 HD21 LEU A 41 9.617 4.812 -5.820 1.00 0.00 H new ATOM 0 HD22 LEU A 41 8.071 4.645 -6.686 1.00 0.00 H new ATOM 0 HD23 LEU A 41 8.156 4.299 -4.942 1.00 0.00 H new ATOM 664 N GLN A 42 6.034 -0.358 -5.044 1.00 0.00 N ATOM 665 CA GLN A 42 5.067 -1.439 -5.099 1.00 0.00 C ATOM 666 C GLN A 42 4.009 -1.262 -3.992 1.00 0.00 C ATOM 667 O GLN A 42 2.851 -1.590 -4.224 1.00 0.00 O ATOM 668 CB GLN A 42 5.795 -2.796 -5.010 1.00 0.00 C ATOM 669 CG GLN A 42 6.569 -3.240 -6.264 1.00 0.00 C ATOM 670 CD GLN A 42 5.688 -3.688 -7.435 1.00 0.00 C ATOM 671 OE1 GLN A 42 5.029 -2.882 -8.090 1.00 0.00 O ATOM 672 NE2 GLN A 42 5.675 -4.976 -7.749 1.00 0.00 N ATOM 0 H GLN A 42 6.990 -0.681 -4.896 1.00 0.00 H new ATOM 0 HA GLN A 42 4.538 -1.415 -6.052 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.493 -2.755 -4.174 1.00 0.00 H new ATOM 0 HB3 GLN A 42 5.059 -3.564 -4.773 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.199 -2.415 -6.596 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.234 -4.060 -5.993 1.00 0.00 H new ATOM 0 HE21 GLN A 42 6.223 -5.640 -7.202 1.00 0.00 H new ATOM 0 HE22 GLN A 42 5.117 -5.303 -8.537 1.00 0.00 H new ATOM 681 N ARG A 43 4.335 -0.744 -2.796 1.00 0.00 N ATOM 682 CA ARG A 43 3.327 -0.554 -1.737 1.00 0.00 C ATOM 683 C ARG A 43 2.266 0.441 -2.194 1.00 0.00 C ATOM 684 O ARG A 43 1.084 0.253 -1.887 1.00 0.00 O ATOM 685 CB ARG A 43 3.928 -0.019 -0.424 1.00 0.00 C ATOM 686 CG ARG A 43 4.954 -0.936 0.243 1.00 0.00 C ATOM 687 CD ARG A 43 4.516 -1.516 1.590 1.00 0.00 C ATOM 688 NE ARG A 43 5.672 -2.030 2.343 1.00 0.00 N ATOM 689 CZ ARG A 43 6.528 -2.994 1.978 1.00 0.00 C ATOM 690 NH1 ARG A 43 6.328 -3.741 0.893 1.00 0.00 N ATOM 691 NH2 ARG A 43 7.602 -3.181 2.728 1.00 0.00 N ATOM 0 H ARG A 43 5.278 -0.452 -2.539 1.00 0.00 H new ATOM 0 HA ARG A 43 2.899 -1.539 -1.550 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.400 0.943 -0.624 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.117 0.165 0.280 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.180 -1.759 -0.435 1.00 0.00 H new ATOM 0 HG3 ARG A 43 5.879 -0.378 0.387 1.00 0.00 H new ATOM 0 HD2 ARG A 43 4.010 -0.747 2.174 1.00 0.00 H new ATOM 0 HD3 ARG A 43 3.797 -2.319 1.428 1.00 0.00 H new ATOM 0 HE ARG A 43 5.842 -1.600 3.252 1.00 0.00 H new ATOM 0 HH11 ARG A 43 5.504 -3.587 0.313 1.00 0.00 H new ATOM 0 HH12 ARG A 43 6.999 -4.467 0.643 1.00 0.00 H new ATOM 0 HH21 ARG A 43 7.756 -2.601 3.553 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.276 -3.906 2.482 1.00 0.00 H new ATOM 705 N LEU A 44 2.687 1.512 -2.865 1.00 0.00 N ATOM 706 CA LEU A 44 1.799 2.553 -3.365 1.00 0.00 C ATOM 707 C LEU A 44 1.060 2.046 -4.600 1.00 0.00 C ATOM 708 O LEU A 44 -0.167 2.072 -4.644 1.00 0.00 O ATOM 709 CB LEU A 44 2.611 3.818 -3.695 1.00 0.00 C ATOM 710 CG LEU A 44 3.260 4.473 -2.458 1.00 0.00 C ATOM 711 CD1 LEU A 44 4.277 5.521 -2.912 1.00 0.00 C ATOM 712 CD2 LEU A 44 2.214 5.126 -1.545 1.00 0.00 C ATOM 0 H LEU A 44 3.670 1.681 -3.078 1.00 0.00 H new ATOM 0 HA LEU A 44 1.065 2.806 -2.600 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.391 3.563 -4.412 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.958 4.543 -4.180 1.00 0.00 H new ATOM 0 HG LEU A 44 3.758 3.691 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.736 5.985 -2.039 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.048 5.042 -3.516 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.773 6.284 -3.505 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.711 5.576 -0.686 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.678 5.897 -2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.508 4.370 -1.201 1.00 0.00 H new ATOM 724 N GLU A 45 1.794 1.518 -5.578 1.00 0.00 N ATOM 725 CA GLU A 45 1.289 0.990 -6.844 1.00 0.00 C ATOM 726 C GLU A 45 0.366 -0.219 -6.671 1.00 0.00 C ATOM 727 O GLU A 45 -0.267 -0.655 -7.628 1.00 0.00 O ATOM 728 CB GLU A 45 2.449 0.785 -7.835 1.00 0.00 C ATOM 729 CG GLU A 45 3.000 2.178 -8.200 1.00 0.00 C ATOM 730 CD GLU A 45 4.136 2.170 -9.216 1.00 0.00 C ATOM 731 OE1 GLU A 45 5.145 1.461 -9.019 1.00 0.00 O ATOM 732 OE2 GLU A 45 4.069 2.991 -10.158 1.00 0.00 O ATOM 0 H GLU A 45 2.809 1.443 -5.505 1.00 0.00 H new ATOM 0 HA GLU A 45 0.630 1.736 -7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 45 3.230 0.169 -7.389 1.00 0.00 H new ATOM 0 HB3 GLU A 45 2.103 0.264 -8.728 1.00 0.00 H new ATOM 0 HG2 GLU A 45 2.184 2.784 -8.593 1.00 0.00 H new ATOM 0 HG3 GLU A 45 3.349 2.665 -7.290 1.00 0.00 H new ATOM 739 N ARG A 46 0.239 -0.764 -5.456 1.00 0.00 N ATOM 740 CA ARG A 46 -0.673 -1.870 -5.171 1.00 0.00 C ATOM 741 C ARG A 46 -2.101 -1.311 -5.078 1.00 0.00 C ATOM 742 O ARG A 46 -3.022 -2.102 -4.940 1.00 0.00 O ATOM 743 CB ARG A 46 -0.244 -2.644 -3.912 1.00 0.00 C ATOM 744 CG ARG A 46 0.723 -3.792 -4.251 1.00 0.00 C ATOM 745 CD ARG A 46 1.429 -4.330 -2.993 1.00 0.00 C ATOM 746 NE ARG A 46 2.724 -4.959 -3.316 1.00 0.00 N ATOM 747 CZ ARG A 46 2.901 -6.109 -3.978 1.00 0.00 C ATOM 748 NH1 ARG A 46 1.910 -6.988 -4.116 1.00 0.00 N ATOM 749 NH2 ARG A 46 4.083 -6.384 -4.510 1.00 0.00 N ATOM 0 H ARG A 46 0.768 -0.448 -4.643 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.641 -2.600 -5.979 1.00 0.00 H new ATOM 0 HB2 ARG A 46 0.234 -1.961 -3.210 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.126 -3.046 -3.414 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.174 -4.600 -4.734 1.00 0.00 H new ATOM 0 HG3 ARG A 46 1.468 -3.442 -4.965 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.588 -3.514 -2.288 1.00 0.00 H new ATOM 0 HD3 ARG A 46 0.785 -5.057 -2.498 1.00 0.00 H new ATOM 0 HE ARG A 46 3.564 -4.471 -3.005 1.00 0.00 H new ATOM 0 HH11 ARG A 46 0.994 -6.791 -3.713 1.00 0.00 H new ATOM 0 HH12 ARG A 46 2.067 -7.858 -4.625 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.852 -5.721 -4.414 1.00 0.00 H new ATOM 0 HH22 ARG A 46 4.224 -7.259 -5.015 1.00 0.00 H new ATOM 763 N LEU A 47 -2.308 0.013 -5.166 1.00 0.00 N ATOM 764 CA LEU A 47 -3.598 0.713 -5.127 1.00 0.00 C ATOM 765 C LEU A 47 -4.664 0.006 -5.994 1.00 0.00 C ATOM 766 O LEU A 47 -5.668 -0.490 -5.458 1.00 0.00 O ATOM 767 CB LEU A 47 -3.397 2.188 -5.568 1.00 0.00 C ATOM 768 CG LEU A 47 -3.210 3.236 -4.460 1.00 0.00 C ATOM 769 CD1 LEU A 47 -2.634 4.530 -5.050 1.00 0.00 C ATOM 770 CD2 LEU A 47 -4.542 3.581 -3.793 1.00 0.00 C ATOM 0 H LEU A 47 -1.528 0.662 -5.273 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.972 0.695 -4.103 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.525 2.229 -6.221 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.259 2.481 -6.168 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.530 2.810 -3.723 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.505 5.266 -4.256 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -1.669 4.321 -5.511 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.318 4.923 -5.802 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.377 4.325 -3.014 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.229 3.983 -4.538 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.971 2.682 -3.351 1.00 0.00 H new ATOM 782 N PRO A 48 -4.482 -0.079 -7.330 1.00 0.00 N ATOM 783 CA PRO A 48 -5.456 -0.720 -8.195 1.00 0.00 C ATOM 784 C PRO A 48 -5.645 -2.190 -7.836 1.00 0.00 C ATOM 785 O PRO A 48 -6.765 -2.688 -7.933 1.00 0.00 O ATOM 786 CB PRO A 48 -4.949 -0.534 -9.629 1.00 0.00 C ATOM 787 CG PRO A 48 -3.449 -0.323 -9.461 1.00 0.00 C ATOM 788 CD PRO A 48 -3.380 0.426 -8.138 1.00 0.00 C ATOM 0 HA PRO A 48 -6.442 -0.270 -8.078 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.163 -1.407 -10.245 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.421 0.321 -10.112 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -2.906 -1.267 -9.424 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.024 0.257 -10.281 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.424 0.256 -7.643 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -3.471 1.501 -8.293 1.00 0.00 H new ATOM 796 N GLU A 49 -4.581 -2.869 -7.410 1.00 0.00 N ATOM 797 CA GLU A 49 -4.609 -4.269 -7.027 1.00 0.00 C ATOM 798 C GLU A 49 -5.461 -4.463 -5.773 1.00 0.00 C ATOM 799 O GLU A 49 -6.269 -5.385 -5.760 1.00 0.00 O ATOM 800 CB GLU A 49 -3.175 -4.791 -6.841 1.00 0.00 C ATOM 801 CG GLU A 49 -2.648 -5.558 -8.073 1.00 0.00 C ATOM 802 CD GLU A 49 -2.739 -4.783 -9.400 1.00 0.00 C ATOM 803 OE1 GLU A 49 -3.848 -4.693 -9.962 1.00 0.00 O ATOM 804 OE2 GLU A 49 -1.694 -4.299 -9.904 1.00 0.00 O ATOM 0 H GLU A 49 -3.657 -2.446 -7.322 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.072 -4.853 -7.822 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -2.513 -3.951 -6.632 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -3.143 -5.446 -5.971 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.607 -5.830 -7.897 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -3.208 -6.488 -8.172 1.00 0.00 H new ATOM 811 N LEU A 50 -5.325 -3.624 -4.737 1.00 0.00 N ATOM 812 CA LEU A 50 -6.113 -3.723 -3.506 1.00 0.00 C ATOM 813 C LEU A 50 -7.589 -3.641 -3.900 1.00 0.00 C ATOM 814 O LEU A 50 -8.416 -4.394 -3.378 1.00 0.00 O ATOM 815 CB LEU A 50 -5.752 -2.608 -2.488 1.00 0.00 C ATOM 816 CG LEU A 50 -4.837 -2.976 -1.291 1.00 0.00 C ATOM 817 CD1 LEU A 50 -5.319 -4.201 -0.510 1.00 0.00 C ATOM 818 CD2 LEU A 50 -3.416 -3.225 -1.798 1.00 0.00 C ATOM 0 H LEU A 50 -4.659 -2.852 -4.732 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.894 -4.668 -3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.272 -1.798 -3.038 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.684 -2.211 -2.085 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.865 -2.132 -0.602 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.632 -4.401 0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -6.316 -4.010 -0.112 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -5.352 -5.065 -1.173 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.770 -3.484 -0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -3.424 -4.045 -2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -3.039 -2.324 -2.281 1.00 0.00 H new ATOM 830 N ALA A 51 -7.937 -2.741 -4.826 1.00 0.00 N ATOM 831 CA ALA A 51 -9.317 -2.613 -5.281 1.00 0.00 C ATOM 832 C ALA A 51 -9.766 -3.851 -6.084 1.00 0.00 C ATOM 833 O ALA A 51 -10.793 -4.464 -5.783 1.00 0.00 O ATOM 834 CB ALA A 51 -9.454 -1.345 -6.121 1.00 0.00 C ATOM 0 H ALA A 51 -7.283 -2.096 -5.270 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.967 -2.544 -4.409 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.484 -1.245 -6.463 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.187 -0.478 -5.517 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.789 -1.406 -6.983 1.00 0.00 H new ATOM 840 N ARG A 52 -9.021 -4.230 -7.126 1.00 0.00 N ATOM 841 CA ARG A 52 -9.337 -5.375 -7.987 1.00 0.00 C ATOM 842 C ARG A 52 -9.480 -6.658 -7.168 1.00 0.00 C ATOM 843 O ARG A 52 -10.454 -7.392 -7.355 1.00 0.00 O ATOM 844 CB ARG A 52 -8.260 -5.519 -9.079 1.00 0.00 C ATOM 845 CG ARG A 52 -8.301 -4.390 -10.133 1.00 0.00 C ATOM 846 CD ARG A 52 -6.960 -4.331 -10.872 1.00 0.00 C ATOM 847 NE ARG A 52 -6.895 -3.277 -11.905 1.00 0.00 N ATOM 848 CZ ARG A 52 -5.776 -2.965 -12.578 1.00 0.00 C ATOM 849 NH1 ARG A 52 -4.633 -3.572 -12.295 1.00 0.00 N ATOM 850 NH2 ARG A 52 -5.794 -2.040 -13.532 1.00 0.00 N ATOM 0 H ARG A 52 -8.168 -3.743 -7.400 1.00 0.00 H new ATOM 0 HA ARG A 52 -10.297 -5.197 -8.471 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -7.276 -5.532 -8.609 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.387 -6.479 -9.580 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -9.111 -4.568 -10.841 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.504 -3.434 -9.650 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.163 -4.166 -10.147 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.770 -5.297 -11.339 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.747 -2.758 -12.119 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.600 -4.281 -11.562 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -3.786 -3.331 -12.810 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.664 -1.559 -13.759 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -4.938 -1.811 -14.037 1.00 0.00 H new ATOM 864 N VAL A 53 -8.538 -6.942 -6.270 1.00 0.00 N ATOM 865 CA VAL A 53 -8.577 -8.135 -5.439 1.00 0.00 C ATOM 866 C VAL A 53 -9.808 -8.092 -4.536 1.00 0.00 C ATOM 867 O VAL A 53 -10.482 -9.112 -4.449 1.00 0.00 O ATOM 868 CB VAL A 53 -7.255 -8.311 -4.669 1.00 0.00 C ATOM 869 CG1 VAL A 53 -7.304 -9.494 -3.689 1.00 0.00 C ATOM 870 CG2 VAL A 53 -6.112 -8.601 -5.653 1.00 0.00 C ATOM 0 H VAL A 53 -7.727 -6.348 -6.101 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.673 -9.021 -6.067 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.095 -7.385 -4.117 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -6.349 -9.577 -3.170 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.099 -9.331 -2.961 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -7.499 -10.414 -4.239 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -5.180 -8.724 -5.102 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -6.331 -9.515 -6.205 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.013 -7.770 -6.351 1.00 0.00 H new ATOM 880 N LEU A 54 -10.164 -6.956 -3.922 1.00 0.00 N ATOM 881 CA LEU A 54 -11.338 -6.856 -3.051 1.00 0.00 C ATOM 882 C LEU A 54 -12.592 -7.350 -3.774 1.00 0.00 C ATOM 883 O LEU A 54 -13.308 -8.223 -3.266 1.00 0.00 O ATOM 884 CB LEU A 54 -11.477 -5.416 -2.535 1.00 0.00 C ATOM 885 CG LEU A 54 -12.835 -5.082 -1.893 1.00 0.00 C ATOM 886 CD1 LEU A 54 -13.221 -6.064 -0.786 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.794 -3.680 -1.295 1.00 0.00 C ATOM 0 H LEU A 54 -9.646 -6.083 -4.016 1.00 0.00 H new ATOM 0 HA LEU A 54 -11.209 -7.504 -2.184 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.691 -5.231 -1.803 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -11.307 -4.731 -3.365 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.580 -5.150 -2.686 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -14.187 -5.780 -0.369 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -13.285 -7.071 -1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -12.466 -6.042 -0.000 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.758 -3.449 -0.842 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -12.015 -3.632 -0.534 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -12.580 -2.955 -2.081 1.00 0.00 H new ATOM 899 N ARG A 55 -12.871 -6.826 -4.973 1.00 0.00 N ATOM 900 CA ARG A 55 -14.057 -7.295 -5.699 1.00 0.00 C ATOM 901 C ARG A 55 -13.963 -8.790 -6.007 1.00 0.00 C ATOM 902 O ARG A 55 -14.979 -9.491 -6.025 1.00 0.00 O ATOM 903 CB ARG A 55 -14.388 -6.430 -6.914 1.00 0.00 C ATOM 904 CG ARG A 55 -13.219 -6.167 -7.853 1.00 0.00 C ATOM 905 CD ARG A 55 -13.579 -5.344 -9.087 1.00 0.00 C ATOM 906 NE ARG A 55 -14.096 -6.141 -10.209 1.00 0.00 N ATOM 907 CZ ARG A 55 -13.351 -6.879 -11.046 1.00 0.00 C ATOM 908 NH1 ARG A 55 -12.079 -7.158 -10.765 1.00 0.00 N ATOM 909 NH2 ARG A 55 -13.891 -7.329 -12.166 1.00 0.00 N ATOM 0 H ARG A 55 -12.320 -6.109 -5.445 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.916 -7.174 -5.039 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -15.186 -6.912 -7.478 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -14.777 -5.473 -6.565 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -12.434 -5.649 -7.301 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -12.805 -7.122 -8.176 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.325 -4.600 -8.809 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.695 -4.800 -9.419 1.00 0.00 H new ATOM 0 HE ARG A 55 -15.104 -6.132 -10.364 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -11.659 -6.809 -9.904 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -11.525 -7.720 -11.411 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.864 -7.114 -12.386 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -13.335 -7.891 -12.810 1.00 0.00 H new ATOM 923 N ASN A 56 -12.749 -9.287 -6.249 1.00 0.00 N ATOM 924 CA ASN A 56 -12.509 -10.698 -6.530 1.00 0.00 C ATOM 925 C ASN A 56 -12.847 -11.553 -5.298 1.00 0.00 C ATOM 926 O ASN A 56 -13.384 -12.647 -5.444 1.00 0.00 O ATOM 927 CB ASN A 56 -11.084 -10.891 -7.068 1.00 0.00 C ATOM 928 CG ASN A 56 -10.277 -11.992 -6.401 1.00 0.00 C ATOM 929 OD1 ASN A 56 -10.064 -13.048 -6.985 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.743 -11.722 -5.227 1.00 0.00 N ATOM 0 H ASN A 56 -11.903 -8.717 -6.255 1.00 0.00 H new ATOM 0 HA ASN A 56 -13.175 -11.048 -7.319 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -11.143 -11.103 -8.135 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -10.543 -9.951 -6.959 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -9.131 -12.402 -4.777 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.942 -10.833 -4.769 1.00 0.00 H new ATOM 937 N VAL A 57 -12.596 -11.049 -4.089 1.00 0.00 N ATOM 938 CA VAL A 57 -12.894 -11.767 -2.855 1.00 0.00 C ATOM 939 C VAL A 57 -14.407 -11.915 -2.708 1.00 0.00 C ATOM 940 O VAL A 57 -14.891 -13.035 -2.593 1.00 0.00 O ATOM 941 CB VAL A 57 -12.258 -11.082 -1.625 1.00 0.00 C ATOM 942 CG1 VAL A 57 -12.701 -11.753 -0.315 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.727 -11.132 -1.717 1.00 0.00 C ATOM 0 H VAL A 57 -12.180 -10.130 -3.941 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.450 -12.761 -2.910 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.596 -10.046 -1.621 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.235 -11.246 0.530 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -13.785 -11.690 -0.222 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.398 -12.800 -0.322 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.294 -10.645 -0.843 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.398 -12.171 -1.754 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.400 -10.616 -2.619 1.00 0.00 H new ATOM 953 N PHE A 58 -15.182 -10.826 -2.757 1.00 0.00 N ATOM 954 CA PHE A 58 -16.639 -10.922 -2.592 1.00 0.00 C ATOM 955 C PHE A 58 -17.272 -11.780 -3.675 1.00 0.00 C ATOM 956 O PHE A 58 -18.119 -12.619 -3.362 1.00 0.00 O ATOM 957 CB PHE A 58 -17.302 -9.553 -2.585 1.00 0.00 C ATOM 958 CG PHE A 58 -17.251 -8.751 -1.297 1.00 0.00 C ATOM 959 CD1 PHE A 58 -16.149 -8.814 -0.415 1.00 0.00 C ATOM 960 CD2 PHE A 58 -18.298 -7.846 -1.030 1.00 0.00 C ATOM 961 CE1 PHE A 58 -16.107 -7.990 0.719 1.00 0.00 C ATOM 962 CE2 PHE A 58 -18.261 -7.055 0.129 1.00 0.00 C ATOM 963 CZ PHE A 58 -17.171 -7.124 1.000 1.00 0.00 C ATOM 0 H PHE A 58 -14.832 -9.880 -2.907 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.803 -11.395 -1.624 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -16.843 -8.954 -3.371 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -18.349 -9.686 -2.856 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -15.337 -9.498 -0.615 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -19.128 -7.761 -1.716 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -15.252 -8.023 1.377 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -19.081 -6.388 0.349 1.00 0.00 H new ATOM 0 HZ PHE A 58 -17.149 -6.511 1.889 1.00 0.00 H new ATOM 973 N VAL A 59 -16.850 -11.612 -4.934 1.00 0.00 N ATOM 974 CA VAL A 59 -17.431 -12.426 -6.001 1.00 0.00 C ATOM 975 C VAL A 59 -17.177 -13.919 -5.716 1.00 0.00 C ATOM 976 O VAL A 59 -18.035 -14.749 -6.022 1.00 0.00 O ATOM 977 CB VAL A 59 -17.027 -11.920 -7.405 1.00 0.00 C ATOM 978 CG1 VAL A 59 -15.685 -12.448 -7.912 1.00 0.00 C ATOM 979 CG2 VAL A 59 -18.096 -12.268 -8.443 1.00 0.00 C ATOM 0 H VAL A 59 -16.136 -10.946 -5.229 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.515 -12.314 -6.010 1.00 0.00 H new ATOM 0 HB VAL A 59 -16.929 -10.841 -7.283 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.485 -12.041 -8.903 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.893 -12.144 -7.228 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.720 -13.536 -7.967 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.786 -11.901 -9.421 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -18.224 -13.350 -8.485 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -19.041 -11.802 -8.163 1.00 0.00 H new ATOM 989 N SER A 60 -16.042 -14.268 -5.097 1.00 0.00 N ATOM 990 CA SER A 60 -15.687 -15.637 -4.748 1.00 0.00 C ATOM 991 C SER A 60 -16.466 -16.086 -3.495 1.00 0.00 C ATOM 992 O SER A 60 -16.829 -17.262 -3.369 1.00 0.00 O ATOM 993 CB SER A 60 -14.168 -15.667 -4.497 1.00 0.00 C ATOM 994 OG SER A 60 -13.690 -16.983 -4.332 1.00 0.00 O ATOM 0 H SER A 60 -15.334 -13.587 -4.822 1.00 0.00 H new ATOM 0 HA SER A 60 -15.947 -16.325 -5.553 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.652 -15.195 -5.333 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.935 -15.082 -3.608 1.00 0.00 H new ATOM 0 HG SER A 60 -12.723 -16.963 -4.176 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.756 -15.165 -2.572 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.466 -15.411 -1.319 1.00 0.00 C ATOM 1002 C GLU A 61 -18.973 -15.619 -1.486 1.00 0.00 C ATOM 1003 O GLU A 61 -19.589 -16.232 -0.616 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.216 -14.241 -0.348 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.188 -14.678 1.122 1.00 0.00 C ATOM 1006 CD GLU A 61 -15.964 -15.542 1.454 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -14.823 -15.079 1.231 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -16.123 -16.683 1.945 1.00 0.00 O ATOM 0 H GLU A 61 -16.490 -14.187 -2.685 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.069 -16.345 -0.922 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.268 -13.765 -0.598 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -17.995 -13.491 -0.484 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -17.189 -13.795 1.761 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.096 -15.237 1.349 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.572 -15.147 -2.587 1.00 0.00 N ATOM 1016 CA ARG A 62 -21.006 -15.259 -2.892 1.00 0.00 C ATOM 1017 C ARG A 62 -21.906 -14.397 -1.979 1.00 0.00 C ATOM 1018 O ARG A 62 -23.136 -14.514 -1.993 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.344 -16.748 -3.112 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.818 -17.100 -3.227 1.00 0.00 C ATOM 1021 CD ARG A 62 -22.974 -18.458 -3.913 1.00 0.00 C ATOM 1022 NE ARG A 62 -24.144 -19.190 -3.416 1.00 0.00 N ATOM 1023 CZ ARG A 62 -24.162 -20.372 -2.794 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -23.029 -21.011 -2.527 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -25.332 -20.891 -2.448 1.00 0.00 N ATOM 0 H ARG A 62 -19.053 -14.659 -3.317 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.257 -14.781 -3.839 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.842 -17.081 -4.020 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -20.920 -17.319 -2.286 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.273 -17.128 -2.237 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -23.341 -16.332 -3.797 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -23.067 -18.313 -4.989 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -22.076 -19.053 -3.748 1.00 0.00 H new ATOM 0 HE ARG A 62 -25.050 -18.744 -3.562 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -22.136 -20.600 -2.797 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -23.052 -21.913 -2.052 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -26.195 -20.389 -2.658 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -25.369 -21.792 -1.972 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.310 -13.478 -1.211 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.001 -12.560 -0.312 1.00 0.00 C ATOM 1041 C LYS A 63 -21.511 -11.150 -0.632 1.00 0.00 C ATOM 1042 O LYS A 63 -20.299 -10.941 -0.667 1.00 0.00 O ATOM 1043 CB LYS A 63 -21.873 -12.961 1.168 1.00 0.00 C ATOM 1044 CG LYS A 63 -20.453 -13.366 1.588 1.00 0.00 C ATOM 1045 CD LYS A 63 -20.326 -13.700 3.077 1.00 0.00 C ATOM 1046 CE LYS A 63 -21.109 -14.984 3.370 1.00 0.00 C ATOM 1047 NZ LYS A 63 -20.642 -15.668 4.592 1.00 0.00 N ATOM 0 H LYS A 63 -20.298 -13.352 -1.201 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.077 -12.601 -0.479 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -22.200 -12.127 1.789 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -22.550 -13.791 1.368 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.143 -14.231 1.002 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -19.766 -12.555 1.346 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -19.278 -13.829 3.346 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.711 -12.878 3.681 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -22.167 -14.744 3.474 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -21.018 -15.662 2.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -21.204 -16.530 4.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -19.639 -15.923 4.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -20.753 -15.034 5.409 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.405 -10.175 -0.873 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.025 -8.807 -1.193 1.00 0.00 C ATOM 1063 C PRO A 64 -21.669 -7.987 0.054 1.00 0.00 C ATOM 1064 O PRO A 64 -21.358 -6.800 -0.075 1.00 0.00 O ATOM 1065 CB PRO A 64 -23.258 -8.216 -1.883 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.407 -8.902 -1.151 1.00 0.00 C ATOM 1067 CD PRO A 64 -23.853 -10.291 -0.864 1.00 0.00 C ATOM 0 HA PRO A 64 -21.131 -8.786 -1.817 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.300 -7.132 -1.779 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -23.269 -8.435 -2.951 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.672 -8.376 -0.234 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -25.307 -8.946 -1.764 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.206 -10.656 0.101 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -24.188 -11.004 -1.617 1.00 0.00 H new ATOM 1075 N ALA A 65 -21.787 -8.570 1.253 1.00 0.00 N ATOM 1076 CA ALA A 65 -21.491 -7.920 2.516 1.00 0.00 C ATOM 1077 C ALA A 65 -20.878 -8.963 3.437 1.00 0.00 C ATOM 1078 O ALA A 65 -21.423 -10.062 3.549 1.00 0.00 O ATOM 1079 CB ALA A 65 -22.778 -7.356 3.124 1.00 0.00 C ATOM 0 H ALA A 65 -22.101 -9.534 1.364 1.00 0.00 H new ATOM 0 HA ALA A 65 -20.797 -7.092 2.373 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -22.550 -6.869 4.072 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -23.216 -6.630 2.439 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -23.486 -8.167 3.294 1.00 0.00 H new ATOM 1085 N LEU A 66 -19.774 -8.638 4.099 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.051 -9.523 5.014 1.00 0.00 C ATOM 1087 C LEU A 66 -18.913 -8.826 6.360 1.00 0.00 C ATOM 1088 O LEU A 66 -18.980 -7.595 6.427 1.00 0.00 O ATOM 1089 CB LEU A 66 -17.629 -9.796 4.493 1.00 0.00 C ATOM 1090 CG LEU A 66 -17.467 -10.785 3.326 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -18.235 -10.416 2.056 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -15.979 -10.899 2.990 1.00 0.00 C ATOM 0 H LEU A 66 -19.340 -7.719 4.013 1.00 0.00 H new ATOM 0 HA LEU A 66 -19.602 -10.460 5.098 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.197 -8.844 4.186 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.032 -10.163 5.328 1.00 0.00 H new ATOM 0 HG LEU A 66 -17.893 -11.729 3.666 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -18.058 -11.172 1.291 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -19.301 -10.366 2.277 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -17.894 -9.446 1.693 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.845 -11.597 2.164 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.595 -9.920 2.704 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.436 -11.261 3.863 1.00 0.00 H new ATOM 1104 N THR A 67 -18.718 -9.602 7.422 1.00 0.00 N ATOM 1105 CA THR A 67 -18.538 -9.085 8.768 1.00 0.00 C ATOM 1106 C THR A 67 -17.221 -8.302 8.786 1.00 0.00 C ATOM 1107 O THR A 67 -16.313 -8.609 8.005 1.00 0.00 O ATOM 1108 CB THR A 67 -18.510 -10.244 9.787 1.00 0.00 C ATOM 1109 OG1 THR A 67 -19.002 -11.474 9.277 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.365 -9.924 11.001 1.00 0.00 C ATOM 0 H THR A 67 -18.681 -10.620 7.368 1.00 0.00 H new ATOM 0 HA THR A 67 -19.365 -8.432 9.047 1.00 0.00 H new ATOM 0 HB THR A 67 -17.455 -10.352 10.038 1.00 0.00 H new ATOM 0 HG1 THR A 67 -18.953 -12.161 9.975 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.327 -10.757 11.703 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.986 -9.024 11.486 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.396 -9.760 10.687 1.00 0.00 H new ATOM 1118 N MET A 68 -17.106 -7.300 9.661 1.00 0.00 N ATOM 1119 CA MET A 68 -15.903 -6.484 9.763 1.00 0.00 C ATOM 1120 C MET A 68 -14.705 -7.371 10.101 1.00 0.00 C ATOM 1121 O MET A 68 -13.683 -7.300 9.422 1.00 0.00 O ATOM 1122 CB MET A 68 -16.094 -5.361 10.794 1.00 0.00 C ATOM 1123 CG MET A 68 -14.907 -4.389 10.777 1.00 0.00 C ATOM 1124 SD MET A 68 -14.677 -3.472 9.225 1.00 0.00 S ATOM 1125 CE MET A 68 -15.974 -2.224 9.418 1.00 0.00 C ATOM 0 H MET A 68 -17.843 -7.036 10.314 1.00 0.00 H new ATOM 0 HA MET A 68 -15.709 -6.006 8.803 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.015 -4.819 10.580 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.202 -5.791 11.790 1.00 0.00 H new ATOM 0 HG2 MET A 68 -15.034 -3.672 11.588 1.00 0.00 H new ATOM 0 HG3 MET A 68 -13.996 -4.950 10.987 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.845 -1.446 8.666 1.00 0.00 H new ATOM 0 HE2 MET A 68 -16.951 -2.692 9.293 1.00 0.00 H new ATOM 0 HE3 MET A 68 -15.908 -1.782 10.412 1.00 0.00 H new ATOM 1135 N GLU A 69 -14.849 -8.239 11.103 1.00 0.00 N ATOM 1136 CA GLU A 69 -13.790 -9.142 11.524 1.00 0.00 C ATOM 1137 C GLU A 69 -13.436 -10.111 10.397 1.00 0.00 C ATOM 1138 O GLU A 69 -12.257 -10.326 10.132 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.229 -9.903 12.783 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.143 -10.883 13.251 1.00 0.00 C ATOM 1141 CD GLU A 69 -13.562 -11.630 14.504 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -14.543 -12.408 14.438 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -12.923 -11.460 15.566 1.00 0.00 O ATOM 0 H GLU A 69 -15.709 -8.332 11.644 1.00 0.00 H new ATOM 0 HA GLU A 69 -12.898 -8.562 11.760 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -14.450 -9.194 13.581 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.150 -10.449 12.578 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -12.930 -11.597 12.456 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.220 -10.337 13.445 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.438 -10.687 9.721 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.198 -11.636 8.638 1.00 0.00 C ATOM 1152 C VAL A 70 -13.292 -11.011 7.585 1.00 0.00 C ATOM 1153 O VAL A 70 -12.237 -11.570 7.268 1.00 0.00 O ATOM 1154 CB VAL A 70 -15.533 -12.117 8.028 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.366 -12.925 6.730 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.262 -13.000 9.041 1.00 0.00 C ATOM 0 H VAL A 70 -15.424 -10.508 9.909 1.00 0.00 H new ATOM 0 HA VAL A 70 -13.690 -12.512 9.041 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.097 -11.217 7.785 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.346 -13.228 6.361 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -14.870 -12.309 5.979 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -14.763 -13.811 6.928 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.205 -13.341 8.614 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -15.641 -13.862 9.286 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -16.460 -12.427 9.947 1.00 0.00 H new ATOM 1166 N VAL A 71 -13.706 -9.866 7.041 1.00 0.00 N ATOM 1167 CA VAL A 71 -12.947 -9.194 6.004 1.00 0.00 C ATOM 1168 C VAL A 71 -11.585 -8.683 6.503 1.00 0.00 C ATOM 1169 O VAL A 71 -10.621 -8.653 5.745 1.00 0.00 O ATOM 1170 CB VAL A 71 -13.850 -8.129 5.354 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -13.991 -6.830 6.161 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.367 -7.861 3.933 1.00 0.00 C ATOM 0 H VAL A 71 -14.567 -9.389 7.308 1.00 0.00 H new ATOM 0 HA VAL A 71 -12.664 -9.901 5.224 1.00 0.00 H new ATOM 0 HB VAL A 71 -14.859 -8.540 5.335 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -14.644 -6.139 5.627 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -14.420 -7.053 7.138 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.009 -6.374 6.291 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.003 -7.108 3.468 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.339 -7.501 3.960 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.413 -8.783 3.353 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.480 -8.300 7.772 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.249 -7.795 8.360 1.00 0.00 C ATOM 1184 C CYS A 72 -9.234 -8.936 8.428 1.00 0.00 C ATOM 1185 O CYS A 72 -8.127 -8.790 7.907 1.00 0.00 O ATOM 1186 CB CYS A 72 -10.554 -7.162 9.719 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.059 -6.416 10.425 1.00 0.00 S ATOM 0 H CYS A 72 -12.260 -8.333 8.428 1.00 0.00 H new ATOM 0 HA CYS A 72 -9.807 -7.008 7.748 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.328 -6.403 9.607 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -10.946 -7.918 10.399 1.00 0.00 H new ATOM 0 HG CYS A 72 -9.342 -5.883 11.577 1.00 0.00 H new ATOM 1193 N ALA A 73 -9.620 -10.080 9.009 1.00 0.00 N ATOM 1194 CA ALA A 73 -8.757 -11.252 9.119 1.00 0.00 C ATOM 1195 C ALA A 73 -8.309 -11.681 7.714 1.00 0.00 C ATOM 1196 O ALA A 73 -7.157 -12.075 7.505 1.00 0.00 O ATOM 1197 CB ALA A 73 -9.497 -12.382 9.836 1.00 0.00 C ATOM 0 H ALA A 73 -10.546 -10.214 9.416 1.00 0.00 H new ATOM 0 HA ALA A 73 -7.872 -11.009 9.708 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.845 -13.252 9.913 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.783 -12.053 10.835 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.391 -12.647 9.271 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.222 -11.600 6.740 1.00 0.00 N ATOM 1204 CA ARG A 74 -8.979 -11.928 5.340 1.00 0.00 C ATOM 1205 C ARG A 74 -7.912 -11.001 4.749 1.00 0.00 C ATOM 1206 O ARG A 74 -7.070 -11.454 3.977 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.310 -11.770 4.579 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.202 -13.019 4.642 1.00 0.00 C ATOM 1209 CD ARG A 74 -10.977 -13.975 3.463 1.00 0.00 C ATOM 1210 NE ARG A 74 -9.636 -14.570 3.458 1.00 0.00 N ATOM 1211 CZ ARG A 74 -9.234 -15.623 4.172 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -10.057 -16.226 5.024 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -7.991 -16.051 4.040 1.00 0.00 N ATOM 0 H ARG A 74 -10.179 -11.294 6.915 1.00 0.00 H new ATOM 0 HA ARG A 74 -8.613 -12.951 5.252 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -10.857 -10.921 4.991 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.098 -11.537 3.536 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -11.010 -13.549 5.575 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.248 -12.712 4.659 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -11.722 -14.770 3.499 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -11.133 -13.435 2.529 1.00 0.00 H new ATOM 0 HE ARG A 74 -8.943 -14.136 2.849 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -11.011 -15.885 5.139 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -9.734 -17.030 5.562 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -7.354 -15.578 3.399 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -7.668 -16.855 4.579 1.00 0.00 H new ATOM 1227 N MET A 75 -7.945 -9.707 5.062 1.00 0.00 N ATOM 1228 CA MET A 75 -6.995 -8.728 4.550 1.00 0.00 C ATOM 1229 C MET A 75 -5.629 -8.917 5.178 1.00 0.00 C ATOM 1230 O MET A 75 -4.646 -9.063 4.453 1.00 0.00 O ATOM 1231 CB MET A 75 -7.452 -7.283 4.829 1.00 0.00 C ATOM 1232 CG MET A 75 -8.019 -6.575 3.599 1.00 0.00 C ATOM 1233 SD MET A 75 -9.799 -6.773 3.421 1.00 0.00 S ATOM 1234 CE MET A 75 -9.917 -8.303 2.463 1.00 0.00 C ATOM 0 H MET A 75 -8.644 -9.306 5.688 1.00 0.00 H new ATOM 0 HA MET A 75 -6.941 -8.888 3.473 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.209 -7.295 5.613 1.00 0.00 H new ATOM 0 HB3 MET A 75 -6.607 -6.710 5.211 1.00 0.00 H new ATOM 0 HG2 MET A 75 -7.783 -5.513 3.659 1.00 0.00 H new ATOM 0 HG3 MET A 75 -7.526 -6.961 2.707 1.00 0.00 H new ATOM 0 HE1 MET A 75 -10.414 -8.101 1.514 1.00 0.00 H new ATOM 0 HE2 MET A 75 -8.916 -8.691 2.273 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.492 -9.040 3.024 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.570 -8.910 6.508 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.320 -9.035 7.226 1.00 0.00 C ATOM 1246 C VAL A 76 -3.585 -10.330 6.907 1.00 0.00 C ATOM 1247 O VAL A 76 -2.361 -10.316 6.888 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.545 -8.767 8.722 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.085 -9.973 9.489 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.247 -8.256 9.342 1.00 0.00 C ATOM 0 H VAL A 76 -6.389 -8.817 7.109 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.631 -8.266 6.876 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.322 -8.007 8.801 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.218 -9.707 10.538 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.044 -10.274 9.066 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -4.379 -10.800 9.411 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.402 -8.064 10.404 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.465 -9.005 9.219 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.946 -7.333 8.847 1.00 0.00 H new ATOM 1260 N ASP A 77 -4.275 -11.431 6.587 1.00 0.00 N ATOM 1261 CA ASP A 77 -3.549 -12.672 6.261 1.00 0.00 C ATOM 1262 C ASP A 77 -2.694 -12.481 5.004 1.00 0.00 C ATOM 1263 O ASP A 77 -1.665 -13.137 4.830 1.00 0.00 O ATOM 1264 CB ASP A 77 -4.518 -13.829 6.055 1.00 0.00 C ATOM 1265 CG ASP A 77 -3.848 -15.153 5.659 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -2.892 -15.594 6.341 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -4.374 -15.802 4.724 1.00 0.00 O ATOM 0 H ASP A 77 -5.292 -11.494 6.546 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.896 -12.909 7.101 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -5.083 -13.982 6.974 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.235 -13.553 5.282 1.00 0.00 H new ATOM 1272 N SER A 78 -3.093 -11.556 4.126 1.00 0.00 N ATOM 1273 CA SER A 78 -2.398 -11.247 2.891 1.00 0.00 C ATOM 1274 C SER A 78 -1.082 -10.506 3.154 1.00 0.00 C ATOM 1275 O SER A 78 -0.305 -10.309 2.215 1.00 0.00 O ATOM 1276 CB SER A 78 -3.338 -10.456 1.976 1.00 0.00 C ATOM 1277 OG SER A 78 -3.099 -10.709 0.598 1.00 0.00 O ATOM 0 H SER A 78 -3.931 -10.992 4.266 1.00 0.00 H new ATOM 0 HA SER A 78 -2.122 -12.174 2.389 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.371 -10.710 2.215 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.219 -9.390 2.172 1.00 0.00 H new ATOM 0 HG SER A 78 -3.724 -10.183 0.056 1.00 0.00 H new ATOM 1283 N CYS A 79 -0.801 -10.129 4.411 1.00 0.00 N ATOM 1284 CA CYS A 79 0.425 -9.446 4.797 1.00 0.00 C ATOM 1285 C CYS A 79 1.653 -10.329 4.611 1.00 0.00 C ATOM 1286 O CYS A 79 2.770 -9.834 4.770 1.00 0.00 O ATOM 1287 CB CYS A 79 0.352 -8.922 6.234 1.00 0.00 C ATOM 1288 SG CYS A 79 0.591 -10.238 7.474 1.00 0.00 S ATOM 0 H CYS A 79 -1.434 -10.297 5.193 1.00 0.00 H new ATOM 0 HA CYS A 79 0.527 -8.590 4.129 1.00 0.00 H new ATOM 0 HB2 CYS A 79 1.111 -8.153 6.375 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.616 -8.448 6.395 1.00 0.00 H new ATOM 0 HG CYS A 79 -0.554 -10.789 7.748 1.00 0.00 H new ATOM 1294 N GLN A 80 1.447 -11.612 4.280 1.00 0.00 N ATOM 1295 CA GLN A 80 2.436 -12.648 4.026 1.00 0.00 C ATOM 1296 C GLN A 80 3.252 -12.315 2.764 1.00 0.00 C ATOM 1297 O GLN A 80 3.220 -13.022 1.756 1.00 0.00 O ATOM 1298 CB GLN A 80 1.732 -14.024 4.003 1.00 0.00 C ATOM 1299 CG GLN A 80 0.683 -14.246 2.893 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.409 -15.280 3.181 1.00 0.00 C ATOM 1301 OE1 GLN A 80 -1.390 -15.356 2.443 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -0.281 -16.145 4.176 1.00 0.00 N ATOM 0 H GLN A 80 0.499 -11.974 4.176 1.00 0.00 H new ATOM 0 HA GLN A 80 3.172 -12.695 4.829 1.00 0.00 H new ATOM 0 HB2 GLN A 80 2.496 -14.796 3.909 1.00 0.00 H new ATOM 0 HB3 GLN A 80 1.245 -14.173 4.967 1.00 0.00 H new ATOM 0 HG2 GLN A 80 0.201 -13.291 2.683 1.00 0.00 H new ATOM 0 HG3 GLN A 80 1.206 -14.546 1.985 1.00 0.00 H new ATOM 0 HE21 GLN A 80 0.528 -16.094 4.796 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -0.991 -16.863 4.322 1.00 0.00 H new ATOM 1311 N THR A 81 3.955 -11.190 2.807 1.00 0.00 N ATOM 1312 CA THR A 81 4.809 -10.645 1.784 1.00 0.00 C ATOM 1313 C THR A 81 5.902 -9.888 2.566 1.00 0.00 C ATOM 1314 O THR A 81 6.746 -10.557 3.160 1.00 0.00 O ATOM 1315 CB THR A 81 3.937 -9.912 0.739 1.00 0.00 C ATOM 1316 OG1 THR A 81 4.717 -9.331 -0.287 1.00 0.00 O ATOM 1317 CG2 THR A 81 2.939 -8.901 1.304 1.00 0.00 C ATOM 0 H THR A 81 3.933 -10.592 3.633 1.00 0.00 H new ATOM 0 HA THR A 81 5.343 -11.343 1.139 1.00 0.00 H new ATOM 0 HB THR A 81 3.322 -10.706 0.315 1.00 0.00 H new ATOM 0 HG1 THR A 81 4.130 -8.879 -0.928 1.00 0.00 H new ATOM 0 HG21 THR A 81 2.380 -8.446 0.486 1.00 0.00 H new ATOM 0 HG22 THR A 81 2.248 -9.409 1.977 1.00 0.00 H new ATOM 0 HG23 THR A 81 3.476 -8.127 1.852 1.00 0.00 H new ATOM 1325 N ALA A 82 5.898 -8.553 2.684 1.00 0.00 N ATOM 1326 CA ALA A 82 6.934 -7.820 3.422 1.00 0.00 C ATOM 1327 C ALA A 82 6.441 -6.522 4.076 1.00 0.00 C ATOM 1328 O ALA A 82 7.240 -5.631 4.366 1.00 0.00 O ATOM 1329 CB ALA A 82 8.133 -7.556 2.499 1.00 0.00 C ATOM 0 H ALA A 82 5.181 -7.955 2.273 1.00 0.00 H new ATOM 0 HA ALA A 82 7.236 -8.456 4.254 1.00 0.00 H new ATOM 0 HB1 ALA A 82 8.902 -7.012 3.048 1.00 0.00 H new ATOM 0 HB2 ALA A 82 8.540 -8.505 2.150 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.810 -6.963 1.643 1.00 0.00 H new ATOM 1335 N LEU A 83 5.138 -6.392 4.296 1.00 0.00 N ATOM 1336 CA LEU A 83 4.473 -5.234 4.897 1.00 0.00 C ATOM 1337 C LEU A 83 3.859 -5.609 6.242 1.00 0.00 C ATOM 1338 O LEU A 83 3.684 -6.791 6.545 1.00 0.00 O ATOM 1339 CB LEU A 83 3.476 -4.598 3.907 1.00 0.00 C ATOM 1340 CG LEU A 83 2.537 -5.576 3.185 1.00 0.00 C ATOM 1341 CD1 LEU A 83 1.315 -5.938 4.012 1.00 0.00 C ATOM 1342 CD2 LEU A 83 2.101 -5.014 1.839 1.00 0.00 C ATOM 0 H LEU A 83 4.478 -7.129 4.048 1.00 0.00 H new ATOM 0 HA LEU A 83 5.211 -4.460 5.108 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.868 -3.872 4.448 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.041 -4.045 3.157 1.00 0.00 H new ATOM 0 HG LEU A 83 3.109 -6.491 3.030 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.688 -6.631 3.451 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.632 -6.407 4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.747 -5.035 4.236 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.437 -5.724 1.346 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.576 -4.071 1.991 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.978 -4.844 1.214 1.00 0.00 H new ATOM 1354 N SER A 84 3.560 -4.601 7.060 1.00 0.00 N ATOM 1355 CA SER A 84 2.985 -4.768 8.385 1.00 0.00 C ATOM 1356 C SER A 84 1.449 -4.746 8.352 1.00 0.00 C ATOM 1357 O SER A 84 0.858 -4.174 7.427 1.00 0.00 O ATOM 1358 CB SER A 84 3.577 -3.685 9.302 1.00 0.00 C ATOM 1359 OG SER A 84 3.624 -2.404 8.696 1.00 0.00 O ATOM 0 H SER A 84 3.716 -3.625 6.810 1.00 0.00 H new ATOM 0 HA SER A 84 3.243 -5.750 8.781 1.00 0.00 H new ATOM 0 HB2 SER A 84 2.983 -3.627 10.214 1.00 0.00 H new ATOM 0 HB3 SER A 84 4.585 -3.978 9.596 1.00 0.00 H new ATOM 0 HG SER A 84 4.007 -1.758 9.326 1.00 0.00 H new ATOM 1365 N PRO A 85 0.775 -5.282 9.389 1.00 0.00 N ATOM 1366 CA PRO A 85 -0.680 -5.329 9.472 1.00 0.00 C ATOM 1367 C PRO A 85 -1.368 -3.958 9.392 1.00 0.00 C ATOM 1368 O PRO A 85 -2.500 -3.890 8.909 1.00 0.00 O ATOM 1369 CB PRO A 85 -1.006 -6.081 10.770 1.00 0.00 C ATOM 1370 CG PRO A 85 0.264 -6.002 11.601 1.00 0.00 C ATOM 1371 CD PRO A 85 1.348 -5.984 10.529 1.00 0.00 C ATOM 0 HA PRO A 85 -1.080 -5.845 8.599 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -1.847 -5.623 11.291 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -1.281 -7.116 10.568 1.00 0.00 H new ATOM 0 HG2 PRO A 85 0.290 -5.106 12.221 1.00 0.00 H new ATOM 0 HG3 PRO A 85 0.367 -6.856 12.270 1.00 0.00 H new ATOM 0 HD2 PRO A 85 2.244 -5.478 10.889 1.00 0.00 H new ATOM 0 HD3 PRO A 85 1.643 -6.997 10.255 1.00 0.00 H new ATOM 1379 N GLY A 86 -0.690 -2.873 9.784 1.00 0.00 N ATOM 1380 CA GLY A 86 -1.263 -1.534 9.772 1.00 0.00 C ATOM 1381 C GLY A 86 -1.296 -0.816 8.427 1.00 0.00 C ATOM 1382 O GLY A 86 -2.117 0.089 8.279 1.00 0.00 O ATOM 0 H GLY A 86 0.273 -2.905 10.118 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.284 -1.597 10.149 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.701 -0.917 10.474 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.436 -1.178 7.470 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.392 -0.545 6.145 1.00 0.00 C ATOM 1388 C GLU A 87 -1.727 -0.816 5.437 1.00 0.00 C ATOM 1389 O GLU A 87 -2.414 0.088 4.958 1.00 0.00 O ATOM 1390 CB GLU A 87 0.783 -1.138 5.347 1.00 0.00 C ATOM 1391 CG GLU A 87 2.172 -0.725 5.860 1.00 0.00 C ATOM 1392 CD GLU A 87 2.762 0.473 5.110 1.00 0.00 C ATOM 1393 OE1 GLU A 87 2.080 1.511 4.972 1.00 0.00 O ATOM 1394 OE2 GLU A 87 3.941 0.381 4.680 1.00 0.00 O ATOM 0 H GLU A 87 0.252 -1.921 7.591 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.244 0.532 6.229 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.709 -2.225 5.369 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.689 -0.833 4.305 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.103 -0.483 6.921 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.852 -1.572 5.770 1.00 0.00 H new ATOM 1401 N MET A 88 -2.136 -2.083 5.469 1.00 0.00 N ATOM 1402 CA MET A 88 -3.362 -2.610 4.894 1.00 0.00 C ATOM 1403 C MET A 88 -4.572 -1.838 5.431 1.00 0.00 C ATOM 1404 O MET A 88 -5.446 -1.453 4.659 1.00 0.00 O ATOM 1405 CB MET A 88 -3.410 -4.091 5.283 1.00 0.00 C ATOM 1406 CG MET A 88 -4.356 -4.989 4.482 1.00 0.00 C ATOM 1407 SD MET A 88 -3.696 -5.640 2.924 1.00 0.00 S ATOM 1408 CE MET A 88 -2.305 -6.634 3.551 1.00 0.00 C ATOM 0 H MET A 88 -1.584 -2.809 5.926 1.00 0.00 H new ATOM 0 HA MET A 88 -3.387 -2.501 3.810 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.402 -4.497 5.196 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.690 -4.156 6.334 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.647 -5.830 5.111 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.263 -4.425 4.263 1.00 0.00 H new ATOM 0 HE1 MET A 88 -1.957 -7.308 2.768 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.491 -5.973 3.849 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.633 -7.217 4.412 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.615 -1.577 6.743 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.703 -0.848 7.394 1.00 0.00 C ATOM 1420 C GLU A 89 -5.801 0.558 6.815 1.00 0.00 C ATOM 1421 O GLU A 89 -6.900 1.006 6.466 1.00 0.00 O ATOM 1422 CB GLU A 89 -5.506 -0.805 8.913 1.00 0.00 C ATOM 1423 CG GLU A 89 -5.590 -2.211 9.513 1.00 0.00 C ATOM 1424 CD GLU A 89 -5.303 -2.229 11.013 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -4.236 -1.731 11.439 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -6.130 -2.773 11.778 1.00 0.00 O ATOM 0 H GLU A 89 -3.883 -1.872 7.389 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.639 -1.372 7.201 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -4.537 -0.363 9.146 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.265 -0.166 9.365 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -6.584 -2.620 9.332 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -4.880 -2.862 9.003 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.660 1.248 6.699 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.628 2.587 6.135 1.00 0.00 C ATOM 1435 C LYS A 90 -5.112 2.570 4.685 1.00 0.00 C ATOM 1436 O LYS A 90 -5.666 3.581 4.247 1.00 0.00 O ATOM 1437 CB LYS A 90 -3.229 3.210 6.275 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.970 3.625 7.733 1.00 0.00 C ATOM 1439 CD LYS A 90 -2.058 4.855 7.839 1.00 0.00 C ATOM 1440 CE LYS A 90 -2.102 5.367 9.283 1.00 0.00 C ATOM 1441 NZ LYS A 90 -1.806 6.812 9.388 1.00 0.00 N ATOM 0 H LYS A 90 -3.749 0.893 6.991 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.314 3.220 6.698 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.472 2.495 5.954 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.144 4.079 5.622 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.921 3.838 8.221 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.516 2.792 8.270 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.037 4.595 7.560 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.389 5.633 7.151 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.089 5.171 9.703 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.384 4.809 9.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.850 7.104 10.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.854 6.999 9.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.506 7.351 8.839 1.00 0.00 H new ATOM 1455 N HIS A 91 -4.953 1.461 3.949 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.400 1.393 2.577 1.00 0.00 C ATOM 1457 C HIS A 91 -6.912 1.184 2.512 1.00 0.00 C ATOM 1458 O HIS A 91 -7.584 1.691 1.613 1.00 0.00 O ATOM 1459 CB HIS A 91 -4.627 0.279 1.881 1.00 0.00 C ATOM 1460 CG HIS A 91 -4.371 0.586 0.438 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -3.202 1.107 -0.075 1.00 0.00 N ATOM 1462 CD2 HIS A 91 -5.229 0.349 -0.599 1.00 0.00 C ATOM 1463 CE1 HIS A 91 -3.320 1.103 -1.410 1.00 0.00 C ATOM 1464 NE2 HIS A 91 -4.527 0.637 -1.768 1.00 0.00 N ATOM 0 H HIS A 91 -4.516 0.606 4.293 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.202 2.333 2.061 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -3.677 0.124 2.392 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -5.187 -0.653 1.959 1.00 0.00 H new ATOM 0 HD1 HIS A 91 -2.398 1.434 0.461 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -6.250 0.006 -0.527 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -2.554 1.428 -2.099 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.467 0.463 3.490 1.00 0.00 N ATOM 1473 CA LEU A 92 -8.895 0.205 3.546 1.00 0.00 C ATOM 1474 C LEU A 92 -9.633 1.528 3.665 1.00 0.00 C ATOM 1475 O LEU A 92 -10.593 1.760 2.921 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.264 -0.743 4.697 1.00 0.00 C ATOM 1477 CG LEU A 92 -8.776 -2.175 4.434 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -8.831 -3.014 5.712 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -9.614 -2.855 3.349 1.00 0.00 C ATOM 0 H LEU A 92 -6.938 0.048 4.257 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.195 -0.297 2.626 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -8.827 -0.375 5.625 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.346 -0.747 4.833 1.00 0.00 H new ATOM 0 HG LEU A 92 -7.743 -2.106 4.093 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -8.480 -4.024 5.500 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.194 -2.561 6.472 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.858 -3.055 6.076 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -9.245 -3.867 3.185 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.656 -2.896 3.666 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -9.539 -2.287 2.422 1.00 0.00 H new ATOM 1491 N VAL A 93 -9.173 2.380 4.582 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.793 3.684 4.783 1.00 0.00 C ATOM 1493 C VAL A 93 -9.566 4.612 3.580 1.00 0.00 C ATOM 1494 O VAL A 93 -10.513 5.296 3.204 1.00 0.00 O ATOM 1495 CB VAL A 93 -9.400 4.281 6.149 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -7.899 4.528 6.310 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -10.191 5.552 6.482 1.00 0.00 C ATOM 0 H VAL A 93 -8.378 2.190 5.192 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.875 3.557 4.829 1.00 0.00 H new ATOM 0 HB VAL A 93 -9.669 3.509 6.870 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -7.703 4.948 7.296 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.362 3.586 6.204 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -7.561 5.226 5.544 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -9.876 5.932 7.454 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -10.004 6.307 5.719 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -11.256 5.321 6.510 1.00 0.00 H new ATOM 1507 N LEU A 94 -8.389 4.608 2.926 1.00 0.00 N ATOM 1508 CA LEU A 94 -8.154 5.494 1.771 1.00 0.00 C ATOM 1509 C LEU A 94 -9.204 5.273 0.693 1.00 0.00 C ATOM 1510 O LEU A 94 -9.738 6.234 0.142 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.718 5.398 1.192 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.445 4.463 -0.007 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.822 5.049 -1.380 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -4.945 4.165 -0.101 1.00 0.00 C ATOM 0 H LEU A 94 -7.599 4.012 3.172 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.250 6.512 2.147 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.416 6.403 0.898 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.058 5.091 2.003 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.062 3.586 0.189 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.595 4.323 -2.160 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.887 5.279 -1.397 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.251 5.961 -1.556 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -4.758 3.505 -0.948 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.397 5.097 -0.239 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.612 3.680 0.817 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.493 4.007 0.384 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.466 3.671 -0.639 1.00 0.00 C ATOM 1528 C LEU A 95 -11.834 4.164 -0.192 1.00 0.00 C ATOM 1529 O LEU A 95 -12.482 4.925 -0.898 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.476 2.162 -0.889 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.226 1.629 -1.627 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -9.245 0.097 -1.651 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.124 2.125 -3.076 1.00 0.00 C ATOM 0 H LEU A 95 -9.061 3.200 0.834 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.201 4.156 -1.579 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.565 1.648 0.068 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.362 1.908 -1.471 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.365 2.008 -1.076 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.361 -0.270 -2.173 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -9.247 -0.283 -0.629 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.140 -0.248 -2.168 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.226 1.716 -3.538 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.001 1.798 -3.635 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.073 3.214 -3.085 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.269 3.760 0.997 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.562 4.177 1.521 1.00 0.00 C ATOM 1547 C ALA A 96 -13.732 5.704 1.578 1.00 0.00 C ATOM 1548 O ALA A 96 -14.863 6.180 1.547 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.752 3.570 2.904 1.00 0.00 C ATOM 0 H ALA A 96 -11.743 3.143 1.616 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.327 3.816 0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.718 3.876 3.306 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.717 2.483 2.832 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.958 3.916 3.565 1.00 0.00 H new ATOM 1555 N GLU A 97 -12.645 6.480 1.626 1.00 0.00 N ATOM 1556 CA GLU A 97 -12.716 7.936 1.684 1.00 0.00 C ATOM 1557 C GLU A 97 -12.725 8.592 0.305 1.00 0.00 C ATOM 1558 O GLU A 97 -13.228 9.708 0.154 1.00 0.00 O ATOM 1559 CB GLU A 97 -11.519 8.431 2.504 1.00 0.00 C ATOM 1560 CG GLU A 97 -11.572 9.911 2.917 1.00 0.00 C ATOM 1561 CD GLU A 97 -12.831 10.244 3.722 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -13.895 10.539 3.128 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -12.784 10.184 4.972 1.00 0.00 O ATOM 0 H GLU A 97 -11.693 6.113 1.626 1.00 0.00 H new ATOM 0 HA GLU A 97 -13.660 8.217 2.151 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -11.440 7.822 3.405 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -10.610 8.265 1.926 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.690 10.152 3.510 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -11.538 10.536 2.025 1.00 0.00 H new ATOM 1570 N LEU A 98 -12.171 7.931 -0.714 1.00 0.00 N ATOM 1571 CA LEU A 98 -12.114 8.490 -2.062 1.00 0.00 C ATOM 1572 C LEU A 98 -13.218 7.922 -2.952 1.00 0.00 C ATOM 1573 O LEU A 98 -13.459 8.447 -4.043 1.00 0.00 O ATOM 1574 CB LEU A 98 -10.710 8.268 -2.648 1.00 0.00 C ATOM 1575 CG LEU A 98 -9.588 8.976 -1.864 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.232 8.494 -2.382 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -9.668 10.498 -1.997 1.00 0.00 C ATOM 0 H LEU A 98 -11.754 7.004 -0.628 1.00 0.00 H new ATOM 0 HA LEU A 98 -12.295 9.564 -2.013 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -10.503 7.198 -2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.697 8.620 -3.679 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.708 8.727 -0.810 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.434 8.992 -1.831 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.152 7.416 -2.243 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.143 8.730 -3.442 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.858 10.956 -1.429 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.577 10.777 -3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -10.625 10.847 -1.610 1.00 0.00 H new ATOM 1589 N LEU A 99 -13.888 6.863 -2.507 1.00 0.00 N ATOM 1590 CA LEU A 99 -14.976 6.195 -3.216 1.00 0.00 C ATOM 1591 C LEU A 99 -15.964 5.602 -2.192 1.00 0.00 C ATOM 1592 O LEU A 99 -16.157 4.381 -2.144 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.453 5.195 -4.276 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.347 4.208 -3.843 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -13.297 3.006 -4.790 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -11.940 4.822 -3.897 1.00 0.00 C ATOM 0 H LEU A 99 -13.680 6.429 -1.607 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.536 6.921 -3.805 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -15.301 4.612 -4.636 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -14.078 5.769 -5.123 1.00 0.00 H new ATOM 0 HG LEU A 99 -13.602 3.930 -2.820 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -12.512 2.322 -4.469 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -14.257 2.490 -4.774 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -13.087 3.349 -5.803 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -11.207 4.080 -3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -11.720 5.139 -4.917 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -11.893 5.684 -3.231 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.639 6.461 -1.398 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.603 6.068 -0.371 1.00 0.00 C ATOM 1610 C PRO A 100 -18.895 5.465 -0.931 1.00 0.00 C ATOM 1611 O PRO A 100 -19.781 5.107 -0.157 1.00 0.00 O ATOM 1612 CB PRO A 100 -17.887 7.341 0.436 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.655 8.454 -0.573 1.00 0.00 C ATOM 1614 CD PRO A 100 -16.491 7.909 -1.386 1.00 0.00 C ATOM 0 HA PRO A 100 -17.185 5.270 0.242 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -18.906 7.354 0.822 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -17.221 7.430 1.294 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.535 8.634 -1.191 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -17.407 9.398 -0.088 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -16.505 8.309 -2.400 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.538 8.198 -0.942 1.00 0.00 H new ATOM 1622 N ASP A 101 -19.059 5.406 -2.253 1.00 0.00 N ATOM 1623 CA ASP A 101 -20.244 4.819 -2.905 1.00 0.00 C ATOM 1624 C ASP A 101 -19.972 3.356 -3.239 1.00 0.00 C ATOM 1625 O ASP A 101 -20.892 2.617 -3.600 1.00 0.00 O ATOM 1626 CB ASP A 101 -20.613 5.544 -4.208 1.00 0.00 C ATOM 1627 CG ASP A 101 -21.198 6.923 -3.951 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -20.501 7.745 -3.315 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -22.356 7.180 -4.342 1.00 0.00 O ATOM 0 H ASP A 101 -18.370 5.766 -2.913 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.074 4.919 -2.206 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -19.725 5.638 -4.833 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -21.333 4.944 -4.765 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.701 2.951 -3.169 1.00 0.00 N ATOM 1635 CA TRP A 102 -18.263 1.603 -3.446 1.00 0.00 C ATOM 1636 C TRP A 102 -18.265 0.830 -2.128 1.00 0.00 C ATOM 1637 O TRP A 102 -18.920 -0.207 -2.052 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.894 1.658 -4.148 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.454 0.417 -4.866 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -17.208 -0.288 -5.737 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -15.199 -0.320 -4.755 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.514 -1.396 -6.175 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -15.282 -1.487 -5.571 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -14.029 -0.168 -3.984 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -14.289 -2.475 -5.575 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -13.013 -1.139 -4.001 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -13.162 -2.310 -4.759 1.00 0.00 C ATOM 0 H TRP A 102 -17.938 3.576 -2.911 1.00 0.00 H new ATOM 0 HA TRP A 102 -18.929 1.075 -4.128 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -16.913 2.478 -4.866 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -16.139 1.905 -3.402 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -18.208 -0.023 -6.045 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.869 -2.063 -6.860 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.911 0.711 -3.368 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.391 -3.351 -6.198 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -12.112 -0.983 -3.427 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.409 -3.083 -4.714 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.529 1.302 -1.110 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.450 0.644 0.193 1.00 0.00 C ATOM 1660 C LEU A 103 -18.290 1.382 1.219 1.00 0.00 C ATOM 1661 O LEU A 103 -18.063 2.570 1.453 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.007 0.623 0.730 1.00 0.00 C ATOM 1663 CG LEU A 103 -15.807 -0.461 1.797 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -15.620 -1.819 1.103 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -14.582 -0.116 2.642 1.00 0.00 C ATOM 0 H LEU A 103 -16.972 2.154 -1.173 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.813 -0.373 0.046 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.316 0.452 -0.095 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -15.763 1.598 1.153 1.00 0.00 H new ATOM 0 HG LEU A 103 -16.678 -0.514 2.450 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -15.477 -2.595 1.855 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -16.504 -2.048 0.508 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -14.746 -1.778 0.453 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.436 -0.884 3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.701 -0.066 2.002 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -14.734 0.849 3.126 1.00 0.00 H new ATOM 1677 N SER A 104 -19.192 0.673 1.884 1.00 0.00 N ATOM 1678 CA SER A 104 -20.035 1.253 2.912 1.00 0.00 C ATOM 1679 C SER A 104 -20.184 0.266 4.057 1.00 0.00 C ATOM 1680 O SER A 104 -20.470 -0.913 3.841 1.00 0.00 O ATOM 1681 CB SER A 104 -21.366 1.735 2.346 1.00 0.00 C ATOM 1682 OG SER A 104 -21.877 0.977 1.267 1.00 0.00 O ATOM 0 H SER A 104 -19.357 -0.321 1.723 1.00 0.00 H new ATOM 0 HA SER A 104 -19.559 2.149 3.310 1.00 0.00 H new ATOM 0 HB2 SER A 104 -22.104 1.736 3.149 1.00 0.00 H new ATOM 0 HB3 SER A 104 -21.249 2.768 2.019 1.00 0.00 H new ATOM 0 HG SER A 104 -22.730 1.359 0.974 1.00 0.00 H new ATOM 1688 N LEU A 105 -19.902 0.708 5.282 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.025 -0.149 6.454 1.00 0.00 C ATOM 1690 C LEU A 105 -21.415 0.044 7.040 1.00 0.00 C ATOM 1691 O LEU A 105 -22.084 1.039 6.764 1.00 0.00 O ATOM 1692 CB LEU A 105 -18.846 0.028 7.432 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.920 1.188 8.439 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -19.636 0.796 9.741 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.495 1.610 8.819 1.00 0.00 C ATOM 0 H LEU A 105 -19.587 1.656 5.486 1.00 0.00 H new ATOM 0 HA LEU A 105 -19.943 -1.201 6.181 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -18.736 -0.899 7.995 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -17.937 0.153 6.843 1.00 0.00 H new ATOM 0 HG LEU A 105 -19.479 1.991 7.958 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -19.659 1.652 10.415 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -20.656 0.483 9.516 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -19.101 -0.026 10.217 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -17.537 2.432 9.533 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -16.973 0.765 9.269 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -16.961 1.932 7.925 1.00 0.00 H new ATOM 1707 N HIS A 106 -21.871 -0.928 7.818 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.168 -0.907 8.467 1.00 0.00 C ATOM 1709 C HIS A 106 -22.983 -1.450 9.877 1.00 0.00 C ATOM 1710 O HIS A 106 -22.602 -2.612 10.051 1.00 0.00 O ATOM 1711 CB HIS A 106 -24.206 -1.698 7.670 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.512 -1.100 6.320 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -25.323 -0.015 6.067 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -24.015 -1.532 5.124 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -25.329 0.191 4.740 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.570 -0.729 4.116 1.00 0.00 N ATOM 0 H HIS A 106 -21.334 -1.772 8.018 1.00 0.00 H new ATOM 0 HA HIS A 106 -23.554 0.111 8.516 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -23.847 -2.718 7.534 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -25.128 -1.759 8.249 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -23.320 -2.346 4.980 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -25.868 0.984 4.243 1.00 0.00 H new ATOM 0 HE2 HIS A 106 -24.427 -0.824 3.111 1.00 0.00 H new ATOM 1724 N ARG A 107 -23.171 -0.597 10.886 1.00 0.00 N ATOM 1725 CA ARG A 107 -23.035 -0.990 12.283 1.00 0.00 C ATOM 1726 C ARG A 107 -24.388 -1.537 12.722 1.00 0.00 C ATOM 1727 O ARG A 107 -25.334 -0.764 12.897 1.00 0.00 O ATOM 1728 CB ARG A 107 -22.566 0.200 13.145 1.00 0.00 C ATOM 1729 CG ARG A 107 -21.556 -0.259 14.210 1.00 0.00 C ATOM 1730 CD ARG A 107 -20.124 0.096 13.782 1.00 0.00 C ATOM 1731 NE ARG A 107 -19.822 1.514 14.019 1.00 0.00 N ATOM 1732 CZ ARG A 107 -19.318 2.029 15.143 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -19.052 1.266 16.195 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -19.078 3.331 15.195 1.00 0.00 N ATOM 0 H ARG A 107 -23.421 0.383 10.754 1.00 0.00 H new ATOM 0 HA ARG A 107 -22.272 -1.759 12.409 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -22.110 0.958 12.508 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -23.425 0.665 13.629 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -21.785 0.215 15.165 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -21.641 -1.335 14.360 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -19.416 -0.524 14.332 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -19.993 -0.132 12.724 1.00 0.00 H new ATOM 0 HE ARG A 107 -20.015 2.163 13.256 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -19.232 0.263 16.156 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -18.667 1.682 17.043 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -19.278 3.919 14.386 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -18.693 3.745 16.044 1.00 0.00 H new ATOM 1748 N ILE A 108 -24.528 -2.855 12.810 1.00 0.00 N ATOM 1749 CA ILE A 108 -25.773 -3.500 13.213 1.00 0.00 C ATOM 1750 C ILE A 108 -25.636 -3.820 14.700 1.00 0.00 C ATOM 1751 O ILE A 108 -24.543 -4.147 15.166 1.00 0.00 O ATOM 1752 CB ILE A 108 -26.039 -4.784 12.386 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -25.570 -4.746 10.914 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.530 -5.151 12.446 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.271 -3.729 10.008 1.00 0.00 C ATOM 0 H ILE A 108 -23.775 -3.511 12.602 1.00 0.00 H new ATOM 0 HA ILE A 108 -26.624 -2.843 13.032 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.423 -5.548 12.859 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -24.500 -4.537 10.900 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.707 -5.739 10.485 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.706 -6.054 11.862 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -27.820 -5.326 13.482 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.123 -4.333 12.037 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -25.859 -3.794 9.001 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.339 -3.944 9.978 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -26.114 -2.724 10.400 1.00 0.00 H new ATOM 1767 N ARG A 109 -26.743 -3.814 15.451 1.00 0.00 N ATOM 1768 CA ARG A 109 -26.746 -4.102 16.893 1.00 0.00 C ATOM 1769 C ARG A 109 -26.074 -5.433 17.270 1.00 0.00 C ATOM 1770 O ARG A 109 -25.677 -5.619 18.422 1.00 0.00 O ATOM 1771 CB ARG A 109 -28.185 -4.032 17.439 1.00 0.00 C ATOM 1772 CG ARG A 109 -29.148 -5.051 16.790 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.439 -5.261 17.590 1.00 0.00 C ATOM 1774 NE ARG A 109 -30.153 -5.894 18.887 1.00 0.00 N ATOM 1775 CZ ARG A 109 -30.927 -6.683 19.634 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -32.196 -6.915 19.297 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -30.404 -7.225 20.727 1.00 0.00 N ATOM 0 H ARG A 109 -27.668 -3.608 15.075 1.00 0.00 H new ATOM 0 HA ARG A 109 -26.135 -3.332 17.363 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -28.164 -4.201 18.516 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -28.575 -3.026 17.282 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.402 -4.711 15.786 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -28.636 -6.007 16.683 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -30.933 -4.303 17.749 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -31.128 -5.884 17.020 1.00 0.00 H new ATOM 0 HE ARG A 109 -29.228 -5.701 19.271 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -32.587 -6.487 18.458 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -32.775 -7.521 19.878 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -29.434 -7.034 20.977 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -30.972 -7.832 21.317 1.00 0.00 H new ATOM 1791 N THR A 110 -26.001 -6.365 16.327 1.00 0.00 N ATOM 1792 CA THR A 110 -25.405 -7.675 16.479 1.00 0.00 C ATOM 1793 C THR A 110 -23.905 -7.612 16.181 1.00 0.00 C ATOM 1794 O THR A 110 -23.115 -8.263 16.873 1.00 0.00 O ATOM 1795 CB THR A 110 -26.185 -8.649 15.568 1.00 0.00 C ATOM 1796 OG1 THR A 110 -25.677 -9.958 15.551 1.00 0.00 O ATOM 1797 CG2 THR A 110 -26.295 -8.228 14.097 1.00 0.00 C ATOM 0 H THR A 110 -26.377 -6.214 15.391 1.00 0.00 H new ATOM 0 HA THR A 110 -25.478 -8.039 17.504 1.00 0.00 H new ATOM 0 HB THR A 110 -27.167 -8.615 16.039 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.223 -10.513 14.955 1.00 0.00 H new ATOM 0 HG21 THR A 110 -26.860 -8.979 13.545 1.00 0.00 H new ATOM 0 HG22 THR A 110 -26.806 -7.268 14.031 1.00 0.00 H new ATOM 0 HG23 THR A 110 -25.297 -8.138 13.669 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.496 -6.868 15.146 1.00 0.00 N ATOM 1806 CA ASP A 111 -22.100 -6.758 14.739 1.00 0.00 C ATOM 1807 C ASP A 111 -21.935 -5.748 13.612 1.00 0.00 C ATOM 1808 O ASP A 111 -22.921 -5.278 13.040 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.577 -8.128 14.235 1.00 0.00 C ATOM 1810 CG ASP A 111 -20.096 -8.362 14.530 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.493 -7.602 15.320 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.542 -9.370 14.042 1.00 0.00 O ATOM 0 H ASP A 111 -24.134 -6.323 14.566 1.00 0.00 H new ATOM 0 HA ASP A 111 -21.533 -6.431 15.610 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -22.161 -8.923 14.698 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.740 -8.197 13.159 1.00 0.00 H new ATOM 1817 N THR A 112 -20.692 -5.429 13.273 1.00 0.00 N ATOM 1818 CA THR A 112 -20.360 -4.493 12.216 1.00 0.00 C ATOM 1819 C THR A 112 -20.055 -5.287 10.942 1.00 0.00 C ATOM 1820 O THR A 112 -19.443 -6.354 10.998 1.00 0.00 O ATOM 1821 CB THR A 112 -19.178 -3.630 12.677 1.00 0.00 C ATOM 1822 OG1 THR A 112 -19.445 -3.086 13.958 1.00 0.00 O ATOM 1823 CG2 THR A 112 -18.966 -2.480 11.692 1.00 0.00 C ATOM 0 H THR A 112 -19.874 -5.824 13.737 1.00 0.00 H new ATOM 0 HA THR A 112 -21.189 -3.820 11.995 1.00 0.00 H new ATOM 0 HB THR A 112 -18.286 -4.254 12.721 1.00 0.00 H new ATOM 0 HG1 THR A 112 -18.631 -2.673 14.314 1.00 0.00 H new ATOM 0 HG21 THR A 112 -18.126 -1.869 12.022 1.00 0.00 H new ATOM 0 HG22 THR A 112 -18.755 -2.883 10.702 1.00 0.00 H new ATOM 0 HG23 THR A 112 -19.866 -1.867 11.649 1.00 0.00 H new ATOM 1831 N TYR A 113 -20.459 -4.769 9.782 1.00 0.00 N ATOM 1832 CA TYR A 113 -20.250 -5.402 8.484 1.00 0.00 C ATOM 1833 C TYR A 113 -19.875 -4.330 7.465 1.00 0.00 C ATOM 1834 O TYR A 113 -20.101 -3.142 7.705 1.00 0.00 O ATOM 1835 CB TYR A 113 -21.546 -6.095 8.016 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.128 -7.163 8.926 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -22.814 -6.785 10.093 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.050 -8.527 8.585 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.421 -7.743 10.918 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -22.673 -9.495 9.391 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.356 -9.105 10.563 1.00 0.00 C ATOM 1842 OH TYR A 113 -24.000 -10.038 11.312 1.00 0.00 O ATOM 0 H TYR A 113 -20.951 -3.878 9.720 1.00 0.00 H new ATOM 0 HA TYR A 113 -19.455 -6.142 8.572 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -22.305 -5.327 7.867 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -21.355 -6.547 7.043 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -22.875 -5.740 10.359 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -21.509 -8.830 7.701 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -23.934 -7.439 11.818 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -22.629 -10.538 9.114 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.852 -10.927 10.926 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.351 -4.744 6.314 1.00 0.00 N ATOM 1853 CA VAL A 114 -18.959 -3.877 5.209 1.00 0.00 C ATOM 1854 C VAL A 114 -19.551 -4.481 3.945 1.00 0.00 C ATOM 1855 O VAL A 114 -19.388 -5.680 3.683 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.428 -3.705 5.119 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -16.936 -3.390 3.706 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -16.931 -2.518 5.950 1.00 0.00 C ATOM 0 H VAL A 114 -19.182 -5.731 6.119 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.342 -2.868 5.360 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.047 -4.662 5.475 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -15.851 -3.282 3.714 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.215 -4.202 3.034 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.391 -2.461 3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -15.848 -2.436 5.856 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.397 -1.601 5.589 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.194 -2.671 6.997 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.291 -3.644 3.226 1.00 0.00 N ATOM 1869 CA LYS A 115 -20.963 -3.884 1.964 1.00 0.00 C ATOM 1870 C LYS A 115 -20.024 -3.345 0.890 1.00 0.00 C ATOM 1871 O LYS A 115 -19.291 -2.381 1.131 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.251 -3.025 1.920 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.581 -3.785 1.924 1.00 0.00 C ATOM 1874 CD LYS A 115 -23.910 -4.504 0.605 1.00 0.00 C ATOM 1875 CE LYS A 115 -23.929 -3.621 -0.655 1.00 0.00 C ATOM 1876 NZ LYS A 115 -24.899 -2.512 -0.551 1.00 0.00 N ATOM 0 H LYS A 115 -20.447 -2.689 3.548 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.206 -4.938 1.829 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.241 -2.351 2.777 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.216 -2.404 1.025 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.562 -4.520 2.729 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -24.384 -3.084 2.151 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -23.181 -5.300 0.456 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -24.885 -4.980 0.706 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -22.932 -3.214 -0.825 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -24.174 -4.235 -1.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -24.875 -1.946 -1.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -25.855 -2.898 -0.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -24.651 -1.909 0.259 1.00 0.00 H new ATOM 1890 N LEU A 116 -20.046 -3.970 -0.281 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.265 -3.548 -1.433 1.00 0.00 C ATOM 1892 C LEU A 116 -20.227 -3.613 -2.596 1.00 0.00 C ATOM 1893 O LEU A 116 -21.235 -4.330 -2.544 1.00 0.00 O ATOM 1894 CB LEU A 116 -17.982 -4.346 -1.654 1.00 0.00 C ATOM 1895 CG LEU A 116 -17.005 -3.737 -2.683 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -17.287 -4.055 -4.157 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.647 -2.270 -2.468 1.00 0.00 C ATOM 0 H LEU A 116 -20.616 -4.797 -0.458 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.873 -2.541 -1.289 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.465 -4.446 -0.700 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.249 -5.352 -1.979 1.00 0.00 H new ATOM 0 HG LEU A 116 -16.101 -4.297 -2.444 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -16.536 -3.574 -4.783 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -17.250 -5.134 -4.310 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -18.276 -3.684 -4.426 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -15.956 -1.946 -3.246 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -17.552 -1.664 -2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -16.176 -2.150 -1.492 1.00 0.00 H new ATOM 1909 N ASP A 117 -19.926 -2.839 -3.624 1.00 0.00 N ATOM 1910 CA ASP A 117 -20.769 -2.740 -4.801 1.00 0.00 C ATOM 1911 C ASP A 117 -20.076 -3.071 -6.115 1.00 0.00 C ATOM 1912 O ASP A 117 -19.269 -2.305 -6.650 1.00 0.00 O ATOM 1913 CB ASP A 117 -21.436 -1.371 -4.825 1.00 0.00 C ATOM 1914 CG ASP A 117 -22.899 -1.543 -5.169 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -23.681 -1.897 -4.258 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -23.253 -1.393 -6.358 1.00 0.00 O ATOM 0 H ASP A 117 -19.087 -2.260 -3.665 1.00 0.00 H new ATOM 0 HA ASP A 117 -21.528 -3.518 -4.715 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -21.332 -0.884 -3.855 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -20.950 -0.728 -5.558 1.00 0.00 H new ATOM 1921 N LYS A 118 -20.360 -4.250 -6.648 1.00 0.00 N ATOM 1922 CA LYS A 118 -19.785 -4.683 -7.922 1.00 0.00 C ATOM 1923 C LYS A 118 -20.422 -3.958 -9.105 1.00 0.00 C ATOM 1924 O LYS A 118 -19.874 -4.055 -10.209 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.922 -6.203 -8.109 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.993 -6.934 -7.140 1.00 0.00 C ATOM 1927 CD LYS A 118 -18.785 -8.428 -7.427 1.00 0.00 C ATOM 1928 CE LYS A 118 -18.313 -8.706 -8.864 1.00 0.00 C ATOM 1929 NZ LYS A 118 -17.091 -7.965 -9.241 1.00 0.00 N ATOM 0 H LYS A 118 -20.988 -4.930 -6.219 1.00 0.00 H new ATOM 0 HA LYS A 118 -18.726 -4.427 -7.892 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.954 -6.508 -7.936 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -19.677 -6.475 -9.136 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -18.021 -6.440 -7.153 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.391 -6.827 -6.131 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -18.052 -8.828 -6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -19.720 -8.960 -7.249 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -18.129 -9.774 -8.976 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -19.113 -8.446 -9.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -16.869 -8.147 -10.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -17.246 -6.946 -9.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -16.297 -8.280 -8.647 1.00 0.00 H new ATOM 1943 N ALA A 119 -21.554 -3.275 -8.906 1.00 0.00 N ATOM 1944 CA ALA A 119 -22.225 -2.572 -9.991 1.00 0.00 C ATOM 1945 C ALA A 119 -21.416 -1.363 -10.461 1.00 0.00 C ATOM 1946 O ALA A 119 -21.435 -1.056 -11.653 1.00 0.00 O ATOM 1947 CB ALA A 119 -23.635 -2.158 -9.574 1.00 0.00 C ATOM 0 H ALA A 119 -22.020 -3.197 -8.002 1.00 0.00 H new ATOM 0 HA ALA A 119 -22.304 -3.259 -10.834 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -24.119 -1.634 -10.398 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -24.214 -3.045 -9.318 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -23.579 -1.498 -8.708 1.00 0.00 H new ATOM 1953 N VAL A 120 -20.670 -0.707 -9.566 1.00 0.00 N ATOM 1954 CA VAL A 120 -19.856 0.450 -9.920 1.00 0.00 C ATOM 1955 C VAL A 120 -18.801 -0.001 -10.935 1.00 0.00 C ATOM 1956 O VAL A 120 -18.195 -1.068 -10.768 1.00 0.00 O ATOM 1957 CB VAL A 120 -19.212 1.062 -8.657 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -18.454 2.349 -8.993 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -20.247 1.427 -7.585 1.00 0.00 C ATOM 0 H VAL A 120 -20.617 -0.965 -8.581 1.00 0.00 H new ATOM 0 HA VAL A 120 -20.473 1.229 -10.368 1.00 0.00 H new ATOM 0 HB VAL A 120 -18.540 0.293 -8.275 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -18.011 2.758 -8.085 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -17.667 2.130 -9.714 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -19.144 3.077 -9.420 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -19.740 1.853 -6.719 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -20.948 2.157 -7.990 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -20.790 0.531 -7.283 1.00 0.00 H new ATOM 1969 N ASP A 121 -18.590 0.764 -12.009 1.00 0.00 N ATOM 1970 CA ASP A 121 -17.585 0.406 -12.999 1.00 0.00 C ATOM 1971 C ASP A 121 -16.217 0.661 -12.392 1.00 0.00 C ATOM 1972 O ASP A 121 -15.837 1.805 -12.126 1.00 0.00 O ATOM 1973 CB ASP A 121 -17.700 1.176 -14.311 1.00 0.00 C ATOM 1974 CG ASP A 121 -16.646 0.717 -15.333 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -15.882 -0.250 -15.097 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -16.613 1.328 -16.426 1.00 0.00 O ATOM 0 H ASP A 121 -19.098 1.625 -12.210 1.00 0.00 H new ATOM 0 HA ASP A 121 -17.739 -0.643 -13.250 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -18.697 1.037 -14.729 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -17.581 2.242 -14.119 1.00 0.00 H new ATOM 1981 N LEU A 122 -15.479 -0.422 -12.170 1.00 0.00 N ATOM 1982 CA LEU A 122 -14.143 -0.389 -11.611 1.00 0.00 C ATOM 1983 C LEU A 122 -13.243 0.508 -12.456 1.00 0.00 C ATOM 1984 O LEU A 122 -12.364 1.140 -11.900 1.00 0.00 O ATOM 1985 CB LEU A 122 -13.611 -1.824 -11.539 1.00 0.00 C ATOM 1986 CG LEU A 122 -12.499 -2.116 -10.513 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -11.147 -1.475 -10.772 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -12.915 -1.848 -9.062 1.00 0.00 C ATOM 0 H LEU A 122 -15.806 -1.365 -12.380 1.00 0.00 H new ATOM 0 HA LEU A 122 -14.160 0.030 -10.605 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -14.451 -2.484 -11.323 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -13.238 -2.095 -12.527 1.00 0.00 H new ATOM 0 HG LEU A 122 -12.359 -3.187 -10.663 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -10.453 -1.757 -9.980 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -10.760 -1.816 -11.732 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -11.256 -0.391 -10.790 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -12.082 -2.076 -8.397 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -13.192 -0.800 -8.951 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -13.767 -2.478 -8.805 1.00 0.00 H new ATOM 2000 N ALA A 123 -13.449 0.599 -13.772 1.00 0.00 N ATOM 2001 CA ALA A 123 -12.640 1.442 -14.650 1.00 0.00 C ATOM 2002 C ALA A 123 -12.666 2.894 -14.161 1.00 0.00 C ATOM 2003 O ALA A 123 -11.618 3.525 -14.023 1.00 0.00 O ATOM 2004 CB ALA A 123 -13.141 1.337 -16.096 1.00 0.00 C ATOM 0 H ALA A 123 -14.185 0.087 -14.259 1.00 0.00 H new ATOM 0 HA ALA A 123 -11.607 1.094 -14.624 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -12.530 1.970 -16.740 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -13.070 0.302 -16.431 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -14.180 1.664 -16.146 1.00 0.00 H new ATOM 2010 N GLY A 124 -13.861 3.416 -13.863 1.00 0.00 N ATOM 2011 CA GLY A 124 -14.014 4.782 -13.377 1.00 0.00 C ATOM 2012 C GLY A 124 -13.329 4.952 -12.025 1.00 0.00 C ATOM 2013 O GLY A 124 -12.900 6.055 -11.680 1.00 0.00 O ATOM 0 H GLY A 124 -14.739 2.905 -13.953 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -13.587 5.480 -14.097 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -15.073 5.025 -13.287 1.00 0.00 H new ATOM 2017 N LEU A 125 -13.250 3.870 -11.243 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.606 3.854 -9.943 1.00 0.00 C ATOM 2019 C LEU A 125 -11.098 3.879 -10.186 1.00 0.00 C ATOM 2020 O LEU A 125 -10.450 4.790 -9.680 1.00 0.00 O ATOM 2021 CB LEU A 125 -13.074 2.682 -9.063 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.593 2.691 -8.786 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.990 1.506 -7.904 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -15.050 4.000 -8.128 1.00 0.00 C ATOM 0 H LEU A 125 -13.643 2.967 -11.510 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.892 4.733 -9.365 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.806 1.743 -9.548 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.539 2.714 -8.114 1.00 0.00 H new ATOM 0 HG LEU A 125 -15.092 2.606 -9.752 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -16.064 1.532 -7.722 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.730 0.575 -8.407 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -14.459 1.566 -6.954 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -16.125 3.962 -7.951 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.531 4.131 -7.179 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.820 4.838 -8.786 1.00 0.00 H new ATOM 2036 N THR A 126 -10.521 2.969 -10.978 1.00 0.00 N ATOM 2037 CA THR A 126 -9.090 2.952 -11.276 1.00 0.00 C ATOM 2038 C THR A 126 -8.626 4.321 -11.800 1.00 0.00 C ATOM 2039 O THR A 126 -7.580 4.812 -11.376 1.00 0.00 O ATOM 2040 CB THR A 126 -8.762 1.858 -12.312 1.00 0.00 C ATOM 2041 OG1 THR A 126 -9.361 0.625 -11.998 1.00 0.00 O ATOM 2042 CG2 THR A 126 -7.253 1.620 -12.369 1.00 0.00 C ATOM 0 H THR A 126 -11.041 2.218 -11.433 1.00 0.00 H new ATOM 0 HA THR A 126 -8.558 2.732 -10.350 1.00 0.00 H new ATOM 0 HB THR A 126 -9.149 2.217 -13.266 1.00 0.00 H new ATOM 0 HG1 THR A 126 -9.127 -0.036 -12.682 1.00 0.00 H new ATOM 0 HG21 THR A 126 -7.034 0.845 -13.104 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.750 2.544 -12.654 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.898 1.301 -11.389 1.00 0.00 H new ATOM 2050 N ALA A 127 -9.416 4.956 -12.675 1.00 0.00 N ATOM 2051 CA ALA A 127 -9.096 6.251 -13.253 1.00 0.00 C ATOM 2052 C ALA A 127 -8.969 7.306 -12.153 1.00 0.00 C ATOM 2053 O ALA A 127 -7.886 7.844 -11.930 1.00 0.00 O ATOM 2054 CB ALA A 127 -10.155 6.631 -14.297 1.00 0.00 C ATOM 0 H ALA A 127 -10.304 4.574 -13.000 1.00 0.00 H new ATOM 0 HA ALA A 127 -8.133 6.197 -13.761 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.910 7.602 -14.727 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.174 5.879 -15.086 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -11.134 6.682 -13.820 1.00 0.00 H new ATOM 2060 N ARG A 128 -10.055 7.595 -11.426 1.00 0.00 N ATOM 2061 CA ARG A 128 -10.007 8.610 -10.364 1.00 0.00 C ATOM 2062 C ARG A 128 -8.965 8.271 -9.296 1.00 0.00 C ATOM 2063 O ARG A 128 -8.348 9.179 -8.729 1.00 0.00 O ATOM 2064 CB ARG A 128 -11.405 8.857 -9.787 1.00 0.00 C ATOM 2065 CG ARG A 128 -11.923 7.694 -8.944 1.00 0.00 C ATOM 2066 CD ARG A 128 -13.366 7.893 -8.497 1.00 0.00 C ATOM 2067 NE ARG A 128 -14.303 7.571 -9.579 1.00 0.00 N ATOM 2068 CZ ARG A 128 -15.619 7.419 -9.411 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -16.189 7.691 -8.243 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -16.346 6.961 -10.419 1.00 0.00 N ATOM 0 H ARG A 128 -10.964 7.149 -11.549 1.00 0.00 H new ATOM 0 HA ARG A 128 -9.676 9.550 -10.805 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -11.384 9.759 -9.176 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -12.101 9.042 -10.605 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -11.849 6.771 -9.519 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -11.288 7.575 -8.066 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -13.573 7.262 -7.633 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -13.513 8.925 -8.180 1.00 0.00 H new ATOM 0 HE ARG A 128 -13.925 7.456 -10.519 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -15.621 8.020 -7.462 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -17.195 7.571 -8.126 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -15.899 6.730 -11.307 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -17.353 6.839 -10.308 1.00 0.00 H new ATOM 2084 N LEU A 129 -8.750 6.978 -9.033 1.00 0.00 N ATOM 2085 CA LEU A 129 -7.784 6.454 -8.073 1.00 0.00 C ATOM 2086 C LEU A 129 -6.415 6.965 -8.475 1.00 0.00 C ATOM 2087 O LEU A 129 -5.761 7.624 -7.670 1.00 0.00 O ATOM 2088 CB LEU A 129 -7.891 4.919 -7.993 1.00 0.00 C ATOM 2089 CG LEU A 129 -6.726 4.135 -7.354 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -7.263 2.770 -6.896 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -5.578 3.891 -8.351 1.00 0.00 C ATOM 0 H LEU A 129 -9.269 6.239 -9.506 1.00 0.00 H new ATOM 0 HA LEU A 129 -7.984 6.803 -7.060 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.798 4.678 -7.438 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.028 4.542 -9.007 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.335 4.721 -6.523 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -6.456 2.196 -6.440 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.060 2.918 -6.167 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.654 2.226 -7.756 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -4.780 3.336 -7.858 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -5.949 3.316 -9.200 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -5.191 4.848 -8.702 1.00 0.00 H new ATOM 2103 N ALA A 130 -6.022 6.721 -9.721 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.743 7.132 -10.259 1.00 0.00 C ATOM 2105 C ALA A 130 -4.636 8.642 -10.481 1.00 0.00 C ATOM 2106 O ALA A 130 -3.521 9.137 -10.615 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.540 6.395 -11.584 1.00 0.00 C ATOM 0 H ALA A 130 -6.602 6.220 -10.395 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.970 6.881 -9.533 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.582 6.683 -12.018 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.550 5.319 -11.407 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -5.343 6.657 -12.273 1.00 0.00 H new ATOM 2113 N HIS A 131 -5.745 9.386 -10.516 1.00 0.00 N ATOM 2114 CA HIS A 131 -5.726 10.829 -10.745 1.00 0.00 C ATOM 2115 C HIS A 131 -5.535 11.657 -9.470 1.00 0.00 C ATOM 2116 O HIS A 131 -5.208 12.837 -9.590 1.00 0.00 O ATOM 2117 CB HIS A 131 -6.966 11.253 -11.549 1.00 0.00 C ATOM 2118 CG HIS A 131 -7.009 10.703 -12.961 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -8.139 10.335 -13.662 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -5.934 10.482 -13.781 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -7.742 9.865 -14.856 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -6.404 9.926 -14.977 1.00 0.00 N ATOM 0 H HIS A 131 -6.681 9.002 -10.386 1.00 0.00 H new ATOM 0 HA HIS A 131 -4.839 11.048 -11.340 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -7.859 10.927 -11.017 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -7.001 12.342 -11.594 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -4.903 10.699 -13.546 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -8.409 9.488 -15.618 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -5.846 9.628 -15.777 1.00 0.00 H new ATOM 2130 N HIS A 132 -5.740 11.093 -8.268 1.00 0.00 N ATOM 2131 CA HIS A 132 -5.557 11.762 -6.963 1.00 0.00 C ATOM 2132 C HIS A 132 -6.188 13.170 -6.835 1.00 0.00 C ATOM 2133 O HIS A 132 -5.775 13.949 -5.977 1.00 0.00 O ATOM 2134 CB HIS A 132 -4.042 11.812 -6.682 1.00 0.00 C ATOM 2135 CG HIS A 132 -3.320 10.502 -6.899 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -2.377 10.245 -7.868 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -3.520 9.342 -6.200 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -2.005 8.963 -7.736 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -2.677 8.360 -6.736 1.00 0.00 N ATOM 0 H HIS A 132 -6.048 10.126 -8.172 1.00 0.00 H new ATOM 0 HA HIS A 132 -6.099 11.175 -6.221 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -3.592 12.571 -7.322 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -3.887 12.131 -5.651 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -4.208 9.207 -5.378 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -1.263 8.477 -8.352 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -2.590 7.390 -6.432 1.00 0.00 H new ATOM 2147 N VAL A 133 -7.196 13.501 -7.645 1.00 0.00 N ATOM 2148 CA VAL A 133 -7.895 14.785 -7.688 1.00 0.00 C ATOM 2149 C VAL A 133 -8.283 15.286 -6.299 1.00 0.00 C ATOM 2150 O VAL A 133 -8.001 16.440 -5.982 1.00 0.00 O ATOM 2151 CB VAL A 133 -9.115 14.700 -8.629 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -9.753 16.080 -8.837 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -8.725 14.122 -9.997 1.00 0.00 C ATOM 0 H VAL A 133 -7.567 12.840 -8.328 1.00 0.00 H new ATOM 0 HA VAL A 133 -7.202 15.524 -8.091 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.836 14.037 -8.151 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -10.610 15.988 -9.504 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -10.082 16.477 -7.877 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -9.021 16.757 -9.278 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -9.606 14.075 -10.637 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -7.973 14.761 -10.461 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -8.318 13.119 -9.866 1.00 0.00 H new ATOM 2163 N HIS A 134 -8.937 14.453 -5.485 1.00 0.00 N ATOM 2164 CA HIS A 134 -9.353 14.812 -4.128 1.00 0.00 C ATOM 2165 C HIS A 134 -8.599 13.998 -3.070 1.00 0.00 C ATOM 2166 O HIS A 134 -9.090 13.833 -1.949 1.00 0.00 O ATOM 2167 CB HIS A 134 -10.885 14.810 -3.997 1.00 0.00 C ATOM 2168 CG HIS A 134 -11.601 13.498 -4.221 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -12.205 12.725 -3.250 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -11.941 12.971 -5.439 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -12.896 11.755 -3.866 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -12.764 11.862 -5.202 1.00 0.00 N ATOM 0 H HIS A 134 -9.194 13.503 -5.752 1.00 0.00 H new ATOM 0 HA HIS A 134 -9.061 15.843 -3.927 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -11.138 15.165 -2.998 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -11.284 15.537 -4.705 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -11.631 13.342 -6.405 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -13.476 10.996 -3.362 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -13.182 11.253 -5.905 1.00 0.00 H new ATOM 2180 N ALA A 135 -7.448 13.429 -3.446 1.00 0.00 N ATOM 2181 CA ALA A 135 -6.620 12.625 -2.565 1.00 0.00 C ATOM 2182 C ALA A 135 -5.447 13.421 -1.993 1.00 0.00 C ATOM 2183 O ALA A 135 -5.060 14.482 -2.496 1.00 0.00 O ATOM 2184 CB ALA A 135 -6.126 11.384 -3.314 1.00 0.00 C ATOM 0 H ALA A 135 -7.067 13.521 -4.388 1.00 0.00 H new ATOM 0 HA ALA A 135 -7.231 12.315 -1.717 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -5.505 10.782 -2.651 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -6.981 10.794 -3.645 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -5.540 11.691 -4.180 1.00 0.00 H new ATOM 2190 N GLU A 136 -4.864 12.826 -0.962 1.00 0.00 N ATOM 2191 CA GLU A 136 -3.724 13.308 -0.175 1.00 0.00 C ATOM 2192 C GLU A 136 -2.714 12.178 0.019 1.00 0.00 C ATOM 2193 O GLU A 136 -1.507 12.402 -0.042 1.00 0.00 O ATOM 2194 CB GLU A 136 -4.195 13.890 1.173 1.00 0.00 C ATOM 2195 CG GLU A 136 -4.753 12.851 2.158 1.00 0.00 C ATOM 2196 CD GLU A 136 -5.876 13.376 3.050 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -6.847 13.970 2.515 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -5.872 13.061 4.263 1.00 0.00 O ATOM 0 H GLU A 136 -5.197 11.923 -0.623 1.00 0.00 H new ATOM 0 HA GLU A 136 -3.231 14.115 -0.718 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -3.358 14.405 1.644 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -4.963 14.639 0.982 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -5.122 11.994 1.595 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.940 12.492 2.789 1.00 0.00 H new ATOM 2205 N GLY A 137 -3.205 10.944 0.162 1.00 0.00 N ATOM 2206 CA GLY A 137 -2.398 9.758 0.357 1.00 0.00 C ATOM 2207 C GLY A 137 -2.710 9.089 1.685 1.00 0.00 C ATOM 2208 O GLY A 137 -1.782 8.877 2.466 1.00 0.00 O ATOM 0 H GLY A 137 -4.206 10.747 0.143 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.577 9.056 -0.457 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.342 10.025 0.321 1.00 0.00 H new ATOM 2212 N LEU A 138 -3.993 8.796 1.960 1.00 0.00 N ATOM 2213 CA LEU A 138 -4.378 8.124 3.204 1.00 0.00 C ATOM 2214 C LEU A 138 -3.614 6.816 3.262 1.00 0.00 C ATOM 2215 O LEU A 138 -3.038 6.511 4.329 1.00 0.00 O ATOM 2216 CB LEU A 138 -5.896 7.871 3.339 1.00 0.00 C ATOM 2217 CG LEU A 138 -6.651 8.907 4.185 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -7.046 10.080 3.297 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -7.912 8.310 4.815 1.00 0.00 C ATOM 0 H LEU A 138 -4.773 9.014 1.340 1.00 0.00 H new ATOM 0 HA LEU A 138 -4.129 8.779 4.039 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -6.336 7.847 2.342 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -6.048 6.885 3.778 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.992 9.235 4.989 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -7.583 10.821 3.890 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -6.150 10.534 2.874 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.688 9.726 2.491 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -8.419 9.072 5.406 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -8.579 7.957 4.029 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.637 7.475 5.460 1.00 0.00 H new TER 2231 LEU A 138