USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 966 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 112 SER OG : rot -72:sc= 0.291 USER MOD Set 1.2: A 115 GLN : amide:sc= -0.797 X(o=-0.51,f=-0.014) USER MOD Set 2.1: A 100 GLN : amide:sc= 0.0841 X(o=0.084,f=-0.28) USER MOD Set 2.2: A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 77 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 97 LYS NZ :NH3+ -108:sc= 0.339 (180deg=-0.0731) USER MOD Set 4.1: A 84 HIS : no HD1:sc= -5.61! K(o=-4.1!,f=-2.3) USER MOD Set 4.2: A 93 TYR OH : rot -159:sc= 1.49 USER MOD Set 5.1: A 7 ASN : amide:sc= 0.816 K(o=1.5,f=0.83) USER MOD Set 5.2: A 8 SER OG : rot 180:sc= 0.728 USER MOD Single : A 17 LYS NZ :NH3+ -111:sc= 0.0642 (180deg=-0.123) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 41:sc= 0.0834 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 TYR OH : rot 92:sc= 0.0368 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot -174:sc= 1.06 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 151:sc= 0.0985 USER MOD Single : A 37 LYS NZ :NH3+ -127:sc= -0.0551 (180deg=-0.104) USER MOD Single : A 38 TYR OH : rot 30:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00747) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot -118:sc= -0.0268 USER MOD Single : A 53 LYS NZ :NH3+ 152:sc= -1.17 (180deg=-2.06!) USER MOD Single : A 58 CYS SG : rot -56:sc= -0.592 USER MOD Single : A 65 THR OG1 : rot 82:sc= 0.0319 USER MOD Single : A 68 THR OG1 : rot 40:sc= 1.29 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -172:sc= -0.0043 (180deg=-0.0988) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot -61:sc= 0.105 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -51:sc= 1.25 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -114:sc= -0.329 (180deg=-1.94!) USER MOD Single : A 107 MET CE :methyl -168:sc= 0 (180deg=-0.153) USER MOD Single : A 117 ASN : amide:sc= -0.276 K(o=-0.28,f=-2) USER MOD Single : A 122 GLN : amide:sc= -0.84 K(o=-0.84,f=-2.4!) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 7 -14.204 12.457 -6.018 1.00 0.00 N ATOM 2 CA ASN A 7 -14.913 11.213 -5.915 1.00 0.00 C ATOM 3 C ASN A 7 -13.912 10.169 -5.473 1.00 0.00 C ATOM 4 O ASN A 7 -13.741 9.871 -4.291 1.00 0.00 O ATOM 5 CB ASN A 7 -15.629 10.857 -7.268 1.00 0.00 C ATOM 6 CG ASN A 7 -16.510 9.599 -7.193 1.00 0.00 C ATOM 7 OD1 ASN A 7 -17.655 9.671 -6.749 1.00 0.00 O ATOM 8 ND2 ASN A 7 -15.981 8.424 -7.620 1.00 0.00 N ATOM 0 HA ASN A 7 -15.716 11.271 -5.180 1.00 0.00 H new ATOM 0 HB2 ASN A 7 -16.245 11.702 -7.576 1.00 0.00 H new ATOM 0 HB3 ASN A 7 -14.874 10.715 -8.041 1.00 0.00 H new ATOM 0 HD21 ASN A 7 -16.536 7.569 -7.578 1.00 0.00 H new ATOM 0 HD22 ASN A 7 -15.028 8.396 -7.983 1.00 0.00 H new ATOM 15 N SER A 8 -13.227 9.555 -6.472 1.00 0.00 N ATOM 16 CA SER A 8 -12.314 8.421 -6.470 1.00 0.00 C ATOM 17 C SER A 8 -10.970 8.601 -5.786 1.00 0.00 C ATOM 18 O SER A 8 -9.946 8.130 -6.269 1.00 0.00 O ATOM 19 CB SER A 8 -12.078 7.959 -7.942 1.00 0.00 C ATOM 20 OG SER A 8 -13.311 7.961 -8.673 1.00 0.00 O ATOM 0 H SER A 8 -13.330 9.908 -7.424 1.00 0.00 H new ATOM 0 HA SER A 8 -12.821 7.675 -5.857 1.00 0.00 H new ATOM 0 HB2 SER A 8 -11.360 8.621 -8.426 1.00 0.00 H new ATOM 0 HB3 SER A 8 -11.645 6.959 -7.950 1.00 0.00 H new ATOM 0 HG SER A 8 -13.146 7.670 -9.594 1.00 0.00 H new ATOM 26 N PHE A 9 -10.972 9.268 -4.610 1.00 0.00 N ATOM 27 CA PHE A 9 -9.843 9.508 -3.734 1.00 0.00 C ATOM 28 C PHE A 9 -10.129 8.735 -2.516 1.00 0.00 C ATOM 29 O PHE A 9 -9.424 7.792 -2.229 1.00 0.00 O ATOM 30 CB PHE A 9 -9.636 11.019 -3.429 1.00 0.00 C ATOM 31 CG PHE A 9 -8.327 11.432 -2.815 1.00 0.00 C ATOM 32 CD1 PHE A 9 -7.140 10.728 -2.931 1.00 0.00 C ATOM 33 CD2 PHE A 9 -8.334 12.609 -2.093 1.00 0.00 C ATOM 34 CE1 PHE A 9 -5.989 11.210 -2.339 1.00 0.00 C ATOM 35 CE2 PHE A 9 -7.194 13.082 -1.490 1.00 0.00 C ATOM 36 CZ PHE A 9 -6.011 12.391 -1.625 1.00 0.00 C ATOM 0 H PHE A 9 -11.831 9.674 -4.238 1.00 0.00 H new ATOM 0 HA PHE A 9 -8.909 9.196 -4.201 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -9.758 11.570 -4.362 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -10.436 11.340 -2.762 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.114 9.801 -3.485 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -9.253 13.168 -2.001 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.065 10.659 -2.435 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -7.226 13.993 -0.912 1.00 0.00 H new ATOM 0 HZ PHE A 9 -5.106 12.771 -1.175 1.00 0.00 H new ATOM 46 N VAL A 10 -11.219 9.026 -1.779 1.00 0.00 N ATOM 47 CA VAL A 10 -11.683 8.295 -0.585 1.00 0.00 C ATOM 48 C VAL A 10 -12.059 6.803 -0.691 1.00 0.00 C ATOM 49 O VAL A 10 -12.495 6.187 0.266 1.00 0.00 O ATOM 50 CB VAL A 10 -12.609 9.144 0.250 1.00 0.00 C ATOM 51 CG1 VAL A 10 -11.714 10.303 0.697 1.00 0.00 C ATOM 52 CG2 VAL A 10 -13.766 9.707 -0.582 1.00 0.00 C ATOM 0 H VAL A 10 -11.826 9.812 -2.011 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.757 8.140 -0.031 1.00 0.00 H new ATOM 0 HB VAL A 10 -13.058 8.575 1.065 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -12.290 10.990 1.317 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -10.874 9.913 1.272 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -11.340 10.832 -0.179 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -14.411 10.313 0.055 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -13.368 10.324 -1.388 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -14.343 8.885 -1.006 1.00 0.00 H new ATOM 62 N GLY A 11 -11.784 6.239 -1.888 1.00 0.00 N ATOM 63 CA GLY A 11 -11.771 4.856 -2.351 1.00 0.00 C ATOM 64 C GLY A 11 -10.351 4.409 -2.690 1.00 0.00 C ATOM 65 O GLY A 11 -10.159 3.461 -3.449 1.00 0.00 O ATOM 0 H GLY A 11 -11.528 6.852 -2.662 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -12.187 4.206 -1.581 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -12.408 4.756 -3.230 1.00 0.00 H new ATOM 69 N LEU A 12 -9.337 5.110 -2.090 1.00 0.00 N ATOM 70 CA LEU A 12 -7.871 5.010 -2.046 1.00 0.00 C ATOM 71 C LEU A 12 -7.266 3.647 -1.814 1.00 0.00 C ATOM 72 O LEU A 12 -7.905 2.692 -1.369 1.00 0.00 O ATOM 73 CB LEU A 12 -7.339 5.899 -0.875 1.00 0.00 C ATOM 74 CG LEU A 12 -6.304 7.045 -1.080 1.00 0.00 C ATOM 75 CD1 LEU A 12 -5.822 7.404 -2.489 1.00 0.00 C ATOM 76 CD2 LEU A 12 -6.973 8.224 -0.348 1.00 0.00 C ATOM 0 H LEU A 12 -9.610 5.911 -1.520 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.576 5.317 -3.050 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -8.214 6.353 -0.409 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.905 5.218 -0.143 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.338 6.720 -0.694 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -5.106 8.224 -2.431 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -5.344 6.536 -2.942 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -6.673 7.708 -3.098 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.336 9.105 -0.419 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.939 8.436 -0.807 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.119 7.966 0.701 1.00 0.00 H new ATOM 88 N ARG A 13 -5.947 3.612 -2.083 1.00 0.00 N ATOM 89 CA ARG A 13 -5.071 2.455 -2.082 1.00 0.00 C ATOM 90 C ARG A 13 -4.138 2.728 -0.929 1.00 0.00 C ATOM 91 O ARG A 13 -3.442 3.734 -0.937 1.00 0.00 O ATOM 92 CB ARG A 13 -4.352 2.378 -3.462 1.00 0.00 C ATOM 93 CG ARG A 13 -5.326 2.164 -4.648 1.00 0.00 C ATOM 94 CD ARG A 13 -4.936 2.912 -5.938 1.00 0.00 C ATOM 95 NE ARG A 13 -6.043 2.796 -6.959 1.00 0.00 N ATOM 96 CZ ARG A 13 -6.268 1.706 -7.761 1.00 0.00 C ATOM 97 NH1 ARG A 13 -5.496 0.585 -7.684 1.00 0.00 N ATOM 98 NH2 ARG A 13 -7.295 1.746 -8.661 1.00 0.00 N ATOM 0 H ARG A 13 -5.440 4.464 -2.323 1.00 0.00 H new ATOM 0 HA ARG A 13 -5.565 1.492 -1.956 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.790 3.298 -3.623 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.629 1.562 -3.443 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -5.385 1.098 -4.865 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -6.323 2.483 -4.345 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.744 3.962 -5.715 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -4.012 2.498 -6.343 1.00 0.00 H new ATOM 0 HE ARG A 13 -6.673 3.591 -7.060 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -4.726 0.541 -7.016 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -5.688 -0.210 -8.294 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -7.881 2.578 -8.729 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -7.476 0.944 -9.265 1.00 0.00 H new ATOM 112 N VAL A 14 -4.144 1.927 0.162 1.00 0.00 N ATOM 113 CA VAL A 14 -3.408 2.256 1.385 1.00 0.00 C ATOM 114 C VAL A 14 -2.388 1.237 1.802 1.00 0.00 C ATOM 115 O VAL A 14 -2.357 0.094 1.365 1.00 0.00 O ATOM 116 CB VAL A 14 -4.231 2.876 2.541 1.00 0.00 C ATOM 117 CG1 VAL A 14 -5.067 3.996 1.935 1.00 0.00 C ATOM 118 CG2 VAL A 14 -5.134 2.097 3.493 1.00 0.00 C ATOM 0 H VAL A 14 -4.656 1.046 0.211 1.00 0.00 H new ATOM 0 HA VAL A 14 -2.808 3.108 1.064 1.00 0.00 H new ATOM 0 HB VAL A 14 -3.422 3.109 3.233 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -5.667 4.465 2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.408 4.740 1.487 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -5.725 3.585 1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -5.589 2.784 4.207 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -5.916 1.595 2.924 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.543 1.355 4.030 1.00 0.00 H new ATOM 128 N VAL A 15 -1.450 1.673 2.667 1.00 0.00 N ATOM 129 CA VAL A 15 -0.329 0.933 3.228 1.00 0.00 C ATOM 130 C VAL A 15 -0.550 0.855 4.693 1.00 0.00 C ATOM 131 O VAL A 15 -1.142 1.773 5.245 1.00 0.00 O ATOM 132 CB VAL A 15 1.010 1.552 2.907 1.00 0.00 C ATOM 133 CG1 VAL A 15 1.293 1.017 1.490 1.00 0.00 C ATOM 134 CG2 VAL A 15 0.952 3.089 3.053 1.00 0.00 C ATOM 0 H VAL A 15 -1.469 2.633 3.012 1.00 0.00 H new ATOM 0 HA VAL A 15 -0.292 -0.061 2.781 1.00 0.00 H new ATOM 0 HB VAL A 15 1.826 1.290 3.581 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.251 1.401 1.141 1.00 0.00 H new ATOM 0 HG12 VAL A 15 1.325 -0.072 1.512 1.00 0.00 H new ATOM 0 HG13 VAL A 15 0.503 1.343 0.813 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.928 3.514 2.817 1.00 0.00 H new ATOM 0 HG22 VAL A 15 0.206 3.492 2.368 1.00 0.00 H new ATOM 0 HG23 VAL A 15 0.682 3.347 4.077 1.00 0.00 H new ATOM 144 N ALA A 16 -0.120 -0.267 5.326 1.00 0.00 N ATOM 145 CA ALA A 16 -0.453 -0.578 6.698 1.00 0.00 C ATOM 146 C ALA A 16 0.761 -0.887 7.563 1.00 0.00 C ATOM 147 O ALA A 16 1.388 -1.935 7.519 1.00 0.00 O ATOM 148 CB ALA A 16 -1.482 -1.743 6.629 1.00 0.00 C ATOM 0 H ALA A 16 0.468 -0.970 4.878 1.00 0.00 H new ATOM 0 HA ALA A 16 -0.884 0.289 7.198 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -1.777 -2.028 7.639 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.361 -1.419 6.072 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -1.030 -2.599 6.128 1.00 0.00 H new ATOM 154 N LYS A 17 1.080 0.077 8.434 1.00 0.00 N ATOM 155 CA LYS A 17 2.173 0.102 9.369 1.00 0.00 C ATOM 156 C LYS A 17 1.607 0.656 10.677 1.00 0.00 C ATOM 157 O LYS A 17 1.282 1.830 10.693 1.00 0.00 O ATOM 158 CB LYS A 17 3.317 1.052 8.841 1.00 0.00 C ATOM 159 CG LYS A 17 3.059 1.951 7.596 1.00 0.00 C ATOM 160 CD LYS A 17 3.535 3.405 7.793 1.00 0.00 C ATOM 161 CE LYS A 17 5.035 3.626 7.595 1.00 0.00 C ATOM 162 NZ LYS A 17 5.421 5.022 7.907 1.00 0.00 N ATOM 0 H LYS A 17 0.520 0.928 8.495 1.00 0.00 H new ATOM 0 HA LYS A 17 2.598 -0.892 9.505 1.00 0.00 H new ATOM 0 HB2 LYS A 17 3.601 1.708 9.664 1.00 0.00 H new ATOM 0 HB3 LYS A 17 4.182 0.428 8.618 1.00 0.00 H new ATOM 0 HG2 LYS A 17 3.568 1.522 6.733 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.993 1.951 7.370 1.00 0.00 H new ATOM 0 HD2 LYS A 17 2.994 4.046 7.097 1.00 0.00 H new ATOM 0 HD3 LYS A 17 3.265 3.727 8.799 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.593 2.941 8.234 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.306 3.393 6.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 5.696 5.510 7.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.615 5.516 8.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 6.223 5.021 8.569 1.00 0.00 H new ATOM 176 N TRP A 18 1.462 -0.067 11.820 1.00 0.00 N ATOM 177 CA TRP A 18 0.936 0.554 13.062 1.00 0.00 C ATOM 178 C TRP A 18 1.999 1.264 13.924 1.00 0.00 C ATOM 179 O TRP A 18 1.744 2.236 14.630 1.00 0.00 O ATOM 180 CB TRP A 18 0.078 -0.434 13.889 1.00 0.00 C ATOM 181 CG TRP A 18 -1.266 -0.727 13.259 1.00 0.00 C ATOM 182 CD1 TRP A 18 -1.727 -1.764 12.494 1.00 0.00 C ATOM 183 CD2 TRP A 18 -2.391 0.099 13.560 1.00 0.00 C ATOM 184 NE1 TRP A 18 -3.094 -1.651 12.332 1.00 0.00 N ATOM 185 CE2 TRP A 18 -3.516 -0.533 13.029 1.00 0.00 C ATOM 186 CE3 TRP A 18 -2.473 1.268 14.264 1.00 0.00 C ATOM 187 CZ2 TRP A 18 -4.763 -0.031 13.249 1.00 0.00 C ATOM 188 CZ3 TRP A 18 -3.735 1.715 14.553 1.00 0.00 C ATOM 189 CH2 TRP A 18 -4.862 1.069 14.078 1.00 0.00 C ATOM 0 H TRP A 18 1.696 -1.056 11.906 1.00 0.00 H new ATOM 0 HA TRP A 18 0.280 1.353 12.717 1.00 0.00 H new ATOM 0 HB2 TRP A 18 0.627 -1.368 14.010 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -0.077 -0.023 14.887 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -1.115 -2.551 12.080 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.688 -2.281 11.793 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -1.592 1.809 14.575 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -5.637 -0.474 12.795 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -3.853 2.595 15.168 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -5.839 1.432 14.361 1.00 0.00 H new ATOM 200 N SER A 19 3.246 0.778 13.868 1.00 0.00 N ATOM 201 CA SER A 19 4.426 1.386 14.458 1.00 0.00 C ATOM 202 C SER A 19 5.360 1.399 13.279 1.00 0.00 C ATOM 203 O SER A 19 5.229 0.513 12.433 1.00 0.00 O ATOM 204 CB SER A 19 5.057 0.549 15.611 1.00 0.00 C ATOM 205 OG SER A 19 4.162 0.437 16.713 1.00 0.00 O ATOM 0 H SER A 19 3.460 -0.094 13.384 1.00 0.00 H new ATOM 0 HA SER A 19 4.208 2.351 14.916 1.00 0.00 H new ATOM 0 HB2 SER A 19 5.314 -0.445 15.245 1.00 0.00 H new ATOM 0 HB3 SER A 19 5.985 1.017 15.939 1.00 0.00 H new ATOM 0 HG SER A 19 4.581 -0.094 17.422 1.00 0.00 H new ATOM 211 N SER A 20 6.349 2.339 13.147 1.00 0.00 N ATOM 212 CA SER A 20 7.327 2.252 12.043 1.00 0.00 C ATOM 213 C SER A 20 8.321 1.101 12.308 1.00 0.00 C ATOM 214 O SER A 20 9.140 1.160 13.222 1.00 0.00 O ATOM 215 CB SER A 20 8.078 3.611 11.863 1.00 0.00 C ATOM 216 OG SER A 20 8.631 4.110 13.086 1.00 0.00 O ATOM 0 H SER A 20 6.478 3.134 13.773 1.00 0.00 H new ATOM 0 HA SER A 20 6.794 2.041 11.116 1.00 0.00 H new ATOM 0 HB2 SER A 20 8.878 3.484 11.134 1.00 0.00 H new ATOM 0 HB3 SER A 20 7.389 4.350 11.454 1.00 0.00 H new ATOM 0 HG SER A 20 9.019 3.369 13.596 1.00 0.00 H new ATOM 222 N ASN A 21 8.157 0.014 11.505 1.00 0.00 N ATOM 223 CA ASN A 21 8.722 -1.321 11.698 1.00 0.00 C ATOM 224 C ASN A 21 9.923 -1.670 10.850 1.00 0.00 C ATOM 225 O ASN A 21 10.735 -2.522 11.195 1.00 0.00 O ATOM 226 CB ASN A 21 7.576 -2.331 11.344 1.00 0.00 C ATOM 227 CG ASN A 21 7.401 -3.488 12.333 1.00 0.00 C ATOM 228 OD1 ASN A 21 6.349 -3.539 12.974 1.00 0.00 O ATOM 229 ND2 ASN A 21 8.398 -4.395 12.484 1.00 0.00 N ATOM 0 H ASN A 21 7.590 0.066 10.659 1.00 0.00 H new ATOM 0 HA ASN A 21 9.083 -1.363 12.726 1.00 0.00 H new ATOM 0 HB2 ASN A 21 6.636 -1.782 11.281 1.00 0.00 H new ATOM 0 HB3 ASN A 21 7.771 -2.745 10.355 1.00 0.00 H new ATOM 0 HD21 ASN A 21 8.295 -5.160 13.150 1.00 0.00 H new ATOM 0 HD22 ASN A 21 9.251 -4.312 11.931 1.00 0.00 H new ATOM 236 N GLY A 22 9.960 -1.042 9.667 1.00 0.00 N ATOM 237 CA GLY A 22 10.864 -1.250 8.559 1.00 0.00 C ATOM 238 C GLY A 22 10.198 -1.882 7.373 1.00 0.00 C ATOM 239 O GLY A 22 10.702 -1.689 6.282 1.00 0.00 O ATOM 0 H GLY A 22 9.286 -0.306 9.455 1.00 0.00 H new ATOM 0 HA2 GLY A 22 11.292 -0.293 8.262 1.00 0.00 H new ATOM 0 HA3 GLY A 22 11.690 -1.882 8.885 1.00 0.00 H new ATOM 243 N TYR A 23 9.024 -2.552 7.495 1.00 0.00 N ATOM 244 CA TYR A 23 8.120 -2.926 6.406 1.00 0.00 C ATOM 245 C TYR A 23 6.654 -2.693 6.707 1.00 0.00 C ATOM 246 O TYR A 23 6.233 -2.784 7.859 1.00 0.00 O ATOM 247 CB TYR A 23 8.427 -4.180 5.535 1.00 0.00 C ATOM 248 CG TYR A 23 9.421 -5.168 6.093 1.00 0.00 C ATOM 249 CD1 TYR A 23 9.233 -5.787 7.317 1.00 0.00 C ATOM 250 CD2 TYR A 23 10.503 -5.550 5.319 1.00 0.00 C ATOM 251 CE1 TYR A 23 10.111 -6.767 7.746 1.00 0.00 C ATOM 252 CE2 TYR A 23 11.362 -6.549 5.727 1.00 0.00 C ATOM 253 CZ TYR A 23 11.161 -7.164 6.942 1.00 0.00 C ATOM 254 OH TYR A 23 12.001 -8.224 7.350 1.00 0.00 O ATOM 0 H TYR A 23 8.676 -2.855 8.405 1.00 0.00 H new ATOM 0 HA TYR A 23 8.412 -2.172 5.675 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.490 -4.706 5.354 1.00 0.00 H new ATOM 0 HB3 TYR A 23 8.793 -3.840 4.566 1.00 0.00 H new ATOM 0 HD1 TYR A 23 8.397 -5.504 7.940 1.00 0.00 H new ATOM 0 HD2 TYR A 23 10.678 -5.055 4.375 1.00 0.00 H new ATOM 0 HE1 TYR A 23 9.974 -7.224 8.715 1.00 0.00 H new ATOM 0 HE2 TYR A 23 12.187 -6.847 5.097 1.00 0.00 H new ATOM 0 HH TYR A 23 11.660 -9.069 6.990 1.00 0.00 H new ATOM 264 N PHE A 24 5.835 -2.384 5.657 1.00 0.00 N ATOM 265 CA PHE A 24 4.400 -2.125 5.697 1.00 0.00 C ATOM 266 C PHE A 24 3.673 -3.164 4.863 1.00 0.00 C ATOM 267 O PHE A 24 4.158 -3.678 3.849 1.00 0.00 O ATOM 268 CB PHE A 24 3.886 -0.685 5.278 1.00 0.00 C ATOM 269 CG PHE A 24 4.933 0.402 5.118 1.00 0.00 C ATOM 270 CD1 PHE A 24 5.894 0.530 6.106 1.00 0.00 C ATOM 271 CD2 PHE A 24 4.922 1.354 4.086 1.00 0.00 C ATOM 272 CE1 PHE A 24 6.955 1.378 5.971 1.00 0.00 C ATOM 273 CE2 PHE A 24 5.928 2.287 4.026 1.00 0.00 C ATOM 274 CZ PHE A 24 6.971 2.259 4.922 1.00 0.00 C ATOM 0 H PHE A 24 6.204 -2.310 4.709 1.00 0.00 H new ATOM 0 HA PHE A 24 4.172 -2.183 6.761 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.348 -0.779 4.334 1.00 0.00 H new ATOM 0 HB3 PHE A 24 3.164 -0.353 6.024 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.802 -0.057 7.008 1.00 0.00 H new ATOM 0 HD2 PHE A 24 4.133 1.353 3.349 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.769 1.355 6.680 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.900 3.053 3.265 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.805 2.934 4.798 1.00 0.00 H new ATOM 284 N TYR A 25 2.425 -3.384 5.315 1.00 0.00 N ATOM 285 CA TYR A 25 1.308 -4.207 4.915 1.00 0.00 C ATOM 286 C TYR A 25 0.424 -3.351 4.020 1.00 0.00 C ATOM 287 O TYR A 25 0.817 -2.279 3.567 1.00 0.00 O ATOM 288 CB TYR A 25 0.599 -4.863 6.147 1.00 0.00 C ATOM 289 CG TYR A 25 1.671 -5.403 7.072 1.00 0.00 C ATOM 290 CD1 TYR A 25 2.623 -6.291 6.596 1.00 0.00 C ATOM 291 CD2 TYR A 25 1.833 -4.882 8.347 1.00 0.00 C ATOM 292 CE1 TYR A 25 3.773 -6.542 7.314 1.00 0.00 C ATOM 293 CE2 TYR A 25 2.971 -5.153 9.080 1.00 0.00 C ATOM 294 CZ TYR A 25 3.955 -5.946 8.542 1.00 0.00 C ATOM 295 OH TYR A 25 5.170 -6.097 9.228 1.00 0.00 O ATOM 0 H TYR A 25 2.143 -2.866 6.147 1.00 0.00 H new ATOM 0 HA TYR A 25 1.625 -5.075 4.336 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -0.018 -4.130 6.666 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -0.064 -5.665 5.823 1.00 0.00 H new ATOM 0 HD1 TYR A 25 2.462 -6.792 5.653 1.00 0.00 H new ATOM 0 HD2 TYR A 25 1.061 -4.258 8.771 1.00 0.00 H new ATOM 0 HE1 TYR A 25 4.528 -7.203 6.915 1.00 0.00 H new ATOM 0 HE2 TYR A 25 3.087 -4.743 10.072 1.00 0.00 H new ATOM 0 HH TYR A 25 5.129 -5.610 10.078 1.00 0.00 H new ATOM 305 N SER A 26 -0.749 -3.858 3.619 1.00 0.00 N ATOM 306 CA SER A 26 -1.625 -3.266 2.622 1.00 0.00 C ATOM 307 C SER A 26 -3.152 -3.196 3.003 1.00 0.00 C ATOM 308 O SER A 26 -3.711 -4.060 3.681 1.00 0.00 O ATOM 309 CB SER A 26 -1.269 -4.123 1.413 1.00 0.00 C ATOM 310 OG SER A 26 -1.243 -3.404 0.184 1.00 0.00 O ATOM 0 H SER A 26 -1.121 -4.727 4.001 1.00 0.00 H new ATOM 0 HA SER A 26 -1.472 -2.198 2.467 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.292 -4.578 1.577 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.990 -4.937 1.332 1.00 0.00 H new ATOM 0 HG SER A 26 -1.097 -4.028 -0.557 1.00 0.00 H new ATOM 316 N GLY A 27 -3.778 -2.028 2.670 1.00 0.00 N ATOM 317 CA GLY A 27 -5.044 -1.403 3.079 1.00 0.00 C ATOM 318 C GLY A 27 -5.839 -0.710 1.969 1.00 0.00 C ATOM 319 O GLY A 27 -5.331 -0.529 0.869 1.00 0.00 O ATOM 0 H GLY A 27 -3.315 -1.417 1.997 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.676 -2.169 3.528 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.830 -0.670 3.857 1.00 0.00 H new ATOM 323 N LYS A 28 -7.127 -0.306 2.195 1.00 0.00 N ATOM 324 CA LYS A 28 -7.880 0.588 1.278 1.00 0.00 C ATOM 325 C LYS A 28 -8.666 1.673 2.054 1.00 0.00 C ATOM 326 O LYS A 28 -9.180 1.351 3.117 1.00 0.00 O ATOM 327 CB LYS A 28 -8.823 -0.243 0.381 1.00 0.00 C ATOM 328 CG LYS A 28 -9.888 -1.071 1.119 1.00 0.00 C ATOM 329 CD LYS A 28 -10.654 -2.004 0.176 1.00 0.00 C ATOM 330 CE LYS A 28 -11.639 -2.907 0.928 1.00 0.00 C ATOM 331 NZ LYS A 28 -12.277 -3.884 0.017 1.00 0.00 N ATOM 0 H LYS A 28 -7.663 -0.593 3.014 1.00 0.00 H new ATOM 0 HA LYS A 28 -7.159 1.105 0.645 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -9.329 0.434 -0.308 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -8.218 -0.919 -0.223 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.409 -1.661 1.901 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -10.591 -0.399 1.612 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.197 -1.409 -0.558 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.945 -2.622 -0.375 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -11.115 -3.437 1.724 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.406 -2.295 1.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -12.938 -4.480 0.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -12.796 -3.377 -0.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.546 -4.482 -0.417 1.00 0.00 H new ATOM 345 N ILE A 29 -8.852 3.000 1.653 1.00 0.00 N ATOM 346 CA ILE A 29 -9.730 3.900 2.479 1.00 0.00 C ATOM 347 C ILE A 29 -11.211 3.880 2.098 1.00 0.00 C ATOM 348 O ILE A 29 -11.570 3.481 0.995 1.00 0.00 O ATOM 349 CB ILE A 29 -9.237 5.282 2.946 1.00 0.00 C ATOM 350 CG1 ILE A 29 -9.690 6.504 2.119 1.00 0.00 C ATOM 351 CG2 ILE A 29 -7.718 5.221 3.114 1.00 0.00 C ATOM 352 CD1 ILE A 29 -9.128 7.814 2.674 1.00 0.00 C ATOM 0 H ILE A 29 -8.435 3.429 0.827 1.00 0.00 H new ATOM 0 HA ILE A 29 -9.608 3.358 3.417 1.00 0.00 H new ATOM 0 HB ILE A 29 -9.732 5.472 3.898 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -9.368 6.381 1.085 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -10.779 6.552 2.110 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.349 6.192 3.445 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -7.464 4.464 3.856 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -7.257 4.963 2.161 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -9.473 8.647 2.061 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -9.471 7.952 3.699 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -8.039 7.778 2.658 1.00 0.00 H new ATOM 364 N THR A 30 -12.093 4.265 3.067 1.00 0.00 N ATOM 365 CA THR A 30 -13.553 4.390 2.922 1.00 0.00 C ATOM 366 C THR A 30 -13.992 5.855 2.994 1.00 0.00 C ATOM 367 O THR A 30 -14.866 6.288 2.240 1.00 0.00 O ATOM 368 CB THR A 30 -14.310 3.555 3.951 1.00 0.00 C ATOM 369 OG1 THR A 30 -13.832 2.222 3.885 1.00 0.00 O ATOM 370 CG2 THR A 30 -15.826 3.499 3.676 1.00 0.00 C ATOM 0 H THR A 30 -11.779 4.504 4.007 1.00 0.00 H new ATOM 0 HA THR A 30 -13.804 3.999 1.936 1.00 0.00 H new ATOM 0 HB THR A 30 -14.148 4.020 4.924 1.00 0.00 H new ATOM 0 HG1 THR A 30 -13.926 1.797 4.763 1.00 0.00 H new ATOM 0 HG21 THR A 30 -16.312 2.892 4.440 1.00 0.00 H new ATOM 0 HG22 THR A 30 -16.237 4.508 3.699 1.00 0.00 H new ATOM 0 HG23 THR A 30 -16.002 3.058 2.695 1.00 0.00 H new ATOM 378 N ARG A 31 -13.391 6.671 3.916 1.00 0.00 N ATOM 379 CA ARG A 31 -13.710 8.084 4.057 1.00 0.00 C ATOM 380 C ARG A 31 -12.449 8.749 4.582 1.00 0.00 C ATOM 381 O ARG A 31 -11.548 8.087 5.097 1.00 0.00 O ATOM 382 CB ARG A 31 -14.862 8.385 5.074 1.00 0.00 C ATOM 383 CG ARG A 31 -16.247 7.797 4.742 1.00 0.00 C ATOM 384 CD ARG A 31 -17.286 8.204 5.794 1.00 0.00 C ATOM 385 NE ARG A 31 -18.617 7.617 5.410 1.00 0.00 N ATOM 386 CZ ARG A 31 -19.772 7.875 6.100 1.00 0.00 C ATOM 387 NH1 ARG A 31 -19.763 8.683 7.199 1.00 0.00 N ATOM 388 NH2 ARG A 31 -20.945 7.318 5.679 1.00 0.00 N ATOM 0 H ARG A 31 -12.678 6.345 4.568 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.048 8.452 3.088 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.559 8.012 6.052 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -14.964 9.467 5.163 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.566 8.142 3.759 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -16.182 6.710 4.692 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -16.986 7.847 6.779 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.356 9.290 5.856 1.00 0.00 H new ATOM 0 HE ARG A 31 -18.661 6.999 4.600 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -18.889 9.103 7.516 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -20.630 8.867 7.704 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -20.957 6.715 4.856 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -21.810 7.505 6.187 1.00 0.00 H new ATOM 402 N ASP A 32 -12.374 10.103 4.539 1.00 0.00 N ATOM 403 CA ASP A 32 -11.304 10.893 5.160 1.00 0.00 C ATOM 404 C ASP A 32 -11.747 11.338 6.570 1.00 0.00 C ATOM 405 O ASP A 32 -12.869 11.812 6.741 1.00 0.00 O ATOM 406 CB ASP A 32 -10.975 12.134 4.266 1.00 0.00 C ATOM 407 CG ASP A 32 -9.744 12.931 4.731 1.00 0.00 C ATOM 408 OD1 ASP A 32 -8.630 12.346 4.741 1.00 0.00 O ATOM 409 OD2 ASP A 32 -9.910 14.129 5.083 1.00 0.00 O ATOM 0 H ASP A 32 -13.070 10.676 4.063 1.00 0.00 H new ATOM 0 HA ASP A 32 -10.403 10.286 5.251 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.812 11.798 3.242 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.840 12.797 4.250 1.00 0.00 H new ATOM 414 N VAL A 33 -10.874 11.208 7.610 1.00 0.00 N ATOM 415 CA VAL A 33 -11.144 11.681 8.973 1.00 0.00 C ATOM 416 C VAL A 33 -10.188 12.847 9.178 1.00 0.00 C ATOM 417 O VAL A 33 -8.993 12.700 9.007 1.00 0.00 O ATOM 418 CB VAL A 33 -11.124 10.642 10.146 1.00 0.00 C ATOM 419 CG1 VAL A 33 -12.595 10.252 10.414 1.00 0.00 C ATOM 420 CG2 VAL A 33 -10.258 9.366 9.949 1.00 0.00 C ATOM 0 H VAL A 33 -9.960 10.767 7.510 1.00 0.00 H new ATOM 0 HA VAL A 33 -12.196 11.960 9.031 1.00 0.00 H new ATOM 0 HB VAL A 33 -10.635 11.134 10.987 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -12.637 9.527 11.226 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -13.162 11.141 10.691 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -13.025 9.813 9.514 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -10.334 8.734 10.834 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -10.614 8.815 9.078 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -9.217 9.652 9.796 1.00 0.00 H new ATOM 430 N GLY A 34 -10.697 14.054 9.532 1.00 0.00 N ATOM 431 CA GLY A 34 -9.999 15.330 9.812 1.00 0.00 C ATOM 432 C GLY A 34 -8.761 15.768 9.023 1.00 0.00 C ATOM 433 O GLY A 34 -8.737 15.780 7.797 1.00 0.00 O ATOM 0 H GLY A 34 -11.705 14.167 9.638 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.738 16.123 9.703 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.710 15.306 10.863 1.00 0.00 H new ATOM 437 N ALA A 35 -7.697 16.173 9.759 1.00 0.00 N ATOM 438 CA ALA A 35 -6.364 16.503 9.271 1.00 0.00 C ATOM 439 C ALA A 35 -5.418 15.390 9.634 1.00 0.00 C ATOM 440 O ALA A 35 -5.223 15.064 10.803 1.00 0.00 O ATOM 441 CB ALA A 35 -5.868 17.851 9.840 1.00 0.00 C ATOM 0 H ALA A 35 -7.767 16.280 10.771 1.00 0.00 H new ATOM 0 HA ALA A 35 -6.404 16.610 8.187 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.871 18.064 9.454 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -6.551 18.646 9.540 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.832 17.795 10.928 1.00 0.00 H new ATOM 447 N GLY A 36 -4.811 14.772 8.599 1.00 0.00 N ATOM 448 CA GLY A 36 -3.833 13.717 8.710 1.00 0.00 C ATOM 449 C GLY A 36 -4.400 12.334 8.797 1.00 0.00 C ATOM 450 O GLY A 36 -3.662 11.387 8.558 1.00 0.00 O ATOM 0 H GLY A 36 -5.011 15.020 7.630 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -3.168 13.767 7.848 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.223 13.899 9.595 1.00 0.00 H new ATOM 454 N LYS A 37 -5.699 12.166 9.164 1.00 0.00 N ATOM 455 CA LYS A 37 -6.340 10.871 9.372 1.00 0.00 C ATOM 456 C LYS A 37 -7.143 10.354 8.185 1.00 0.00 C ATOM 457 O LYS A 37 -7.570 11.069 7.280 1.00 0.00 O ATOM 458 CB LYS A 37 -7.031 10.711 10.781 1.00 0.00 C ATOM 459 CG LYS A 37 -7.446 11.934 11.613 1.00 0.00 C ATOM 460 CD LYS A 37 -8.048 11.485 12.959 1.00 0.00 C ATOM 461 CE LYS A 37 -8.651 12.648 13.760 1.00 0.00 C ATOM 462 NZ LYS A 37 -9.851 13.202 13.089 1.00 0.00 N ATOM 0 H LYS A 37 -6.329 12.953 9.323 1.00 0.00 H new ATOM 0 HA LYS A 37 -5.510 10.166 9.417 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -7.929 10.112 10.628 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.356 10.120 11.400 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.581 12.573 11.789 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -8.174 12.528 11.061 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.820 10.738 12.775 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -7.273 11.003 13.555 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.917 12.304 14.759 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -7.905 13.433 13.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -9.741 14.230 12.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -9.961 12.760 12.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.693 13.006 13.667 1.00 0.00 H new ATOM 476 N TYR A 38 -7.375 9.011 8.186 1.00 0.00 N ATOM 477 CA TYR A 38 -8.148 8.261 7.200 1.00 0.00 C ATOM 478 C TYR A 38 -9.015 7.232 7.937 1.00 0.00 C ATOM 479 O TYR A 38 -8.612 6.730 8.991 1.00 0.00 O ATOM 480 CB TYR A 38 -7.240 7.568 6.150 1.00 0.00 C ATOM 481 CG TYR A 38 -6.311 8.588 5.535 1.00 0.00 C ATOM 482 CD1 TYR A 38 -6.797 9.537 4.651 1.00 0.00 C ATOM 483 CD2 TYR A 38 -4.996 8.693 5.961 1.00 0.00 C ATOM 484 CE1 TYR A 38 -6.000 10.584 4.237 1.00 0.00 C ATOM 485 CE2 TYR A 38 -4.156 9.672 5.453 1.00 0.00 C ATOM 486 CZ TYR A 38 -4.686 10.655 4.638 1.00 0.00 C ATOM 487 OH TYR A 38 -3.880 11.710 4.150 1.00 0.00 O ATOM 0 H TYR A 38 -7.001 8.408 8.919 1.00 0.00 H new ATOM 0 HA TYR A 38 -8.781 8.956 6.648 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -6.663 6.772 6.621 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -7.851 7.103 5.376 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -7.809 9.457 4.283 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.620 8.001 6.700 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -6.409 11.351 3.596 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -3.102 9.667 5.691 1.00 0.00 H new ATOM 0 HH TYR A 38 -4.439 12.496 3.978 1.00 0.00 H new ATOM 497 N LYS A 39 -10.248 6.934 7.398 1.00 0.00 N ATOM 498 CA LYS A 39 -11.283 6.004 7.879 1.00 0.00 C ATOM 499 C LYS A 39 -11.221 4.970 6.811 1.00 0.00 C ATOM 500 O LYS A 39 -11.519 5.157 5.623 1.00 0.00 O ATOM 501 CB LYS A 39 -12.665 6.704 7.970 1.00 0.00 C ATOM 502 CG LYS A 39 -13.913 5.815 7.848 1.00 0.00 C ATOM 503 CD LYS A 39 -14.065 4.725 8.915 1.00 0.00 C ATOM 504 CE LYS A 39 -15.200 3.771 8.534 1.00 0.00 C ATOM 505 NZ LYS A 39 -16.524 4.425 8.619 1.00 0.00 N ATOM 0 H LYS A 39 -10.549 7.392 6.538 1.00 0.00 H new ATOM 0 HA LYS A 39 -11.134 5.609 8.884 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.716 7.228 8.924 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -12.712 7.461 7.187 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -14.795 6.454 7.881 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -13.901 5.338 6.868 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -13.132 4.171 9.015 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -14.271 5.180 9.884 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -15.041 3.405 7.520 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -15.181 2.903 9.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -17.267 3.736 8.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -16.673 4.782 9.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -16.564 5.217 7.947 1.00 0.00 H new ATOM 519 N LEU A 40 -10.605 3.870 7.244 1.00 0.00 N ATOM 520 CA LEU A 40 -10.103 2.894 6.327 1.00 0.00 C ATOM 521 C LEU A 40 -10.379 1.482 6.659 1.00 0.00 C ATOM 522 O LEU A 40 -10.668 1.108 7.790 1.00 0.00 O ATOM 523 CB LEU A 40 -8.611 3.198 6.135 1.00 0.00 C ATOM 524 CG LEU A 40 -7.701 2.865 7.339 1.00 0.00 C ATOM 525 CD1 LEU A 40 -8.281 2.913 8.762 1.00 0.00 C ATOM 526 CD2 LEU A 40 -6.984 1.545 7.037 1.00 0.00 C ATOM 0 H LEU A 40 -10.450 3.649 8.228 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.652 2.990 5.390 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -8.254 2.642 5.268 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -8.501 4.257 5.902 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.016 3.710 7.408 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.504 2.652 9.481 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -8.647 3.918 8.972 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -9.104 2.203 8.844 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.333 1.285 7.872 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.721 0.755 6.892 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -6.387 1.654 6.132 1.00 0.00 H new ATOM 538 N LEU A 41 -10.280 0.591 5.671 1.00 0.00 N ATOM 539 CA LEU A 41 -10.455 -0.803 5.942 1.00 0.00 C ATOM 540 C LEU A 41 -9.304 -1.520 5.343 1.00 0.00 C ATOM 541 O LEU A 41 -8.832 -1.117 4.300 1.00 0.00 O ATOM 542 CB LEU A 41 -11.893 -0.986 5.444 1.00 0.00 C ATOM 543 CG LEU A 41 -12.623 -2.331 5.624 1.00 0.00 C ATOM 544 CD1 LEU A 41 -14.156 -2.178 5.650 1.00 0.00 C ATOM 545 CD2 LEU A 41 -12.336 -3.208 4.413 1.00 0.00 C ATOM 0 H LEU A 41 -10.082 0.822 4.697 1.00 0.00 H new ATOM 0 HA LEU A 41 -10.412 -1.211 6.952 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -12.501 -0.224 5.931 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -11.894 -0.761 4.378 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.272 -2.749 6.568 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -14.617 -3.157 5.779 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -14.443 -1.530 6.478 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -14.494 -1.739 4.711 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -12.847 -4.164 4.527 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -12.693 -2.711 3.511 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -11.262 -3.378 4.333 1.00 0.00 H new ATOM 557 N PHE A 42 -8.775 -2.643 5.897 1.00 0.00 N ATOM 558 CA PHE A 42 -7.724 -3.447 5.235 1.00 0.00 C ATOM 559 C PHE A 42 -8.416 -4.287 4.156 1.00 0.00 C ATOM 560 O PHE A 42 -9.519 -4.751 4.411 1.00 0.00 O ATOM 561 CB PHE A 42 -6.979 -4.443 6.192 1.00 0.00 C ATOM 562 CG PHE A 42 -5.951 -3.803 7.106 1.00 0.00 C ATOM 563 CD1 PHE A 42 -6.203 -2.668 7.865 1.00 0.00 C ATOM 564 CD2 PHE A 42 -4.711 -4.412 7.255 1.00 0.00 C ATOM 565 CE1 PHE A 42 -5.244 -2.142 8.707 1.00 0.00 C ATOM 566 CE2 PHE A 42 -3.764 -3.910 8.124 1.00 0.00 C ATOM 567 CZ PHE A 42 -4.023 -2.765 8.843 1.00 0.00 C ATOM 0 H PHE A 42 -9.064 -3.009 6.804 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.977 -2.752 4.851 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.719 -4.957 6.805 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.483 -5.203 5.587 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -7.168 -2.188 7.795 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -4.484 -5.297 6.679 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -5.452 -1.239 9.261 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -2.817 -4.417 8.240 1.00 0.00 H new ATOM 0 HZ PHE A 42 -3.275 -2.359 9.508 1.00 0.00 H new ATOM 577 N ASP A 43 -7.839 -4.527 2.941 1.00 0.00 N ATOM 578 CA ASP A 43 -8.462 -5.234 1.792 1.00 0.00 C ATOM 579 C ASP A 43 -9.133 -6.607 2.032 1.00 0.00 C ATOM 580 O ASP A 43 -9.962 -7.076 1.257 1.00 0.00 O ATOM 581 CB ASP A 43 -7.522 -5.266 0.543 1.00 0.00 C ATOM 582 CG ASP A 43 -6.260 -6.124 0.723 1.00 0.00 C ATOM 583 OD1 ASP A 43 -5.425 -5.796 1.607 1.00 0.00 O ATOM 584 OD2 ASP A 43 -6.117 -7.113 -0.046 1.00 0.00 O ATOM 0 H ASP A 43 -6.889 -4.219 2.733 1.00 0.00 H new ATOM 0 HA ASP A 43 -9.326 -4.597 1.601 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -8.085 -5.643 -0.311 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -7.222 -4.246 0.302 1.00 0.00 H new ATOM 589 N ASP A 44 -8.772 -7.220 3.182 1.00 0.00 N ATOM 590 CA ASP A 44 -9.246 -8.455 3.774 1.00 0.00 C ATOM 591 C ASP A 44 -10.340 -8.256 4.860 1.00 0.00 C ATOM 592 O ASP A 44 -10.945 -9.227 5.302 1.00 0.00 O ATOM 593 CB ASP A 44 -7.999 -9.287 4.214 1.00 0.00 C ATOM 594 CG ASP A 44 -7.126 -8.585 5.269 1.00 0.00 C ATOM 595 OD1 ASP A 44 -7.526 -8.565 6.463 1.00 0.00 O ATOM 596 OD2 ASP A 44 -6.044 -8.065 4.885 1.00 0.00 O ATOM 0 H ASP A 44 -8.057 -6.797 3.773 1.00 0.00 H new ATOM 0 HA ASP A 44 -9.793 -9.036 3.032 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -8.335 -10.245 4.612 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -7.389 -9.503 3.336 1.00 0.00 H new ATOM 601 N GLY A 45 -10.679 -6.990 5.268 1.00 0.00 N ATOM 602 CA GLY A 45 -11.876 -6.653 6.056 1.00 0.00 C ATOM 603 C GLY A 45 -11.735 -6.123 7.459 1.00 0.00 C ATOM 604 O GLY A 45 -12.735 -6.032 8.163 1.00 0.00 O ATOM 0 H GLY A 45 -10.108 -6.175 5.046 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -12.440 -5.914 5.487 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -12.491 -7.551 6.110 1.00 0.00 H new ATOM 608 N TYR A 46 -10.531 -5.723 7.933 1.00 0.00 N ATOM 609 CA TYR A 46 -10.333 -5.125 9.259 1.00 0.00 C ATOM 610 C TYR A 46 -10.413 -3.596 9.145 1.00 0.00 C ATOM 611 O TYR A 46 -9.480 -2.965 8.656 1.00 0.00 O ATOM 612 CB TYR A 46 -8.972 -5.594 9.895 1.00 0.00 C ATOM 613 CG TYR A 46 -8.674 -4.946 11.235 1.00 0.00 C ATOM 614 CD1 TYR A 46 -9.416 -5.257 12.361 1.00 0.00 C ATOM 615 CD2 TYR A 46 -7.760 -3.907 11.302 1.00 0.00 C ATOM 616 CE1 TYR A 46 -9.256 -4.535 13.530 1.00 0.00 C ATOM 617 CE2 TYR A 46 -7.621 -3.168 12.457 1.00 0.00 C ATOM 618 CZ TYR A 46 -8.363 -3.481 13.573 1.00 0.00 C ATOM 619 OH TYR A 46 -8.221 -2.692 14.731 1.00 0.00 O ATOM 0 H TYR A 46 -9.668 -5.810 7.396 1.00 0.00 H new ATOM 0 HA TYR A 46 -11.124 -5.464 9.928 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.993 -6.677 10.021 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.160 -5.369 9.203 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.126 -6.070 12.327 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -7.151 -3.674 10.441 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.828 -4.795 14.408 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -6.928 -2.341 12.486 1.00 0.00 H new ATOM 0 HH TYR A 46 -7.546 -1.999 14.574 1.00 0.00 H new ATOM 629 N GLU A 47 -11.510 -2.952 9.631 1.00 0.00 N ATOM 630 CA GLU A 47 -11.682 -1.494 9.611 1.00 0.00 C ATOM 631 C GLU A 47 -11.431 -0.801 10.918 1.00 0.00 C ATOM 632 O GLU A 47 -11.515 -1.377 12.003 1.00 0.00 O ATOM 633 CB GLU A 47 -12.994 -1.057 8.916 1.00 0.00 C ATOM 634 CG GLU A 47 -13.446 0.425 8.983 1.00 0.00 C ATOM 635 CD GLU A 47 -14.568 0.609 7.967 1.00 0.00 C ATOM 636 OE1 GLU A 47 -15.715 0.183 8.268 1.00 0.00 O ATOM 637 OE2 GLU A 47 -14.293 1.165 6.870 1.00 0.00 O ATOM 0 H GLU A 47 -12.299 -3.445 10.048 1.00 0.00 H new ATOM 0 HA GLU A 47 -10.868 -1.134 8.982 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -12.908 -1.323 7.863 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.800 -1.662 9.333 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -13.792 0.675 9.986 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -12.612 1.090 8.758 1.00 0.00 H new ATOM 644 N CYS A 48 -11.043 0.498 10.785 1.00 0.00 N ATOM 645 CA CYS A 48 -10.610 1.304 11.890 1.00 0.00 C ATOM 646 C CYS A 48 -10.635 2.722 11.382 1.00 0.00 C ATOM 647 O CYS A 48 -10.873 2.956 10.197 1.00 0.00 O ATOM 648 CB CYS A 48 -9.158 0.879 12.324 1.00 0.00 C ATOM 649 SG CYS A 48 -8.009 0.306 11.016 1.00 0.00 S ATOM 0 H CYS A 48 -11.033 0.989 9.891 1.00 0.00 H new ATOM 0 HA CYS A 48 -11.247 1.189 12.767 1.00 0.00 H new ATOM 0 HB2 CYS A 48 -8.696 1.729 12.827 1.00 0.00 H new ATOM 0 HB3 CYS A 48 -9.249 0.083 13.063 1.00 0.00 H new ATOM 0 HG CYS A 48 -7.671 -0.928 11.246 1.00 0.00 H new ATOM 655 N ASP A 49 -10.315 3.712 12.247 1.00 0.00 N ATOM 656 CA ASP A 49 -10.014 5.075 11.834 1.00 0.00 C ATOM 657 C ASP A 49 -8.661 5.265 12.479 1.00 0.00 C ATOM 658 O ASP A 49 -8.456 4.811 13.609 1.00 0.00 O ATOM 659 CB ASP A 49 -10.851 6.234 12.460 1.00 0.00 C ATOM 660 CG ASP A 49 -12.308 6.172 12.010 1.00 0.00 C ATOM 661 OD1 ASP A 49 -12.993 5.165 12.336 1.00 0.00 O ATOM 662 OD2 ASP A 49 -12.767 7.143 11.357 1.00 0.00 O ATOM 0 H ASP A 49 -10.262 3.572 13.256 1.00 0.00 H new ATOM 0 HA ASP A 49 -10.162 5.141 10.756 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -10.801 6.175 13.547 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -10.420 7.193 12.173 1.00 0.00 H new ATOM 667 N VAL A 50 -7.713 5.921 11.787 1.00 0.00 N ATOM 668 CA VAL A 50 -6.364 6.121 12.298 1.00 0.00 C ATOM 669 C VAL A 50 -5.786 7.413 11.821 1.00 0.00 C ATOM 670 O VAL A 50 -6.243 7.925 10.801 1.00 0.00 O ATOM 671 CB VAL A 50 -5.396 5.061 11.749 1.00 0.00 C ATOM 672 CG1 VAL A 50 -5.720 3.716 12.392 1.00 0.00 C ATOM 673 CG2 VAL A 50 -5.483 5.014 10.198 1.00 0.00 C ATOM 0 H VAL A 50 -7.869 6.322 10.862 1.00 0.00 H new ATOM 0 HA VAL A 50 -6.460 6.081 13.383 1.00 0.00 H new ATOM 0 HB VAL A 50 -4.366 5.316 12.000 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -5.039 2.956 12.009 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.607 3.793 13.473 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -6.746 3.436 12.153 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.794 4.260 9.818 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -6.500 4.760 9.898 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -5.217 5.989 9.789 1.00 0.00 H new ATOM 683 N LEU A 51 -4.675 7.906 12.461 1.00 0.00 N ATOM 684 CA LEU A 51 -3.868 9.033 11.994 1.00 0.00 C ATOM 685 C LEU A 51 -2.861 8.488 11.021 1.00 0.00 C ATOM 686 O LEU A 51 -2.381 7.368 11.159 1.00 0.00 O ATOM 687 CB LEU A 51 -3.250 9.796 13.193 1.00 0.00 C ATOM 688 CG LEU A 51 -2.925 11.303 13.027 1.00 0.00 C ATOM 689 CD1 LEU A 51 -1.832 11.666 12.005 1.00 0.00 C ATOM 690 CD2 LEU A 51 -4.187 12.124 12.747 1.00 0.00 C ATOM 0 H LEU A 51 -4.328 7.506 13.333 1.00 0.00 H new ATOM 0 HA LEU A 51 -4.470 9.779 11.475 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -3.933 9.696 14.036 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -2.327 9.287 13.469 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.501 11.565 13.996 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.699 12.748 11.983 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.894 11.191 12.292 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -2.128 11.317 11.016 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.920 13.175 12.637 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -4.655 11.770 11.828 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.885 12.012 13.576 1.00 0.00 H new ATOM 702 N GLY A 52 -2.774 9.195 9.869 1.00 0.00 N ATOM 703 CA GLY A 52 -2.616 8.599 8.554 1.00 0.00 C ATOM 704 C GLY A 52 -1.357 7.908 8.298 1.00 0.00 C ATOM 705 O GLY A 52 -1.376 6.813 7.777 1.00 0.00 O ATOM 0 H GLY A 52 -2.814 10.214 9.845 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -3.431 7.891 8.400 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -2.731 9.385 7.807 1.00 0.00 H new ATOM 709 N LYS A 53 -0.216 8.478 8.756 1.00 0.00 N ATOM 710 CA LYS A 53 1.183 8.079 8.575 1.00 0.00 C ATOM 711 C LYS A 53 1.591 6.666 9.089 1.00 0.00 C ATOM 712 O LYS A 53 2.764 6.384 9.310 1.00 0.00 O ATOM 713 CB LYS A 53 2.010 9.120 9.419 1.00 0.00 C ATOM 714 CG LYS A 53 1.543 9.465 10.878 1.00 0.00 C ATOM 715 CD LYS A 53 1.327 8.263 11.835 1.00 0.00 C ATOM 716 CE LYS A 53 1.308 8.486 13.355 1.00 0.00 C ATOM 717 NZ LYS A 53 0.347 9.528 13.764 1.00 0.00 N ATOM 0 H LYS A 53 -0.271 9.323 9.324 1.00 0.00 H new ATOM 0 HA LYS A 53 1.365 8.050 7.501 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.035 8.753 9.480 1.00 0.00 H new ATOM 0 HB3 LYS A 53 2.038 10.052 8.854 1.00 0.00 H new ATOM 0 HG2 LYS A 53 2.282 10.129 11.325 1.00 0.00 H new ATOM 0 HG3 LYS A 53 0.609 10.024 10.815 1.00 0.00 H new ATOM 0 HD2 LYS A 53 0.379 7.799 11.563 1.00 0.00 H new ATOM 0 HD3 LYS A 53 2.111 7.535 11.624 1.00 0.00 H new ATOM 0 HE2 LYS A 53 1.056 7.549 13.853 1.00 0.00 H new ATOM 0 HE3 LYS A 53 2.307 8.767 13.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 0.016 9.335 14.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 0.811 10.458 13.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -0.464 9.526 13.114 1.00 0.00 H new ATOM 731 N ASP A 54 0.562 5.820 9.298 1.00 0.00 N ATOM 732 CA ASP A 54 0.399 4.475 9.757 1.00 0.00 C ATOM 733 C ASP A 54 -0.419 3.806 8.668 1.00 0.00 C ATOM 734 O ASP A 54 0.115 3.107 7.819 1.00 0.00 O ATOM 735 CB ASP A 54 -0.385 4.383 11.108 1.00 0.00 C ATOM 736 CG ASP A 54 0.479 4.788 12.307 1.00 0.00 C ATOM 737 OD1 ASP A 54 1.730 4.845 12.172 1.00 0.00 O ATOM 738 OD2 ASP A 54 -0.117 5.024 13.392 1.00 0.00 O ATOM 0 H ASP A 54 -0.368 6.183 9.090 1.00 0.00 H new ATOM 0 HA ASP A 54 1.369 4.013 9.940 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -1.263 5.027 11.061 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.744 3.364 11.249 1.00 0.00 H new ATOM 743 N ILE A 55 -1.773 3.992 8.610 1.00 0.00 N ATOM 744 CA ILE A 55 -2.572 3.360 7.556 1.00 0.00 C ATOM 745 C ILE A 55 -3.122 4.480 6.649 1.00 0.00 C ATOM 746 O ILE A 55 -4.087 5.179 6.977 1.00 0.00 O ATOM 747 CB ILE A 55 -3.603 2.380 8.132 1.00 0.00 C ATOM 748 CG1 ILE A 55 -3.234 1.796 9.539 1.00 0.00 C ATOM 749 CG2 ILE A 55 -3.790 1.246 7.104 1.00 0.00 C ATOM 750 CD1 ILE A 55 -2.025 0.844 9.632 1.00 0.00 C ATOM 0 H ILE A 55 -2.305 4.561 9.268 1.00 0.00 H new ATOM 0 HA ILE A 55 -1.967 2.711 6.922 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.527 2.932 8.302 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -3.052 2.634 10.211 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -4.107 1.266 9.920 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -4.519 0.529 7.482 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.147 1.664 6.162 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -2.837 0.743 6.940 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -1.894 0.523 10.665 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -2.198 -0.027 9.000 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -1.127 1.362 9.296 1.00 0.00 H new ATOM 762 N LEU A 56 -2.409 4.676 5.494 1.00 0.00 N ATOM 763 CA LEU A 56 -2.505 5.868 4.624 1.00 0.00 C ATOM 764 C LEU A 56 -2.593 5.764 3.139 1.00 0.00 C ATOM 765 O LEU A 56 -2.059 4.819 2.565 1.00 0.00 O ATOM 766 CB LEU A 56 -1.326 6.792 4.966 1.00 0.00 C ATOM 767 CG LEU A 56 -0.422 7.529 3.963 1.00 0.00 C ATOM 768 CD1 LEU A 56 0.436 8.389 4.888 1.00 0.00 C ATOM 769 CD2 LEU A 56 0.433 6.647 3.019 1.00 0.00 C ATOM 0 H LEU A 56 -1.741 3.988 5.146 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.507 6.224 4.864 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.740 7.567 5.611 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.654 6.193 5.580 1.00 0.00 H new ATOM 0 HG LEU A 56 -1.016 8.077 3.231 1.00 0.00 H new ATOM 0 HD11 LEU A 56 1.136 8.976 4.294 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.205 9.060 5.460 1.00 0.00 H new ATOM 0 HD13 LEU A 56 0.990 7.746 5.572 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.025 7.285 2.362 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.099 6.019 3.611 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -0.222 6.016 2.418 1.00 0.00 H new ATOM 781 N LEU A 57 -3.143 6.830 2.470 1.00 0.00 N ATOM 782 CA LEU A 57 -3.265 7.132 1.050 1.00 0.00 C ATOM 783 C LEU A 57 -2.002 7.076 0.209 1.00 0.00 C ATOM 784 O LEU A 57 -1.075 7.873 0.219 1.00 0.00 O ATOM 785 CB LEU A 57 -3.965 8.506 0.881 1.00 0.00 C ATOM 786 CG LEU A 57 -3.467 9.801 1.576 1.00 0.00 C ATOM 787 CD1 LEU A 57 -2.024 10.247 1.353 1.00 0.00 C ATOM 788 CD2 LEU A 57 -4.350 10.971 1.105 1.00 0.00 C ATOM 0 H LEU A 57 -3.560 7.585 3.015 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.860 6.310 0.651 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -3.980 8.716 -0.189 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.000 8.366 1.193 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.527 9.545 2.634 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.838 11.167 1.907 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.345 9.469 1.702 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.858 10.424 0.290 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.017 11.893 1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.271 11.073 0.023 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -5.387 10.776 1.377 1.00 0.00 H new ATOM 800 N CYS A 58 -1.916 5.986 -0.519 1.00 0.00 N ATOM 801 CA CYS A 58 -0.855 5.574 -1.342 1.00 0.00 C ATOM 802 C CYS A 58 -1.413 5.321 -2.759 1.00 0.00 C ATOM 803 O CYS A 58 -2.605 5.351 -3.050 1.00 0.00 O ATOM 804 CB CYS A 58 -0.236 4.397 -0.523 1.00 0.00 C ATOM 805 SG CYS A 58 1.566 4.569 -0.286 1.00 0.00 S ATOM 0 H CYS A 58 -2.680 5.311 -0.534 1.00 0.00 H new ATOM 0 HA CYS A 58 -0.047 6.274 -1.558 1.00 0.00 H new ATOM 0 HB2 CYS A 58 -0.722 4.343 0.451 1.00 0.00 H new ATOM 0 HB3 CYS A 58 -0.442 3.457 -1.034 1.00 0.00 H new ATOM 0 HG CYS A 58 2.146 4.690 -1.443 1.00 0.00 H new ATOM 811 N ASP A 59 -0.487 5.024 -3.663 1.00 0.00 N ATOM 812 CA ASP A 59 -0.618 4.463 -5.023 1.00 0.00 C ATOM 813 C ASP A 59 -0.627 2.909 -4.968 1.00 0.00 C ATOM 814 O ASP A 59 -1.373 2.324 -5.752 1.00 0.00 O ATOM 815 CB ASP A 59 0.447 4.969 -6.080 1.00 0.00 C ATOM 816 CG ASP A 59 -0.235 5.772 -7.197 1.00 0.00 C ATOM 817 OD1 ASP A 59 -1.179 5.234 -7.834 1.00 0.00 O ATOM 818 OD2 ASP A 59 0.179 6.941 -7.419 1.00 0.00 O ATOM 0 H ASP A 59 0.496 5.187 -3.443 1.00 0.00 H new ATOM 0 HA ASP A 59 -1.573 4.842 -5.388 1.00 0.00 H new ATOM 0 HB2 ASP A 59 1.193 5.589 -5.583 1.00 0.00 H new ATOM 0 HB3 ASP A 59 0.975 4.117 -6.508 1.00 0.00 H new ATOM 823 N PRO A 60 0.150 2.150 -4.117 1.00 0.00 N ATOM 824 CA PRO A 60 1.113 2.584 -3.119 1.00 0.00 C ATOM 825 C PRO A 60 2.307 3.292 -3.666 1.00 0.00 C ATOM 826 O PRO A 60 2.403 4.488 -3.424 1.00 0.00 O ATOM 827 CB PRO A 60 1.410 1.373 -2.190 1.00 0.00 C ATOM 828 CG PRO A 60 0.413 0.293 -2.607 1.00 0.00 C ATOM 829 CD PRO A 60 -0.025 0.709 -4.011 1.00 0.00 C ATOM 0 HA PRO A 60 0.678 3.381 -2.516 1.00 0.00 H new ATOM 0 HB2 PRO A 60 2.437 1.028 -2.309 1.00 0.00 H new ATOM 0 HB3 PRO A 60 1.284 1.641 -1.141 1.00 0.00 H new ATOM 0 HG2 PRO A 60 0.874 -0.695 -2.610 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -0.434 0.247 -1.923 1.00 0.00 H new ATOM 0 HD2 PRO A 60 0.570 0.194 -4.766 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -1.066 0.436 -4.184 1.00 0.00 H new ATOM 837 N ILE A 61 3.235 2.578 -4.301 1.00 0.00 N ATOM 838 CA ILE A 61 4.561 3.071 -4.555 1.00 0.00 C ATOM 839 C ILE A 61 4.783 3.483 -6.011 1.00 0.00 C ATOM 840 O ILE A 61 4.014 3.055 -6.875 1.00 0.00 O ATOM 841 CB ILE A 61 5.432 1.979 -3.954 1.00 0.00 C ATOM 842 CG1 ILE A 61 5.171 2.004 -2.434 1.00 0.00 C ATOM 843 CG2 ILE A 61 6.957 2.136 -4.067 1.00 0.00 C ATOM 844 CD1 ILE A 61 5.937 3.060 -1.636 1.00 0.00 C ATOM 0 H ILE A 61 3.073 1.634 -4.651 1.00 0.00 H new ATOM 0 HA ILE A 61 4.808 4.028 -4.096 1.00 0.00 H new ATOM 0 HB ILE A 61 5.163 1.080 -4.509 1.00 0.00 H new ATOM 0 HG12 ILE A 61 4.104 2.159 -2.272 1.00 0.00 H new ATOM 0 HG13 ILE A 61 5.416 1.023 -2.028 1.00 0.00 H new ATOM 0 HG21 ILE A 61 7.446 1.284 -3.595 1.00 0.00 H new ATOM 0 HG22 ILE A 61 7.241 2.181 -5.118 1.00 0.00 H new ATOM 0 HG23 ILE A 61 7.266 3.054 -3.568 1.00 0.00 H new ATOM 0 HD11 ILE A 61 5.673 2.982 -0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 61 7.009 2.899 -1.755 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.676 4.053 -2.002 1.00 0.00 H new ATOM 856 N PRO A 62 5.800 4.337 -6.325 1.00 0.00 N ATOM 857 CA PRO A 62 6.067 5.006 -7.593 1.00 0.00 C ATOM 858 C PRO A 62 6.133 4.078 -8.816 1.00 0.00 C ATOM 859 O PRO A 62 7.078 3.336 -8.999 1.00 0.00 O ATOM 860 CB PRO A 62 7.492 5.559 -7.236 1.00 0.00 C ATOM 861 CG PRO A 62 7.471 5.971 -5.768 1.00 0.00 C ATOM 862 CD PRO A 62 6.273 5.226 -5.273 1.00 0.00 C ATOM 0 HA PRO A 62 5.298 5.717 -7.894 1.00 0.00 H new ATOM 0 HB2 PRO A 62 8.253 4.798 -7.409 1.00 0.00 H new ATOM 0 HB3 PRO A 62 7.742 6.410 -7.869 1.00 0.00 H new ATOM 0 HG2 PRO A 62 8.382 5.679 -5.246 1.00 0.00 H new ATOM 0 HG3 PRO A 62 7.365 7.049 -5.645 1.00 0.00 H new ATOM 0 HD2 PRO A 62 6.528 4.653 -4.382 1.00 0.00 H new ATOM 0 HD3 PRO A 62 5.486 5.925 -4.988 1.00 0.00 H new ATOM 870 N LEU A 63 5.110 4.076 -9.690 1.00 0.00 N ATOM 871 CA LEU A 63 4.755 3.176 -10.788 1.00 0.00 C ATOM 872 C LEU A 63 5.688 2.481 -11.781 1.00 0.00 C ATOM 873 O LEU A 63 5.218 1.920 -12.758 1.00 0.00 O ATOM 874 CB LEU A 63 3.533 3.840 -11.466 1.00 0.00 C ATOM 875 CG LEU A 63 2.237 3.511 -10.702 1.00 0.00 C ATOM 876 CD1 LEU A 63 1.337 4.734 -10.464 1.00 0.00 C ATOM 877 CD2 LEU A 63 1.538 2.388 -11.476 1.00 0.00 C ATOM 0 H LEU A 63 4.415 4.820 -9.625 1.00 0.00 H new ATOM 0 HA LEU A 63 4.655 2.234 -10.249 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.674 4.920 -11.503 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.451 3.494 -12.496 1.00 0.00 H new ATOM 0 HG LEU A 63 2.476 3.181 -9.691 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.443 4.428 -9.921 1.00 0.00 H new ATOM 0 HD12 LEU A 63 1.880 5.477 -9.880 1.00 0.00 H new ATOM 0 HD13 LEU A 63 1.049 5.166 -11.422 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.611 2.120 -10.970 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.315 2.728 -12.487 1.00 0.00 H new ATOM 0 HD23 LEU A 63 2.191 1.517 -11.522 1.00 0.00 H new ATOM 889 N ASP A 64 7.006 2.448 -11.542 1.00 0.00 N ATOM 890 CA ASP A 64 7.991 1.644 -12.275 1.00 0.00 C ATOM 891 C ASP A 64 9.199 1.514 -11.367 1.00 0.00 C ATOM 892 O ASP A 64 10.346 1.726 -11.748 1.00 0.00 O ATOM 893 CB ASP A 64 8.233 2.306 -13.637 1.00 0.00 C ATOM 894 CG ASP A 64 9.119 1.515 -14.603 1.00 0.00 C ATOM 895 OD1 ASP A 64 8.792 0.330 -14.877 1.00 0.00 O ATOM 896 OD2 ASP A 64 10.135 2.090 -15.077 1.00 0.00 O ATOM 0 H ASP A 64 7.432 3.005 -10.801 1.00 0.00 H new ATOM 0 HA ASP A 64 7.670 0.630 -12.513 1.00 0.00 H new ATOM 0 HB2 ASP A 64 7.269 2.479 -14.114 1.00 0.00 H new ATOM 0 HB3 ASP A 64 8.687 3.283 -13.472 1.00 0.00 H new ATOM 901 N THR A 65 8.898 1.312 -10.064 1.00 0.00 N ATOM 902 CA THR A 65 9.810 1.335 -8.956 1.00 0.00 C ATOM 903 C THR A 65 9.863 0.054 -8.285 1.00 0.00 C ATOM 904 O THR A 65 8.918 -0.701 -8.215 1.00 0.00 O ATOM 905 CB THR A 65 9.540 2.475 -7.980 1.00 0.00 C ATOM 906 OG1 THR A 65 9.578 3.661 -8.749 1.00 0.00 O ATOM 907 CG2 THR A 65 10.545 2.753 -6.854 1.00 0.00 C ATOM 0 H THR A 65 7.942 1.118 -9.766 1.00 0.00 H new ATOM 0 HA THR A 65 10.796 1.530 -9.378 1.00 0.00 H new ATOM 0 HB THR A 65 8.611 2.180 -7.493 1.00 0.00 H new ATOM 0 HG1 THR A 65 8.713 3.792 -9.191 1.00 0.00 H new ATOM 0 HG21 THR A 65 10.197 3.595 -6.256 1.00 0.00 H new ATOM 0 HG22 THR A 65 10.635 1.871 -6.221 1.00 0.00 H new ATOM 0 HG23 THR A 65 11.518 2.991 -7.285 1.00 0.00 H new ATOM 915 N GLU A 66 10.966 -0.102 -7.593 1.00 0.00 N ATOM 916 CA GLU A 66 11.354 -1.090 -6.617 1.00 0.00 C ATOM 917 C GLU A 66 10.414 -1.033 -5.405 1.00 0.00 C ATOM 918 O GLU A 66 10.214 -0.002 -4.760 1.00 0.00 O ATOM 919 CB GLU A 66 12.838 -0.936 -6.201 1.00 0.00 C ATOM 920 CG GLU A 66 13.397 -2.143 -5.420 1.00 0.00 C ATOM 921 CD GLU A 66 14.856 -1.888 -5.049 1.00 0.00 C ATOM 922 OE1 GLU A 66 15.693 -1.761 -5.984 1.00 0.00 O ATOM 923 OE2 GLU A 66 15.154 -1.819 -3.827 1.00 0.00 O ATOM 0 H GLU A 66 11.726 0.566 -7.725 1.00 0.00 H new ATOM 0 HA GLU A 66 11.262 -2.075 -7.074 1.00 0.00 H new ATOM 0 HB2 GLU A 66 13.442 -0.783 -7.096 1.00 0.00 H new ATOM 0 HB3 GLU A 66 12.942 -0.040 -5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 66 12.807 -2.310 -4.519 1.00 0.00 H new ATOM 0 HG3 GLU A 66 13.318 -3.047 -6.024 1.00 0.00 H new ATOM 930 N VAL A 67 9.795 -2.197 -5.206 1.00 0.00 N ATOM 931 CA VAL A 67 8.781 -2.645 -4.260 1.00 0.00 C ATOM 932 C VAL A 67 8.908 -4.122 -4.201 1.00 0.00 C ATOM 933 O VAL A 67 9.764 -4.758 -4.801 1.00 0.00 O ATOM 934 CB VAL A 67 7.303 -2.244 -4.320 1.00 0.00 C ATOM 935 CG1 VAL A 67 6.926 -1.551 -3.000 1.00 0.00 C ATOM 936 CG2 VAL A 67 7.002 -1.358 -5.531 1.00 0.00 C ATOM 0 H VAL A 67 10.042 -2.977 -5.815 1.00 0.00 H new ATOM 0 HA VAL A 67 9.031 -2.062 -3.374 1.00 0.00 H new ATOM 0 HB VAL A 67 6.694 -3.139 -4.444 1.00 0.00 H new ATOM 0 HG11 VAL A 67 5.876 -1.260 -3.029 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.090 -2.237 -2.169 1.00 0.00 H new ATOM 0 HG13 VAL A 67 7.545 -0.664 -2.865 1.00 0.00 H new ATOM 0 HG21 VAL A 67 5.944 -1.096 -5.536 1.00 0.00 H new ATOM 0 HG22 VAL A 67 7.600 -0.449 -5.474 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.247 -1.897 -6.446 1.00 0.00 H new ATOM 946 N THR A 68 8.128 -4.713 -3.294 1.00 0.00 N ATOM 947 CA THR A 68 8.267 -6.101 -2.974 1.00 0.00 C ATOM 948 C THR A 68 6.954 -6.829 -2.917 1.00 0.00 C ATOM 949 O THR A 68 5.864 -6.285 -2.762 1.00 0.00 O ATOM 950 CB THR A 68 9.168 -6.170 -1.736 1.00 0.00 C ATOM 951 OG1 THR A 68 9.367 -7.459 -1.175 1.00 0.00 O ATOM 952 CG2 THR A 68 8.572 -5.260 -0.656 1.00 0.00 C ATOM 0 H THR A 68 7.394 -4.232 -2.775 1.00 0.00 H new ATOM 0 HA THR A 68 8.757 -6.664 -3.769 1.00 0.00 H new ATOM 0 HB THR A 68 10.153 -5.853 -2.080 1.00 0.00 H new ATOM 0 HG1 THR A 68 9.469 -8.117 -1.894 1.00 0.00 H new ATOM 0 HG21 THR A 68 9.199 -5.294 0.235 1.00 0.00 H new ATOM 0 HG22 THR A 68 8.526 -4.236 -1.028 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.567 -5.601 -0.406 1.00 0.00 H new ATOM 960 N ALA A 69 7.113 -8.149 -3.089 1.00 0.00 N ATOM 961 CA ALA A 69 6.109 -9.165 -3.132 1.00 0.00 C ATOM 962 C ALA A 69 6.045 -9.882 -1.798 1.00 0.00 C ATOM 963 O ALA A 69 7.074 -10.201 -1.207 1.00 0.00 O ATOM 964 CB ALA A 69 6.587 -10.111 -4.239 1.00 0.00 C ATOM 0 H ALA A 69 8.045 -8.546 -3.211 1.00 0.00 H new ATOM 0 HA ALA A 69 5.110 -8.775 -3.325 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.877 -10.931 -4.349 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.658 -9.564 -5.179 1.00 0.00 H new ATOM 0 HB3 ALA A 69 7.566 -10.512 -3.977 1.00 0.00 H new ATOM 970 N LEU A 70 4.826 -10.170 -1.291 1.00 0.00 N ATOM 971 CA LEU A 70 4.637 -10.870 -0.025 1.00 0.00 C ATOM 972 C LEU A 70 4.649 -12.384 -0.194 1.00 0.00 C ATOM 973 O LEU A 70 3.809 -13.001 -0.850 1.00 0.00 O ATOM 974 CB LEU A 70 3.339 -10.451 0.685 1.00 0.00 C ATOM 975 CG LEU A 70 3.190 -10.691 2.223 1.00 0.00 C ATOM 976 CD1 LEU A 70 3.239 -12.134 2.732 1.00 0.00 C ATOM 977 CD2 LEU A 70 4.186 -9.890 3.065 1.00 0.00 C ATOM 0 H LEU A 70 3.954 -9.919 -1.756 1.00 0.00 H new ATOM 0 HA LEU A 70 5.485 -10.580 0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 70 3.198 -9.385 0.506 1.00 0.00 H new ATOM 0 HB3 LEU A 70 2.516 -10.969 0.193 1.00 0.00 H new ATOM 0 HG LEU A 70 2.166 -10.341 2.356 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.122 -12.142 3.816 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.432 -12.708 2.276 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.197 -12.581 2.467 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.025 -10.105 4.121 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.203 -10.169 2.789 1.00 0.00 H new ATOM 0 HD23 LEU A 70 4.040 -8.825 2.886 1.00 0.00 H new ATOM 989 N SER A 71 5.661 -12.952 0.464 1.00 0.00 N ATOM 990 CA SER A 71 5.999 -14.320 0.756 1.00 0.00 C ATOM 991 C SER A 71 6.477 -14.209 2.189 1.00 0.00 C ATOM 992 O SER A 71 6.693 -13.102 2.667 1.00 0.00 O ATOM 993 CB SER A 71 7.034 -14.950 -0.205 1.00 0.00 C ATOM 994 OG SER A 71 6.386 -15.310 -1.421 1.00 0.00 O ATOM 0 H SER A 71 6.373 -12.342 0.865 1.00 0.00 H new ATOM 0 HA SER A 71 5.164 -15.007 0.620 1.00 0.00 H new ATOM 0 HB2 SER A 71 7.840 -14.244 -0.404 1.00 0.00 H new ATOM 0 HB3 SER A 71 7.486 -15.829 0.254 1.00 0.00 H new ATOM 0 HG SER A 71 7.039 -15.708 -2.034 1.00 0.00 H new ATOM 1000 N GLU A 72 6.647 -15.329 2.908 1.00 0.00 N ATOM 1001 CA GLU A 72 7.200 -15.520 4.256 1.00 0.00 C ATOM 1002 C GLU A 72 8.442 -14.712 4.745 1.00 0.00 C ATOM 1003 O GLU A 72 9.185 -14.103 3.981 1.00 0.00 O ATOM 1004 CB GLU A 72 7.607 -17.014 4.385 1.00 0.00 C ATOM 1005 CG GLU A 72 7.446 -17.864 3.109 1.00 0.00 C ATOM 1006 CD GLU A 72 6.005 -18.290 2.833 1.00 0.00 C ATOM 1007 OE1 GLU A 72 5.388 -18.912 3.738 1.00 0.00 O ATOM 1008 OE2 GLU A 72 5.506 -18.008 1.711 1.00 0.00 O ATOM 0 H GLU A 72 6.367 -16.226 2.511 1.00 0.00 H new ATOM 0 HA GLU A 72 6.387 -15.146 4.878 1.00 0.00 H new ATOM 0 HB2 GLU A 72 8.649 -17.061 4.702 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.012 -17.466 5.178 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.818 -17.297 2.256 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.069 -18.754 3.195 1.00 0.00 H new ATOM 1015 N ASP A 73 8.718 -14.801 6.072 1.00 0.00 N ATOM 1016 CA ASP A 73 9.749 -14.106 6.864 1.00 0.00 C ATOM 1017 C ASP A 73 11.204 -14.051 6.383 1.00 0.00 C ATOM 1018 O ASP A 73 11.840 -13.003 6.409 1.00 0.00 O ATOM 1019 CB ASP A 73 9.675 -14.570 8.354 1.00 0.00 C ATOM 1020 CG ASP A 73 10.240 -13.546 9.352 1.00 0.00 C ATOM 1021 OD1 ASP A 73 9.714 -12.401 9.386 1.00 0.00 O ATOM 1022 OD2 ASP A 73 11.201 -13.900 10.085 1.00 0.00 O ATOM 0 H ASP A 73 8.168 -15.423 6.665 1.00 0.00 H new ATOM 0 HA ASP A 73 9.462 -13.065 6.718 1.00 0.00 H new ATOM 0 HB2 ASP A 73 8.636 -14.777 8.609 1.00 0.00 H new ATOM 0 HB3 ASP A 73 10.222 -15.507 8.461 1.00 0.00 H new ATOM 1027 N GLU A 74 11.759 -15.192 5.940 1.00 0.00 N ATOM 1028 CA GLU A 74 13.111 -15.344 5.417 1.00 0.00 C ATOM 1029 C GLU A 74 13.079 -15.612 3.910 1.00 0.00 C ATOM 1030 O GLU A 74 14.062 -16.009 3.294 1.00 0.00 O ATOM 1031 CB GLU A 74 13.773 -16.500 6.227 1.00 0.00 C ATOM 1032 CG GLU A 74 15.252 -16.798 5.923 1.00 0.00 C ATOM 1033 CD GLU A 74 15.808 -17.771 6.962 1.00 0.00 C ATOM 1034 OE1 GLU A 74 15.311 -18.927 7.016 1.00 0.00 O ATOM 1035 OE2 GLU A 74 16.735 -17.369 7.715 1.00 0.00 O ATOM 0 H GLU A 74 11.244 -16.072 5.941 1.00 0.00 H new ATOM 0 HA GLU A 74 13.698 -14.433 5.536 1.00 0.00 H new ATOM 0 HB2 GLU A 74 13.684 -16.266 7.288 1.00 0.00 H new ATOM 0 HB3 GLU A 74 13.199 -17.410 6.052 1.00 0.00 H new ATOM 0 HG2 GLU A 74 15.349 -17.224 4.924 1.00 0.00 H new ATOM 0 HG3 GLU A 74 15.828 -15.873 5.933 1.00 0.00 H new ATOM 1042 N TYR A 75 11.885 -15.471 3.281 1.00 0.00 N ATOM 1043 CA TYR A 75 11.633 -15.911 1.916 1.00 0.00 C ATOM 1044 C TYR A 75 11.197 -14.778 1.003 1.00 0.00 C ATOM 1045 O TYR A 75 11.558 -14.774 -0.174 1.00 0.00 O ATOM 1046 CB TYR A 75 10.582 -17.032 1.958 1.00 0.00 C ATOM 1047 CG TYR A 75 11.086 -18.279 2.648 1.00 0.00 C ATOM 1048 CD1 TYR A 75 11.069 -18.421 4.033 1.00 0.00 C ATOM 1049 CD2 TYR A 75 11.545 -19.332 1.880 1.00 0.00 C ATOM 1050 CE1 TYR A 75 11.508 -19.597 4.619 1.00 0.00 C ATOM 1051 CE2 TYR A 75 11.978 -20.506 2.465 1.00 0.00 C ATOM 1052 CZ TYR A 75 11.958 -20.640 3.836 1.00 0.00 C ATOM 1053 OH TYR A 75 12.393 -21.842 4.436 1.00 0.00 O ATOM 0 H TYR A 75 11.073 -15.043 3.725 1.00 0.00 H new ATOM 0 HA TYR A 75 12.565 -16.284 1.491 1.00 0.00 H new ATOM 0 HB2 TYR A 75 9.692 -16.671 2.474 1.00 0.00 H new ATOM 0 HB3 TYR A 75 10.282 -17.281 0.940 1.00 0.00 H new ATOM 0 HD1 TYR A 75 10.712 -17.612 4.653 1.00 0.00 H new ATOM 0 HD2 TYR A 75 11.566 -19.236 0.805 1.00 0.00 H new ATOM 0 HE1 TYR A 75 11.498 -19.698 5.694 1.00 0.00 H new ATOM 0 HE2 TYR A 75 12.332 -21.319 1.848 1.00 0.00 H new ATOM 0 HH TYR A 75 12.676 -22.471 3.740 1.00 0.00 H new ATOM 1063 N PHE A 76 10.446 -13.755 1.518 1.00 0.00 N ATOM 1064 CA PHE A 76 10.074 -12.537 0.713 1.00 0.00 C ATOM 1065 C PHE A 76 11.210 -11.731 0.014 1.00 0.00 C ATOM 1066 O PHE A 76 12.328 -11.577 0.508 1.00 0.00 O ATOM 1067 CB PHE A 76 9.167 -11.472 1.438 1.00 0.00 C ATOM 1068 CG PHE A 76 9.475 -11.109 2.883 1.00 0.00 C ATOM 1069 CD1 PHE A 76 10.744 -11.031 3.438 1.00 0.00 C ATOM 1070 CD2 PHE A 76 8.404 -10.769 3.691 1.00 0.00 C ATOM 1071 CE1 PHE A 76 10.919 -10.638 4.754 1.00 0.00 C ATOM 1072 CE2 PHE A 76 8.565 -10.412 5.010 1.00 0.00 C ATOM 1073 CZ PHE A 76 9.832 -10.338 5.552 1.00 0.00 C ATOM 0 H PHE A 76 10.089 -13.745 2.473 1.00 0.00 H new ATOM 0 HA PHE A 76 9.514 -13.076 -0.051 1.00 0.00 H new ATOM 0 HB2 PHE A 76 9.204 -10.554 0.852 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.139 -11.833 1.400 1.00 0.00 H new ATOM 0 HD1 PHE A 76 11.606 -11.280 2.836 1.00 0.00 H new ATOM 0 HD2 PHE A 76 7.409 -10.784 3.272 1.00 0.00 H new ATOM 0 HE1 PHE A 76 11.917 -10.565 5.161 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.702 -10.190 5.620 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.971 -10.050 6.584 1.00 0.00 H new ATOM 1083 N SER A 77 10.896 -11.265 -1.228 1.00 0.00 N ATOM 1084 CA SER A 77 11.882 -10.668 -2.143 1.00 0.00 C ATOM 1085 C SER A 77 11.299 -9.485 -2.890 1.00 0.00 C ATOM 1086 O SER A 77 10.081 -9.294 -2.938 1.00 0.00 O ATOM 1087 CB SER A 77 12.547 -11.726 -3.097 1.00 0.00 C ATOM 1088 OG SER A 77 13.569 -11.200 -3.962 1.00 0.00 O ATOM 0 H SER A 77 9.951 -11.298 -1.612 1.00 0.00 H new ATOM 0 HA SER A 77 12.696 -10.284 -1.527 1.00 0.00 H new ATOM 0 HB2 SER A 77 12.979 -12.521 -2.490 1.00 0.00 H new ATOM 0 HB3 SER A 77 11.769 -12.180 -3.711 1.00 0.00 H new ATOM 0 HG SER A 77 13.930 -11.922 -4.518 1.00 0.00 H new ATOM 1094 N ALA A 78 12.180 -8.618 -3.466 1.00 0.00 N ATOM 1095 CA ALA A 78 11.803 -7.432 -4.235 1.00 0.00 C ATOM 1096 C ALA A 78 11.637 -7.637 -5.749 1.00 0.00 C ATOM 1097 O ALA A 78 12.123 -8.597 -6.346 1.00 0.00 O ATOM 1098 CB ALA A 78 12.664 -6.185 -3.912 1.00 0.00 C ATOM 0 H ALA A 78 13.190 -8.742 -3.397 1.00 0.00 H new ATOM 0 HA ALA A 78 10.793 -7.233 -3.876 1.00 0.00 H new ATOM 0 HB1 ALA A 78 12.328 -5.344 -4.519 1.00 0.00 H new ATOM 0 HB2 ALA A 78 12.560 -5.935 -2.856 1.00 0.00 H new ATOM 0 HB3 ALA A 78 13.710 -6.398 -4.134 1.00 0.00 H new ATOM 1104 N GLY A 79 10.865 -6.694 -6.341 1.00 0.00 N ATOM 1105 CA GLY A 79 10.388 -6.582 -7.704 1.00 0.00 C ATOM 1106 C GLY A 79 9.998 -5.162 -7.957 1.00 0.00 C ATOM 1107 O GLY A 79 10.397 -4.213 -7.288 1.00 0.00 O ATOM 0 H GLY A 79 10.531 -5.905 -5.788 1.00 0.00 H new ATOM 0 HA2 GLY A 79 11.165 -6.891 -8.403 1.00 0.00 H new ATOM 0 HA3 GLY A 79 9.535 -7.242 -7.862 1.00 0.00 H new ATOM 1111 N VAL A 80 9.257 -4.951 -9.041 1.00 0.00 N ATOM 1112 CA VAL A 80 8.833 -3.649 -9.478 1.00 0.00 C ATOM 1113 C VAL A 80 7.340 -3.528 -9.468 1.00 0.00 C ATOM 1114 O VAL A 80 6.626 -4.470 -9.763 1.00 0.00 O ATOM 1115 CB VAL A 80 9.460 -3.487 -10.859 1.00 0.00 C ATOM 1116 CG1 VAL A 80 8.812 -2.450 -11.800 1.00 0.00 C ATOM 1117 CG2 VAL A 80 10.887 -3.036 -10.559 1.00 0.00 C ATOM 0 H VAL A 80 8.934 -5.706 -9.646 1.00 0.00 H new ATOM 0 HA VAL A 80 9.157 -2.847 -8.815 1.00 0.00 H new ATOM 0 HB VAL A 80 9.346 -4.428 -11.397 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.350 -2.432 -12.748 1.00 0.00 H new ATOM 0 HG12 VAL A 80 7.772 -2.721 -11.979 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.856 -1.463 -11.339 1.00 0.00 H new ATOM 0 HG21 VAL A 80 11.427 -2.890 -11.495 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.863 -2.098 -10.004 1.00 0.00 H new ATOM 0 HG23 VAL A 80 11.392 -3.797 -9.964 1.00 0.00 H new ATOM 1127 N VAL A 81 6.822 -2.312 -9.179 1.00 0.00 N ATOM 1128 CA VAL A 81 5.441 -1.901 -9.369 1.00 0.00 C ATOM 1129 C VAL A 81 5.434 -1.319 -10.768 1.00 0.00 C ATOM 1130 O VAL A 81 6.351 -0.543 -11.061 1.00 0.00 O ATOM 1131 CB VAL A 81 5.020 -0.818 -8.349 1.00 0.00 C ATOM 1132 CG1 VAL A 81 5.841 0.485 -8.407 1.00 0.00 C ATOM 1133 CG2 VAL A 81 3.590 -0.297 -8.485 1.00 0.00 C ATOM 0 H VAL A 81 7.397 -1.565 -8.789 1.00 0.00 H new ATOM 0 HA VAL A 81 4.746 -2.729 -9.232 1.00 0.00 H new ATOM 0 HB VAL A 81 5.173 -1.385 -7.431 1.00 0.00 H new ATOM 0 HG11 VAL A 81 5.471 1.182 -7.655 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.890 0.263 -8.211 1.00 0.00 H new ATOM 0 HG13 VAL A 81 5.743 0.933 -9.396 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.403 0.457 -7.720 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.456 0.146 -9.472 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.889 -1.122 -8.360 1.00 0.00 H new ATOM 1143 N LYS A 82 4.455 -1.724 -11.623 1.00 0.00 N ATOM 1144 CA LYS A 82 4.344 -1.259 -13.002 1.00 0.00 C ATOM 1145 C LYS A 82 3.028 -0.554 -13.251 1.00 0.00 C ATOM 1146 O LYS A 82 2.953 0.477 -13.911 1.00 0.00 O ATOM 1147 CB LYS A 82 4.347 -2.452 -14.011 1.00 0.00 C ATOM 1148 CG LYS A 82 5.659 -3.246 -14.114 1.00 0.00 C ATOM 1149 CD LYS A 82 6.804 -2.457 -14.780 1.00 0.00 C ATOM 1150 CE LYS A 82 6.620 -2.165 -16.277 1.00 0.00 C ATOM 1151 NZ LYS A 82 6.511 -3.416 -17.060 1.00 0.00 N ATOM 0 H LYS A 82 3.725 -2.386 -11.357 1.00 0.00 H new ATOM 0 HA LYS A 82 5.196 -0.595 -13.147 1.00 0.00 H new ATOM 0 HB2 LYS A 82 3.550 -3.141 -13.731 1.00 0.00 H new ATOM 0 HB3 LYS A 82 4.101 -2.066 -15.000 1.00 0.00 H new ATOM 0 HG2 LYS A 82 5.971 -3.549 -13.114 1.00 0.00 H new ATOM 0 HG3 LYS A 82 5.479 -4.159 -14.682 1.00 0.00 H new ATOM 0 HD2 LYS A 82 6.923 -1.510 -14.254 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.731 -3.014 -14.647 1.00 0.00 H new ATOM 0 HE2 LYS A 82 5.724 -1.562 -16.425 1.00 0.00 H new ATOM 0 HE3 LYS A 82 7.463 -1.578 -16.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 6.524 -3.192 -18.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 7.312 -4.039 -16.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 5.620 -3.897 -16.823 1.00 0.00 H new ATOM 1165 N GLY A 83 1.915 -1.167 -12.797 1.00 0.00 N ATOM 1166 CA GLY A 83 0.580 -0.698 -13.149 1.00 0.00 C ATOM 1167 C GLY A 83 -0.437 -1.391 -12.300 1.00 0.00 C ATOM 1168 O GLY A 83 -0.261 -2.554 -11.915 1.00 0.00 O ATOM 0 H GLY A 83 1.926 -1.985 -12.188 1.00 0.00 H new ATOM 0 HA2 GLY A 83 0.513 0.381 -13.006 1.00 0.00 H new ATOM 0 HA3 GLY A 83 0.382 -0.893 -14.203 1.00 0.00 H new ATOM 1172 N HIS A 84 -1.550 -0.689 -11.975 1.00 0.00 N ATOM 1173 CA HIS A 84 -2.594 -1.211 -11.109 1.00 0.00 C ATOM 1174 C HIS A 84 -4.020 -0.888 -11.490 1.00 0.00 C ATOM 1175 O HIS A 84 -4.332 0.142 -12.094 1.00 0.00 O ATOM 1176 CB HIS A 84 -2.321 -0.894 -9.614 1.00 0.00 C ATOM 1177 CG HIS A 84 -1.387 0.257 -9.313 1.00 0.00 C ATOM 1178 ND1 HIS A 84 -1.725 1.576 -9.078 1.00 0.00 N ATOM 1179 CD2 HIS A 84 -0.063 0.168 -9.024 1.00 0.00 C ATOM 1180 CE1 HIS A 84 -0.597 2.202 -8.650 1.00 0.00 C ATOM 1181 NE2 HIS A 84 0.423 1.379 -8.575 1.00 0.00 N ATOM 0 H HIS A 84 -1.734 0.255 -12.315 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.525 -2.287 -11.268 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -3.277 -0.689 -9.132 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -1.914 -1.791 -9.147 1.00 0.00 H new ATOM 0 HD2 HIS A 84 0.529 -0.729 -9.131 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -0.546 3.252 -8.401 1.00 0.00 H new ATOM 0 HE2 HIS A 84 1.368 1.589 -8.255 1.00 0.00 H new ATOM 1189 N ARG A 85 -4.923 -1.847 -11.115 1.00 0.00 N ATOM 1190 CA ARG A 85 -6.333 -1.791 -11.433 1.00 0.00 C ATOM 1191 C ARG A 85 -7.116 -2.029 -10.179 1.00 0.00 C ATOM 1192 O ARG A 85 -6.638 -2.674 -9.242 1.00 0.00 O ATOM 1193 CB ARG A 85 -6.729 -2.948 -12.428 1.00 0.00 C ATOM 1194 CG ARG A 85 -7.298 -4.255 -11.790 1.00 0.00 C ATOM 1195 CD ARG A 85 -7.695 -5.366 -12.763 1.00 0.00 C ATOM 1196 NE ARG A 85 -6.507 -5.877 -13.529 1.00 0.00 N ATOM 1197 CZ ARG A 85 -6.648 -6.651 -14.652 1.00 0.00 C ATOM 1198 NH1 ARG A 85 -7.887 -6.977 -15.125 1.00 0.00 N ATOM 1199 NH2 ARG A 85 -5.543 -7.119 -15.300 1.00 0.00 N ATOM 0 H ARG A 85 -4.661 -2.675 -10.580 1.00 0.00 H new ATOM 0 HA ARG A 85 -6.543 -0.818 -11.878 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -7.471 -2.559 -13.125 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -5.848 -3.210 -13.013 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -6.552 -4.653 -11.102 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -8.173 -3.993 -11.195 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -8.155 -6.187 -12.212 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -8.445 -4.990 -13.460 1.00 0.00 H new ATOM 0 HE ARG A 85 -5.569 -5.641 -13.204 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -8.721 -6.644 -14.642 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -7.978 -7.554 -15.962 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -4.612 -6.893 -14.949 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -5.647 -7.695 -16.135 1.00 0.00 H new ATOM 1213 N LYS A 86 -8.407 -1.653 -10.198 1.00 0.00 N ATOM 1214 CA LYS A 86 -9.361 -2.208 -9.275 1.00 0.00 C ATOM 1215 C LYS A 86 -10.613 -2.478 -10.082 1.00 0.00 C ATOM 1216 O LYS A 86 -11.010 -1.676 -10.929 1.00 0.00 O ATOM 1217 CB LYS A 86 -9.491 -1.259 -8.082 1.00 0.00 C ATOM 1218 CG LYS A 86 -10.727 -1.388 -7.179 1.00 0.00 C ATOM 1219 CD LYS A 86 -10.624 -0.455 -5.959 1.00 0.00 C ATOM 1220 CE LYS A 86 -11.699 -0.713 -4.893 1.00 0.00 C ATOM 1221 NZ LYS A 86 -13.060 -0.481 -5.430 1.00 0.00 N ATOM 0 H LYS A 86 -8.794 -0.968 -10.847 1.00 0.00 H new ATOM 0 HA LYS A 86 -9.075 -3.157 -8.822 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -8.608 -1.388 -7.457 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -9.464 -0.239 -8.465 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -11.624 -1.148 -7.749 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -10.830 -2.420 -6.843 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.640 -0.572 -5.506 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -10.699 0.579 -6.296 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -11.618 -1.739 -4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -11.528 -0.061 -4.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -13.763 -0.664 -4.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -13.143 0.505 -5.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -13.231 -1.121 -6.232 1.00 0.00 H new ATOM 1235 N GLU A 87 -11.276 -3.625 -9.810 1.00 0.00 N ATOM 1236 CA GLU A 87 -12.538 -4.064 -10.384 1.00 0.00 C ATOM 1237 C GLU A 87 -13.537 -4.133 -9.226 1.00 0.00 C ATOM 1238 O GLU A 87 -13.123 -4.213 -8.068 1.00 0.00 O ATOM 1239 CB GLU A 87 -12.355 -5.462 -11.032 1.00 0.00 C ATOM 1240 CG GLU A 87 -13.469 -5.894 -12.002 1.00 0.00 C ATOM 1241 CD GLU A 87 -13.135 -7.274 -12.570 1.00 0.00 C ATOM 1242 OE1 GLU A 87 -12.090 -7.393 -13.264 1.00 0.00 O ATOM 1243 OE2 GLU A 87 -13.919 -8.227 -12.315 1.00 0.00 O ATOM 0 H GLU A 87 -10.909 -4.301 -9.140 1.00 0.00 H new ATOM 0 HA GLU A 87 -12.890 -3.383 -11.159 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -11.406 -5.473 -11.568 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -12.281 -6.205 -10.237 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -14.428 -5.923 -11.484 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -13.565 -5.169 -12.810 1.00 0.00 H new ATOM 1250 N SER A 88 -14.878 -4.138 -9.480 1.00 0.00 N ATOM 1251 CA SER A 88 -15.973 -4.248 -8.492 1.00 0.00 C ATOM 1252 C SER A 88 -16.019 -5.569 -7.683 1.00 0.00 C ATOM 1253 O SER A 88 -16.969 -6.343 -7.781 1.00 0.00 O ATOM 1254 CB SER A 88 -17.355 -4.011 -9.195 1.00 0.00 C ATOM 1255 OG SER A 88 -18.470 -3.951 -8.297 1.00 0.00 O ATOM 0 H SER A 88 -15.234 -4.061 -10.433 1.00 0.00 H new ATOM 0 HA SER A 88 -15.762 -3.472 -7.756 1.00 0.00 H new ATOM 0 HB2 SER A 88 -17.307 -3.080 -9.760 1.00 0.00 H new ATOM 0 HB3 SER A 88 -17.526 -4.812 -9.915 1.00 0.00 H new ATOM 0 HG SER A 88 -18.549 -4.801 -7.816 1.00 0.00 H new ATOM 1261 N GLY A 89 -14.977 -5.808 -6.850 1.00 0.00 N ATOM 1262 CA GLY A 89 -14.769 -6.967 -5.995 1.00 0.00 C ATOM 1263 C GLY A 89 -13.549 -7.768 -6.375 1.00 0.00 C ATOM 1264 O GLY A 89 -13.400 -8.895 -5.921 1.00 0.00 O ATOM 0 H GLY A 89 -14.213 -5.138 -6.763 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -14.672 -6.636 -4.961 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -15.648 -7.610 -6.043 1.00 0.00 H new ATOM 1268 N GLU A 90 -12.628 -7.228 -7.229 1.00 0.00 N ATOM 1269 CA GLU A 90 -11.400 -7.881 -7.621 1.00 0.00 C ATOM 1270 C GLU A 90 -10.337 -6.788 -7.658 1.00 0.00 C ATOM 1271 O GLU A 90 -10.609 -5.645 -8.016 1.00 0.00 O ATOM 1272 CB GLU A 90 -11.599 -8.687 -8.924 1.00 0.00 C ATOM 1273 CG GLU A 90 -10.318 -9.385 -9.367 1.00 0.00 C ATOM 1274 CD GLU A 90 -10.620 -10.406 -10.460 1.00 0.00 C ATOM 1275 OE1 GLU A 90 -11.208 -10.008 -11.502 1.00 0.00 O ATOM 1276 OE2 GLU A 90 -10.265 -11.600 -10.269 1.00 0.00 O ATOM 0 H GLU A 90 -12.747 -6.309 -7.656 1.00 0.00 H new ATOM 0 HA GLU A 90 -11.068 -8.644 -6.917 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.383 -9.429 -8.775 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -11.939 -8.019 -9.715 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -9.604 -8.649 -9.735 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -9.853 -9.881 -8.515 1.00 0.00 H new ATOM 1283 N LEU A 91 -9.083 -7.082 -7.248 1.00 0.00 N ATOM 1284 CA LEU A 91 -8.035 -6.094 -7.095 1.00 0.00 C ATOM 1285 C LEU A 91 -6.797 -6.627 -7.734 1.00 0.00 C ATOM 1286 O LEU A 91 -6.439 -7.764 -7.426 1.00 0.00 O ATOM 1287 CB LEU A 91 -7.743 -5.910 -5.575 1.00 0.00 C ATOM 1288 CG LEU A 91 -7.487 -4.456 -5.137 1.00 0.00 C ATOM 1289 CD1 LEU A 91 -6.300 -3.780 -5.844 1.00 0.00 C ATOM 1290 CD2 LEU A 91 -8.760 -3.622 -5.302 1.00 0.00 C ATOM 0 H LEU A 91 -8.784 -8.029 -7.016 1.00 0.00 H new ATOM 0 HA LEU A 91 -8.336 -5.149 -7.547 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -8.587 -6.302 -5.007 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.874 -6.512 -5.311 1.00 0.00 H new ATOM 0 HG LEU A 91 -7.208 -4.506 -4.085 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -6.191 -2.760 -5.477 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -5.387 -4.339 -5.638 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -6.479 -3.761 -6.919 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -8.566 -2.596 -4.989 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.067 -3.630 -6.348 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -9.554 -4.045 -4.687 1.00 0.00 H new ATOM 1302 N TYR A 92 -6.059 -5.865 -8.595 1.00 0.00 N ATOM 1303 CA TYR A 92 -4.782 -6.448 -8.997 1.00 0.00 C ATOM 1304 C TYR A 92 -3.713 -5.395 -9.163 1.00 0.00 C ATOM 1305 O TYR A 92 -3.935 -4.354 -9.777 1.00 0.00 O ATOM 1306 CB TYR A 92 -4.704 -7.260 -10.362 1.00 0.00 C ATOM 1307 CG TYR A 92 -5.742 -8.195 -10.947 1.00 0.00 C ATOM 1308 CD1 TYR A 92 -7.118 -8.095 -10.869 1.00 0.00 C ATOM 1309 CD2 TYR A 92 -5.244 -9.017 -11.944 1.00 0.00 C ATOM 1310 CE1 TYR A 92 -7.923 -8.794 -11.751 1.00 0.00 C ATOM 1311 CE2 TYR A 92 -6.032 -9.730 -12.812 1.00 0.00 C ATOM 1312 CZ TYR A 92 -7.401 -9.641 -12.700 1.00 0.00 C ATOM 1313 OH TYR A 92 -8.271 -10.301 -13.592 1.00 0.00 O ATOM 0 H TYR A 92 -6.302 -4.951 -8.978 1.00 0.00 H new ATOM 0 HA TYR A 92 -4.642 -7.146 -8.172 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -4.532 -6.508 -11.132 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -3.794 -7.855 -10.288 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -7.568 -7.467 -10.114 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -4.172 -9.102 -12.044 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -8.994 -8.670 -11.692 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -5.584 -10.352 -13.573 1.00 0.00 H new ATOM 0 HH TYR A 92 -7.749 -10.863 -14.202 1.00 0.00 H new ATOM 1323 N TYR A 93 -2.494 -5.712 -8.684 1.00 0.00 N ATOM 1324 CA TYR A 93 -1.270 -4.968 -8.862 1.00 0.00 C ATOM 1325 C TYR A 93 -0.396 -5.873 -9.719 1.00 0.00 C ATOM 1326 O TYR A 93 -0.158 -7.030 -9.362 1.00 0.00 O ATOM 1327 CB TYR A 93 -0.563 -4.617 -7.507 1.00 0.00 C ATOM 1328 CG TYR A 93 -1.101 -3.333 -6.945 1.00 0.00 C ATOM 1329 CD1 TYR A 93 -2.470 -3.224 -6.717 1.00 0.00 C ATOM 1330 CD2 TYR A 93 -0.285 -2.213 -6.735 1.00 0.00 C ATOM 1331 CE1 TYR A 93 -3.049 -2.034 -6.364 1.00 0.00 C ATOM 1332 CE2 TYR A 93 -0.912 -1.010 -6.487 1.00 0.00 C ATOM 1333 CZ TYR A 93 -2.267 -0.922 -6.286 1.00 0.00 C ATOM 1334 OH TYR A 93 -2.894 0.306 -6.076 1.00 0.00 O ATOM 0 H TYR A 93 -2.348 -6.554 -8.128 1.00 0.00 H new ATOM 0 HA TYR A 93 -1.463 -4.001 -9.325 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -0.715 -5.425 -6.792 1.00 0.00 H new ATOM 0 HB3 TYR A 93 0.512 -4.529 -7.664 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -3.092 -4.101 -6.821 1.00 0.00 H new ATOM 0 HD2 TYR A 93 0.792 -2.289 -6.766 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -4.106 -1.979 -6.151 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -0.318 -0.109 -6.450 1.00 0.00 H new ATOM 0 HH TYR A 93 -2.299 1.030 -6.362 1.00 0.00 H new ATOM 1344 N SER A 94 0.104 -5.348 -10.879 1.00 0.00 N ATOM 1345 CA SER A 94 1.025 -6.018 -11.790 1.00 0.00 C ATOM 1346 C SER A 94 2.447 -5.737 -11.322 1.00 0.00 C ATOM 1347 O SER A 94 3.007 -4.647 -11.503 1.00 0.00 O ATOM 1348 CB SER A 94 0.794 -5.701 -13.296 1.00 0.00 C ATOM 1349 OG SER A 94 0.894 -4.317 -13.651 1.00 0.00 O ATOM 0 H SER A 94 -0.146 -4.412 -11.197 1.00 0.00 H new ATOM 0 HA SER A 94 0.831 -7.090 -11.745 1.00 0.00 H new ATOM 0 HB2 SER A 94 1.519 -6.264 -13.884 1.00 0.00 H new ATOM 0 HB3 SER A 94 -0.195 -6.061 -13.579 1.00 0.00 H new ATOM 0 HG SER A 94 0.331 -3.784 -13.051 1.00 0.00 H new ATOM 1355 N ILE A 95 2.984 -6.746 -10.593 1.00 0.00 N ATOM 1356 CA ILE A 95 4.256 -6.707 -9.883 1.00 0.00 C ATOM 1357 C ILE A 95 5.260 -7.437 -10.727 1.00 0.00 C ATOM 1358 O ILE A 95 5.110 -8.624 -11.015 1.00 0.00 O ATOM 1359 CB ILE A 95 4.134 -7.256 -8.459 1.00 0.00 C ATOM 1360 CG1 ILE A 95 3.041 -6.472 -7.688 1.00 0.00 C ATOM 1361 CG2 ILE A 95 5.482 -7.185 -7.700 1.00 0.00 C ATOM 1362 CD1 ILE A 95 3.159 -4.942 -7.762 1.00 0.00 C ATOM 0 H ILE A 95 2.509 -7.643 -10.489 1.00 0.00 H new ATOM 0 HA ILE A 95 4.591 -5.679 -9.742 1.00 0.00 H new ATOM 0 HB ILE A 95 3.851 -8.307 -8.525 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.065 -6.764 -8.076 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.071 -6.773 -6.641 1.00 0.00 H new ATOM 0 HG21 ILE A 95 5.354 -7.584 -6.694 1.00 0.00 H new ATOM 0 HG22 ILE A 95 6.230 -7.773 -8.231 1.00 0.00 H new ATOM 0 HG23 ILE A 95 5.812 -6.148 -7.640 1.00 0.00 H new ATOM 0 HD11 ILE A 95 2.349 -4.487 -7.192 1.00 0.00 H new ATOM 0 HD12 ILE A 95 4.117 -4.630 -7.345 1.00 0.00 H new ATOM 0 HD13 ILE A 95 3.095 -4.622 -8.802 1.00 0.00 H new ATOM 1374 N GLU A 96 6.327 -6.730 -11.184 1.00 0.00 N ATOM 1375 CA GLU A 96 7.333 -7.282 -12.098 1.00 0.00 C ATOM 1376 C GLU A 96 8.412 -7.971 -11.301 1.00 0.00 C ATOM 1377 O GLU A 96 9.155 -7.382 -10.522 1.00 0.00 O ATOM 1378 CB GLU A 96 7.806 -6.276 -13.170 1.00 0.00 C ATOM 1379 CG GLU A 96 8.775 -6.855 -14.219 1.00 0.00 C ATOM 1380 CD GLU A 96 9.128 -5.772 -15.236 1.00 0.00 C ATOM 1381 OE1 GLU A 96 9.760 -4.760 -14.827 1.00 0.00 O ATOM 1382 OE2 GLU A 96 8.776 -5.940 -16.433 1.00 0.00 O ATOM 0 H GLU A 96 6.504 -5.760 -10.922 1.00 0.00 H new ATOM 0 HA GLU A 96 6.878 -8.055 -12.717 1.00 0.00 H new ATOM 0 HB2 GLU A 96 6.932 -5.878 -13.685 1.00 0.00 H new ATOM 0 HB3 GLU A 96 8.292 -5.437 -12.671 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.679 -7.221 -13.732 1.00 0.00 H new ATOM 0 HG3 GLU A 96 8.317 -7.707 -14.722 1.00 0.00 H new ATOM 1389 N LYS A 97 8.349 -9.313 -11.394 1.00 0.00 N ATOM 1390 CA LYS A 97 8.974 -10.192 -10.434 1.00 0.00 C ATOM 1391 C LYS A 97 9.528 -11.432 -11.092 1.00 0.00 C ATOM 1392 O LYS A 97 8.854 -12.080 -11.895 1.00 0.00 O ATOM 1393 CB LYS A 97 7.777 -10.655 -9.569 1.00 0.00 C ATOM 1394 CG LYS A 97 7.914 -11.790 -8.531 1.00 0.00 C ATOM 1395 CD LYS A 97 8.615 -11.422 -7.222 1.00 0.00 C ATOM 1396 CE LYS A 97 10.140 -11.497 -7.323 1.00 0.00 C ATOM 1397 NZ LYS A 97 10.755 -11.327 -5.994 1.00 0.00 N ATOM 0 H LYS A 97 7.859 -9.801 -12.144 1.00 0.00 H new ATOM 0 HA LYS A 97 9.789 -9.695 -9.908 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.419 -9.777 -9.031 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.986 -10.952 -10.258 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.917 -12.161 -8.294 1.00 0.00 H new ATOM 0 HG3 LYS A 97 8.459 -12.614 -8.993 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.324 -10.413 -6.931 1.00 0.00 H new ATOM 0 HD3 LYS A 97 8.275 -12.092 -6.432 1.00 0.00 H new ATOM 0 HE2 LYS A 97 10.435 -12.457 -7.747 1.00 0.00 H new ATOM 0 HE3 LYS A 97 10.504 -10.724 -8.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 11.211 -10.394 -5.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 10.021 -11.397 -5.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 11.467 -12.070 -5.843 1.00 0.00 H new ATOM 1411 N GLU A 98 10.790 -11.832 -10.777 1.00 0.00 N ATOM 1412 CA GLU A 98 11.471 -13.050 -11.253 1.00 0.00 C ATOM 1413 C GLU A 98 11.789 -13.052 -12.769 1.00 0.00 C ATOM 1414 O GLU A 98 12.360 -13.976 -13.342 1.00 0.00 O ATOM 1415 CB GLU A 98 10.685 -14.309 -10.731 1.00 0.00 C ATOM 1416 CG GLU A 98 11.316 -15.695 -10.949 1.00 0.00 C ATOM 1417 CD GLU A 98 12.740 -15.754 -10.394 1.00 0.00 C ATOM 1418 OE1 GLU A 98 12.905 -15.538 -9.163 1.00 0.00 O ATOM 1419 OE2 GLU A 98 13.679 -16.019 -11.191 1.00 0.00 O ATOM 0 H GLU A 98 11.381 -11.282 -10.154 1.00 0.00 H new ATOM 0 HA GLU A 98 12.472 -13.083 -10.824 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.522 -14.181 -9.661 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.704 -14.310 -11.205 1.00 0.00 H new ATOM 0 HG2 GLU A 98 10.703 -16.455 -10.465 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.329 -15.927 -12.014 1.00 0.00 H new ATOM 1426 N GLY A 99 11.459 -11.904 -13.412 1.00 0.00 N ATOM 1427 CA GLY A 99 11.673 -11.577 -14.817 1.00 0.00 C ATOM 1428 C GLY A 99 10.368 -11.412 -15.552 1.00 0.00 C ATOM 1429 O GLY A 99 10.351 -11.059 -16.725 1.00 0.00 O ATOM 0 H GLY A 99 11.005 -11.138 -12.914 1.00 0.00 H new ATOM 0 HA2 GLY A 99 12.253 -10.657 -14.893 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.260 -12.364 -15.289 1.00 0.00 H new ATOM 1433 N GLN A 100 9.225 -11.676 -14.869 1.00 0.00 N ATOM 1434 CA GLN A 100 7.887 -11.636 -15.440 1.00 0.00 C ATOM 1435 C GLN A 100 6.887 -10.947 -14.542 1.00 0.00 C ATOM 1436 O GLN A 100 7.175 -10.571 -13.416 1.00 0.00 O ATOM 1437 CB GLN A 100 7.437 -13.034 -15.966 1.00 0.00 C ATOM 1438 CG GLN A 100 7.628 -14.255 -15.026 1.00 0.00 C ATOM 1439 CD GLN A 100 6.504 -14.430 -14.005 1.00 0.00 C ATOM 1440 OE1 GLN A 100 5.455 -15.023 -14.284 1.00 0.00 O ATOM 1441 NE2 GLN A 100 6.719 -13.909 -12.767 1.00 0.00 N ATOM 0 H GLN A 100 9.227 -11.928 -13.881 1.00 0.00 H new ATOM 0 HA GLN A 100 7.929 -11.000 -16.324 1.00 0.00 H new ATOM 0 HB2 GLN A 100 6.380 -12.971 -16.223 1.00 0.00 H new ATOM 0 HB3 GLN A 100 7.978 -13.235 -16.890 1.00 0.00 H new ATOM 0 HG2 GLN A 100 7.701 -15.159 -15.631 1.00 0.00 H new ATOM 0 HG3 GLN A 100 8.574 -14.149 -14.496 1.00 0.00 H new ATOM 0 HE21 GLN A 100 7.593 -13.424 -12.562 1.00 0.00 H new ATOM 0 HE22 GLN A 100 6.006 -14.003 -12.043 1.00 0.00 H new ATOM 1450 N ARG A 101 5.655 -10.677 -15.026 1.00 0.00 N ATOM 1451 CA ARG A 101 4.650 -9.916 -14.297 1.00 0.00 C ATOM 1452 C ARG A 101 3.723 -10.803 -13.488 1.00 0.00 C ATOM 1453 O ARG A 101 3.067 -11.682 -14.034 1.00 0.00 O ATOM 1454 CB ARG A 101 3.835 -8.987 -15.253 1.00 0.00 C ATOM 1455 CG ARG A 101 4.613 -7.834 -15.939 1.00 0.00 C ATOM 1456 CD ARG A 101 5.601 -8.262 -17.039 1.00 0.00 C ATOM 1457 NE ARG A 101 6.103 -7.049 -17.782 1.00 0.00 N ATOM 1458 CZ ARG A 101 5.579 -6.602 -18.966 1.00 0.00 C ATOM 1459 NH1 ARG A 101 4.494 -7.206 -19.532 1.00 0.00 N ATOM 1460 NH2 ARG A 101 6.156 -5.535 -19.592 1.00 0.00 N ATOM 0 H ARG A 101 5.340 -10.990 -15.944 1.00 0.00 H new ATOM 0 HA ARG A 101 5.191 -9.289 -13.589 1.00 0.00 H new ATOM 0 HB2 ARG A 101 3.390 -9.607 -16.031 1.00 0.00 H new ATOM 0 HB3 ARG A 101 3.013 -8.551 -14.684 1.00 0.00 H new ATOM 0 HG2 ARG A 101 3.892 -7.141 -16.372 1.00 0.00 H new ATOM 0 HG3 ARG A 101 5.163 -7.285 -15.175 1.00 0.00 H new ATOM 0 HD2 ARG A 101 6.439 -8.801 -16.597 1.00 0.00 H new ATOM 0 HD3 ARG A 101 5.112 -8.947 -17.732 1.00 0.00 H new ATOM 0 HE ARG A 101 6.882 -6.529 -17.377 1.00 0.00 H new ATOM 0 HH11 ARG A 101 4.058 -8.006 -19.073 1.00 0.00 H new ATOM 0 HH12 ARG A 101 4.119 -6.858 -20.414 1.00 0.00 H new ATOM 0 HH21 ARG A 101 6.969 -5.079 -19.178 1.00 0.00 H new ATOM 0 HH22 ARG A 101 5.774 -5.194 -20.474 1.00 0.00 H new ATOM 1474 N LYS A 102 3.651 -10.570 -12.149 1.00 0.00 N ATOM 1475 CA LYS A 102 2.728 -11.255 -11.244 1.00 0.00 C ATOM 1476 C LYS A 102 1.543 -10.368 -11.103 1.00 0.00 C ATOM 1477 O LYS A 102 1.613 -9.156 -11.273 1.00 0.00 O ATOM 1478 CB LYS A 102 3.256 -11.563 -9.817 1.00 0.00 C ATOM 1479 CG LYS A 102 4.509 -12.446 -9.820 1.00 0.00 C ATOM 1480 CD LYS A 102 4.416 -13.979 -9.998 1.00 0.00 C ATOM 1481 CE LYS A 102 3.648 -14.480 -11.228 1.00 0.00 C ATOM 1482 NZ LYS A 102 3.790 -15.947 -11.380 1.00 0.00 N ATOM 0 H LYS A 102 4.246 -9.890 -11.676 1.00 0.00 H new ATOM 0 HA LYS A 102 2.532 -12.230 -11.689 1.00 0.00 H new ATOM 0 HB2 LYS A 102 3.480 -10.625 -9.308 1.00 0.00 H new ATOM 0 HB3 LYS A 102 2.471 -12.057 -9.244 1.00 0.00 H new ATOM 0 HG2 LYS A 102 5.157 -12.074 -10.613 1.00 0.00 H new ATOM 0 HG3 LYS A 102 5.025 -12.267 -8.877 1.00 0.00 H new ATOM 0 HD2 LYS A 102 5.429 -14.379 -10.042 1.00 0.00 H new ATOM 0 HD3 LYS A 102 3.946 -14.398 -9.108 1.00 0.00 H new ATOM 0 HE2 LYS A 102 2.594 -14.221 -11.133 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.020 -13.980 -12.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 3.262 -16.262 -12.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 4.795 -16.189 -11.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 3.413 -16.422 -10.535 1.00 0.00 H new ATOM 1496 N TRP A 103 0.405 -10.964 -10.778 1.00 0.00 N ATOM 1497 CA TRP A 103 -0.805 -10.198 -10.665 1.00 0.00 C ATOM 1498 C TRP A 103 -1.307 -10.547 -9.290 1.00 0.00 C ATOM 1499 O TRP A 103 -1.822 -11.631 -9.017 1.00 0.00 O ATOM 1500 CB TRP A 103 -1.767 -10.579 -11.825 1.00 0.00 C ATOM 1501 CG TRP A 103 -1.507 -9.880 -13.173 1.00 0.00 C ATOM 1502 CD1 TRP A 103 -1.087 -10.428 -14.356 1.00 0.00 C ATOM 1503 CD2 TRP A 103 -1.851 -8.508 -13.478 1.00 0.00 C ATOM 1504 NE1 TRP A 103 -1.234 -9.515 -15.387 1.00 0.00 N ATOM 1505 CE2 TRP A 103 -1.729 -8.342 -14.855 1.00 0.00 C ATOM 1506 CE3 TRP A 103 -2.269 -7.475 -12.685 1.00 0.00 C ATOM 1507 CZ2 TRP A 103 -2.073 -7.163 -15.453 1.00 0.00 C ATOM 1508 CZ3 TRP A 103 -2.681 -6.303 -13.291 1.00 0.00 C ATOM 1509 CH2 TRP A 103 -2.574 -6.148 -14.660 1.00 0.00 C ATOM 0 H TRP A 103 0.304 -11.962 -10.592 1.00 0.00 H new ATOM 0 HA TRP A 103 -0.687 -9.119 -10.760 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -1.709 -11.656 -11.980 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -2.787 -10.356 -11.513 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -0.697 -11.429 -14.469 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -1.014 -9.681 -16.369 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -2.277 -7.573 -11.609 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -1.956 -7.028 -16.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -3.089 -5.503 -12.691 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -2.886 -5.221 -15.117 1.00 0.00 H new ATOM 1520 N TYR A 104 -1.118 -9.581 -8.376 1.00 0.00 N ATOM 1521 CA TYR A 104 -1.448 -9.768 -6.979 1.00 0.00 C ATOM 1522 C TYR A 104 -2.358 -8.680 -6.517 1.00 0.00 C ATOM 1523 O TYR A 104 -1.995 -7.514 -6.595 1.00 0.00 O ATOM 1524 CB TYR A 104 -0.248 -9.664 -5.976 1.00 0.00 C ATOM 1525 CG TYR A 104 1.003 -10.448 -6.282 1.00 0.00 C ATOM 1526 CD1 TYR A 104 1.014 -11.830 -6.389 1.00 0.00 C ATOM 1527 CD2 TYR A 104 2.217 -9.789 -6.216 1.00 0.00 C ATOM 1528 CE1 TYR A 104 2.213 -12.527 -6.420 1.00 0.00 C ATOM 1529 CE2 TYR A 104 3.411 -10.472 -6.247 1.00 0.00 C ATOM 1530 CZ TYR A 104 3.410 -11.842 -6.336 1.00 0.00 C ATOM 1531 OH TYR A 104 4.646 -12.517 -6.348 1.00 0.00 O ATOM 0 H TYR A 104 -0.735 -8.661 -8.595 1.00 0.00 H new ATOM 0 HA TYR A 104 -1.865 -10.775 -6.962 1.00 0.00 H new ATOM 0 HB2 TYR A 104 0.029 -8.613 -5.895 1.00 0.00 H new ATOM 0 HB3 TYR A 104 -0.606 -9.976 -4.995 1.00 0.00 H new ATOM 0 HD1 TYR A 104 0.080 -12.369 -6.449 1.00 0.00 H new ATOM 0 HD2 TYR A 104 2.228 -8.712 -6.138 1.00 0.00 H new ATOM 0 HE1 TYR A 104 2.211 -13.603 -6.510 1.00 0.00 H new ATOM 0 HE2 TYR A 104 4.345 -9.932 -6.201 1.00 0.00 H new ATOM 0 HH TYR A 104 5.375 -11.866 -6.281 1.00 0.00 H new ATOM 1541 N LYS A 105 -3.496 -9.010 -5.847 1.00 0.00 N ATOM 1542 CA LYS A 105 -4.323 -8.111 -5.077 1.00 0.00 C ATOM 1543 C LYS A 105 -3.543 -7.567 -3.876 1.00 0.00 C ATOM 1544 O LYS A 105 -2.649 -8.253 -3.377 1.00 0.00 O ATOM 1545 CB LYS A 105 -5.570 -8.883 -4.553 1.00 0.00 C ATOM 1546 CG LYS A 105 -5.329 -10.247 -3.862 1.00 0.00 C ATOM 1547 CD LYS A 105 -5.249 -11.515 -4.746 1.00 0.00 C ATOM 1548 CE LYS A 105 -6.551 -11.915 -5.469 1.00 0.00 C ATOM 1549 NZ LYS A 105 -6.780 -11.142 -6.715 1.00 0.00 N ATOM 0 H LYS A 105 -3.857 -9.964 -5.845 1.00 0.00 H new ATOM 0 HA LYS A 105 -4.629 -7.282 -5.715 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -6.094 -8.237 -3.848 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -6.242 -9.047 -5.395 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -4.398 -10.175 -3.300 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -6.128 -10.398 -3.137 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -4.472 -11.364 -5.495 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -4.932 -12.350 -4.122 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -6.516 -12.978 -5.708 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -7.395 -11.767 -4.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -7.622 -10.542 -6.602 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -5.952 -10.543 -6.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -6.927 -11.798 -7.509 1.00 0.00 H new ATOM 1563 N ARG A 106 -3.835 -6.315 -3.430 1.00 0.00 N ATOM 1564 CA ARG A 106 -3.083 -5.452 -2.482 1.00 0.00 C ATOM 1565 C ARG A 106 -2.267 -6.107 -1.370 1.00 0.00 C ATOM 1566 O ARG A 106 -1.119 -5.742 -1.144 1.00 0.00 O ATOM 1567 CB ARG A 106 -3.971 -4.392 -1.765 1.00 0.00 C ATOM 1568 CG ARG A 106 -4.627 -3.348 -2.676 1.00 0.00 C ATOM 1569 CD ARG A 106 -5.106 -2.141 -1.853 1.00 0.00 C ATOM 1570 NE ARG A 106 -5.786 -1.129 -2.736 1.00 0.00 N ATOM 1571 CZ ARG A 106 -7.139 -1.099 -2.946 1.00 0.00 C ATOM 1572 NH1 ARG A 106 -7.948 -2.081 -2.454 1.00 0.00 N ATOM 1573 NH2 ARG A 106 -7.689 -0.073 -3.659 1.00 0.00 N ATOM 0 H ARG A 106 -4.679 -5.843 -3.755 1.00 0.00 H new ATOM 0 HA ARG A 106 -2.380 -5.025 -3.197 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -4.756 -4.913 -1.217 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -3.360 -3.871 -1.028 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -3.916 -3.020 -3.434 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -5.470 -3.795 -3.202 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -5.795 -2.474 -1.077 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -4.257 -1.679 -1.349 1.00 0.00 H new ATOM 0 HE ARG A 106 -5.209 -0.429 -3.202 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -7.547 -2.853 -1.921 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -8.954 -2.044 -2.619 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -7.093 0.666 -4.032 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -8.696 -0.045 -3.819 1.00 0.00 H new ATOM 1587 N MET A 107 -2.812 -7.161 -0.721 1.00 0.00 N ATOM 1588 CA MET A 107 -2.194 -7.990 0.308 1.00 0.00 C ATOM 1589 C MET A 107 -0.931 -8.779 -0.098 1.00 0.00 C ATOM 1590 O MET A 107 -0.148 -9.141 0.776 1.00 0.00 O ATOM 1591 CB MET A 107 -3.257 -8.896 0.986 1.00 0.00 C ATOM 1592 CG MET A 107 -3.976 -9.868 0.023 1.00 0.00 C ATOM 1593 SD MET A 107 -5.591 -10.461 0.619 1.00 0.00 S ATOM 1594 CE MET A 107 -5.001 -11.261 2.137 1.00 0.00 C ATOM 0 H MET A 107 -3.763 -7.466 -0.926 1.00 0.00 H new ATOM 0 HA MET A 107 -1.800 -7.275 1.030 1.00 0.00 H new ATOM 0 HB2 MET A 107 -2.774 -9.475 1.773 1.00 0.00 H new ATOM 0 HB3 MET A 107 -4.002 -8.263 1.467 1.00 0.00 H new ATOM 0 HG2 MET A 107 -4.117 -9.371 -0.937 1.00 0.00 H new ATOM 0 HG3 MET A 107 -3.330 -10.728 -0.155 1.00 0.00 H new ATOM 0 HE1 MET A 107 -5.797 -11.877 2.557 1.00 0.00 H new ATOM 0 HE2 MET A 107 -4.140 -11.888 1.907 1.00 0.00 H new ATOM 0 HE3 MET A 107 -4.712 -10.499 2.861 1.00 0.00 H new ATOM 1604 N ALA A 108 -0.648 -9.009 -1.421 1.00 0.00 N ATOM 1605 CA ALA A 108 0.596 -9.655 -1.883 1.00 0.00 C ATOM 1606 C ALA A 108 1.639 -8.718 -2.452 1.00 0.00 C ATOM 1607 O ALA A 108 2.668 -9.146 -2.969 1.00 0.00 O ATOM 1608 CB ALA A 108 0.396 -10.903 -2.797 1.00 0.00 C ATOM 0 H ALA A 108 -1.279 -8.749 -2.179 1.00 0.00 H new ATOM 0 HA ALA A 108 1.004 -10.027 -0.943 1.00 0.00 H new ATOM 0 HB1 ALA A 108 1.368 -11.304 -3.083 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -0.166 -11.664 -2.256 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -0.154 -10.614 -3.692 1.00 0.00 H new ATOM 1614 N VAL A 109 1.423 -7.409 -2.306 1.00 0.00 N ATOM 1615 CA VAL A 109 2.302 -6.335 -2.666 1.00 0.00 C ATOM 1616 C VAL A 109 2.486 -5.556 -1.388 1.00 0.00 C ATOM 1617 O VAL A 109 1.575 -4.988 -0.788 1.00 0.00 O ATOM 1618 CB VAL A 109 1.907 -5.545 -3.914 1.00 0.00 C ATOM 1619 CG1 VAL A 109 0.585 -4.759 -3.789 1.00 0.00 C ATOM 1620 CG2 VAL A 109 3.094 -4.667 -4.353 1.00 0.00 C ATOM 0 H VAL A 109 0.554 -7.063 -1.899 1.00 0.00 H new ATOM 0 HA VAL A 109 3.263 -6.700 -3.028 1.00 0.00 H new ATOM 0 HB VAL A 109 1.686 -6.267 -4.700 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.387 -4.230 -4.721 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -0.232 -5.451 -3.583 1.00 0.00 H new ATOM 0 HG13 VAL A 109 0.665 -4.040 -2.974 1.00 0.00 H new ATOM 0 HG21 VAL A 109 2.818 -4.101 -5.243 1.00 0.00 H new ATOM 0 HG22 VAL A 109 3.353 -3.977 -3.550 1.00 0.00 H new ATOM 0 HG23 VAL A 109 3.952 -5.301 -4.577 1.00 0.00 H new ATOM 1630 N ILE A 110 3.732 -5.562 -0.923 1.00 0.00 N ATOM 1631 CA ILE A 110 4.182 -4.869 0.272 1.00 0.00 C ATOM 1632 C ILE A 110 5.347 -3.950 -0.056 1.00 0.00 C ATOM 1633 O ILE A 110 5.850 -3.892 -1.180 1.00 0.00 O ATOM 1634 CB ILE A 110 4.547 -5.804 1.427 1.00 0.00 C ATOM 1635 CG1 ILE A 110 5.454 -6.983 0.994 1.00 0.00 C ATOM 1636 CG2 ILE A 110 3.248 -6.292 2.114 1.00 0.00 C ATOM 1637 CD1 ILE A 110 6.482 -7.422 2.048 1.00 0.00 C ATOM 0 H ILE A 110 4.483 -6.071 -1.390 1.00 0.00 H new ATOM 0 HA ILE A 110 3.333 -4.279 0.618 1.00 0.00 H new ATOM 0 HB ILE A 110 5.144 -5.240 2.144 1.00 0.00 H new ATOM 0 HG12 ILE A 110 4.823 -7.836 0.744 1.00 0.00 H new ATOM 0 HG13 ILE A 110 5.984 -6.701 0.084 1.00 0.00 H new ATOM 0 HG21 ILE A 110 3.501 -6.959 2.938 1.00 0.00 H new ATOM 0 HG22 ILE A 110 2.695 -5.435 2.498 1.00 0.00 H new ATOM 0 HG23 ILE A 110 2.632 -6.827 1.390 1.00 0.00 H new ATOM 0 HD11 ILE A 110 7.072 -8.252 1.658 1.00 0.00 H new ATOM 0 HD12 ILE A 110 7.142 -6.587 2.283 1.00 0.00 H new ATOM 0 HD13 ILE A 110 5.963 -7.740 2.952 1.00 0.00 H new ATOM 1649 N LEU A 111 5.810 -3.195 0.984 1.00 0.00 N ATOM 1650 CA LEU A 111 6.902 -2.230 0.940 1.00 0.00 C ATOM 1651 C LEU A 111 7.674 -2.109 2.255 1.00 0.00 C ATOM 1652 O LEU A 111 7.125 -2.357 3.321 1.00 0.00 O ATOM 1653 CB LEU A 111 6.404 -0.817 0.544 1.00 0.00 C ATOM 1654 CG LEU A 111 4.908 -0.451 0.724 1.00 0.00 C ATOM 1655 CD1 LEU A 111 4.264 -0.849 2.038 1.00 0.00 C ATOM 1656 CD2 LEU A 111 4.872 1.061 0.569 1.00 0.00 C ATOM 0 H LEU A 111 5.396 -3.262 1.914 1.00 0.00 H new ATOM 0 HA LEU A 111 7.579 -2.624 0.181 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.987 -0.094 1.115 1.00 0.00 H new ATOM 0 HB3 LEU A 111 6.652 -0.667 -0.507 1.00 0.00 H new ATOM 0 HG LEU A 111 4.325 -1.011 -0.008 1.00 0.00 H new ATOM 0 HD11 LEU A 111 3.219 -0.538 2.040 1.00 0.00 H new ATOM 0 HD12 LEU A 111 4.321 -1.931 2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 111 4.788 -0.365 2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 111 3.847 1.414 0.681 1.00 0.00 H new ATOM 0 HD22 LEU A 111 5.500 1.520 1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 111 5.244 1.334 -0.419 1.00 0.00 H new ATOM 1668 N SER A 112 8.965 -1.661 2.198 1.00 0.00 N ATOM 1669 CA SER A 112 9.877 -1.373 3.317 1.00 0.00 C ATOM 1670 C SER A 112 9.935 0.135 3.588 1.00 0.00 C ATOM 1671 O SER A 112 9.343 0.893 2.816 1.00 0.00 O ATOM 1672 CB SER A 112 11.292 -2.007 3.115 1.00 0.00 C ATOM 1673 OG SER A 112 12.057 -1.420 2.055 1.00 0.00 O ATOM 0 H SER A 112 9.414 -1.484 1.299 1.00 0.00 H new ATOM 0 HA SER A 112 9.472 -1.852 4.209 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.853 -1.917 4.045 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.175 -3.072 2.915 1.00 0.00 H new ATOM 0 HG SER A 112 11.678 -1.687 1.192 1.00 0.00 H new ATOM 1679 N LEU A 113 10.648 0.683 4.647 1.00 0.00 N ATOM 1680 CA LEU A 113 10.705 2.155 4.832 1.00 0.00 C ATOM 1681 C LEU A 113 11.358 2.920 3.720 1.00 0.00 C ATOM 1682 O LEU A 113 10.727 3.800 3.209 1.00 0.00 O ATOM 1683 CB LEU A 113 11.198 2.872 6.112 1.00 0.00 C ATOM 1684 CG LEU A 113 10.680 2.320 7.449 1.00 0.00 C ATOM 1685 CD1 LEU A 113 11.858 2.245 8.430 1.00 0.00 C ATOM 1686 CD2 LEU A 113 9.523 3.100 8.091 1.00 0.00 C ATOM 0 H LEU A 113 11.161 0.141 5.342 1.00 0.00 H new ATOM 0 HA LEU A 113 9.617 2.182 4.892 1.00 0.00 H new ATOM 0 HB2 LEU A 113 12.287 2.834 6.126 1.00 0.00 H new ATOM 0 HB3 LEU A 113 10.916 3.923 6.045 1.00 0.00 H new ATOM 0 HG LEU A 113 10.259 1.340 7.225 1.00 0.00 H new ATOM 0 HD11 LEU A 113 11.511 1.855 9.387 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.626 1.585 8.027 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.275 3.242 8.574 1.00 0.00 H new ATOM 0 HD21 LEU A 113 9.238 2.622 9.029 1.00 0.00 H new ATOM 0 HD22 LEU A 113 9.839 4.124 8.287 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.669 3.107 7.414 1.00 0.00 H new ATOM 1698 N GLU A 114 12.576 2.658 3.249 1.00 0.00 N ATOM 1699 CA GLU A 114 13.158 3.388 2.087 1.00 0.00 C ATOM 1700 C GLU A 114 12.471 3.293 0.705 1.00 0.00 C ATOM 1701 O GLU A 114 12.745 4.077 -0.193 1.00 0.00 O ATOM 1702 CB GLU A 114 14.690 3.573 2.095 1.00 0.00 C ATOM 1703 CG GLU A 114 15.017 4.923 2.776 1.00 0.00 C ATOM 1704 CD GLU A 114 16.524 5.146 2.809 1.00 0.00 C ATOM 1705 OE1 GLU A 114 17.227 4.335 3.471 1.00 0.00 O ATOM 1706 OE2 GLU A 114 16.994 6.128 2.176 1.00 0.00 O ATOM 0 H GLU A 114 13.192 1.947 3.644 1.00 0.00 H new ATOM 0 HA GLU A 114 12.793 4.384 2.339 1.00 0.00 H new ATOM 0 HB2 GLU A 114 15.168 2.753 2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 114 15.079 3.558 1.077 1.00 0.00 H new ATOM 0 HG2 GLU A 114 14.534 5.737 2.236 1.00 0.00 H new ATOM 0 HG3 GLU A 114 14.619 4.932 3.791 1.00 0.00 H new ATOM 1713 N GLN A 115 11.478 2.367 0.612 1.00 0.00 N ATOM 1714 CA GLN A 115 10.432 2.157 -0.386 1.00 0.00 C ATOM 1715 C GLN A 115 9.282 3.156 -0.179 1.00 0.00 C ATOM 1716 O GLN A 115 8.812 3.799 -1.109 1.00 0.00 O ATOM 1717 CB GLN A 115 9.834 0.728 -0.213 1.00 0.00 C ATOM 1718 CG GLN A 115 9.836 -0.110 -1.489 1.00 0.00 C ATOM 1719 CD GLN A 115 11.189 -0.789 -1.654 1.00 0.00 C ATOM 1720 OE1 GLN A 115 11.494 -1.730 -0.907 1.00 0.00 O ATOM 1721 NE2 GLN A 115 11.984 -0.309 -2.640 1.00 0.00 N ATOM 0 H GLN A 115 11.397 1.662 1.344 1.00 0.00 H new ATOM 0 HA GLN A 115 10.874 2.288 -1.374 1.00 0.00 H new ATOM 0 HB2 GLN A 115 10.399 0.201 0.556 1.00 0.00 H new ATOM 0 HB3 GLN A 115 8.810 0.816 0.149 1.00 0.00 H new ATOM 0 HG2 GLN A 115 9.045 -0.859 -1.445 1.00 0.00 H new ATOM 0 HG3 GLN A 115 9.628 0.523 -2.352 1.00 0.00 H new ATOM 0 HE21 GLN A 115 11.667 0.470 -3.217 1.00 0.00 H new ATOM 0 HE22 GLN A 115 12.900 -0.726 -2.805 1.00 0.00 H new ATOM 1730 N GLY A 116 8.838 3.259 1.098 1.00 0.00 N ATOM 1731 CA GLY A 116 7.820 4.107 1.716 1.00 0.00 C ATOM 1732 C GLY A 116 8.186 5.558 2.045 1.00 0.00 C ATOM 1733 O GLY A 116 7.410 6.471 1.826 1.00 0.00 O ATOM 0 H GLY A 116 9.254 2.657 1.808 1.00 0.00 H new ATOM 0 HA2 GLY A 116 6.955 4.124 1.053 1.00 0.00 H new ATOM 0 HA3 GLY A 116 7.503 3.626 2.641 1.00 0.00 H new ATOM 1737 N ASN A 117 9.395 5.827 2.601 1.00 0.00 N ATOM 1738 CA ASN A 117 9.994 7.096 3.044 1.00 0.00 C ATOM 1739 C ASN A 117 10.492 7.934 1.891 1.00 0.00 C ATOM 1740 O ASN A 117 10.503 9.161 1.951 1.00 0.00 O ATOM 1741 CB ASN A 117 11.130 6.936 4.107 1.00 0.00 C ATOM 1742 CG ASN A 117 10.527 6.656 5.485 1.00 0.00 C ATOM 1743 OD1 ASN A 117 9.317 6.482 5.638 1.00 0.00 O ATOM 1744 ND2 ASN A 117 11.395 6.657 6.527 1.00 0.00 N ATOM 0 H ASN A 117 10.046 5.059 2.766 1.00 0.00 H new ATOM 0 HA ASN A 117 9.170 7.616 3.533 1.00 0.00 H new ATOM 0 HB2 ASN A 117 11.795 6.121 3.820 1.00 0.00 H new ATOM 0 HB3 ASN A 117 11.734 7.842 4.144 1.00 0.00 H new ATOM 0 HD21 ASN A 117 11.052 6.510 7.476 1.00 0.00 H new ATOM 0 HD22 ASN A 117 12.391 6.804 6.361 1.00 0.00 H new ATOM 1751 N ARG A 118 10.834 7.281 0.743 1.00 0.00 N ATOM 1752 CA ARG A 118 11.209 7.938 -0.508 1.00 0.00 C ATOM 1753 C ARG A 118 9.995 8.616 -1.182 1.00 0.00 C ATOM 1754 O ARG A 118 10.101 9.511 -2.011 1.00 0.00 O ATOM 1755 CB ARG A 118 11.773 6.950 -1.558 1.00 0.00 C ATOM 1756 CG ARG A 118 10.772 5.893 -2.085 1.00 0.00 C ATOM 1757 CD ARG A 118 10.858 5.663 -3.604 1.00 0.00 C ATOM 1758 NE ARG A 118 12.254 5.218 -3.971 1.00 0.00 N ATOM 1759 CZ ARG A 118 12.670 3.912 -3.979 1.00 0.00 C ATOM 1760 NH1 ARG A 118 11.807 2.894 -3.699 1.00 0.00 N ATOM 1761 NH2 ARG A 118 13.972 3.624 -4.274 1.00 0.00 N ATOM 0 H ARG A 118 10.852 6.263 0.678 1.00 0.00 H new ATOM 0 HA ARG A 118 11.968 8.665 -0.218 1.00 0.00 H new ATOM 0 HB2 ARG A 118 12.149 7.523 -2.406 1.00 0.00 H new ATOM 0 HB3 ARG A 118 12.626 6.431 -1.121 1.00 0.00 H new ATOM 0 HG2 ARG A 118 10.952 4.948 -1.573 1.00 0.00 H new ATOM 0 HG3 ARG A 118 9.759 6.206 -1.831 1.00 0.00 H new ATOM 0 HD2 ARG A 118 10.133 4.909 -3.909 1.00 0.00 H new ATOM 0 HD3 ARG A 118 10.606 6.581 -4.136 1.00 0.00 H new ATOM 0 HE ARG A 118 12.931 5.936 -4.230 1.00 0.00 H new ATOM 0 HH11 ARG A 118 10.832 3.098 -3.478 1.00 0.00 H new ATOM 0 HH12 ARG A 118 12.136 1.929 -3.710 1.00 0.00 H new ATOM 0 HH21 ARG A 118 14.626 4.378 -4.486 1.00 0.00 H new ATOM 0 HH22 ARG A 118 14.291 2.655 -4.282 1.00 0.00 H new ATOM 1775 N LEU A 119 8.799 8.090 -0.784 1.00 0.00 N ATOM 1776 CA LEU A 119 7.444 8.419 -1.186 1.00 0.00 C ATOM 1777 C LEU A 119 6.854 9.423 -0.272 1.00 0.00 C ATOM 1778 O LEU A 119 6.091 10.283 -0.710 1.00 0.00 O ATOM 1779 CB LEU A 119 6.501 7.180 -1.118 1.00 0.00 C ATOM 1780 CG LEU A 119 5.197 7.343 -1.898 1.00 0.00 C ATOM 1781 CD1 LEU A 119 4.729 6.045 -2.489 1.00 0.00 C ATOM 1782 CD2 LEU A 119 4.025 7.782 -1.056 1.00 0.00 C ATOM 0 H LEU A 119 8.788 7.340 -0.093 1.00 0.00 H new ATOM 0 HA LEU A 119 7.520 8.793 -2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 119 7.034 6.310 -1.501 1.00 0.00 H new ATOM 0 HB3 LEU A 119 6.264 6.975 -0.074 1.00 0.00 H new ATOM 0 HG LEU A 119 5.457 8.095 -2.643 1.00 0.00 H new ATOM 0 HD11 LEU A 119 3.799 6.208 -3.034 1.00 0.00 H new ATOM 0 HD12 LEU A 119 5.488 5.661 -3.171 1.00 0.00 H new ATOM 0 HD13 LEU A 119 4.560 5.322 -1.691 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.139 7.874 -1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.841 7.044 -0.276 1.00 0.00 H new ATOM 0 HD23 LEU A 119 4.247 8.746 -0.598 1.00 0.00 H new ATOM 1794 N ARG A 120 7.137 9.290 1.051 1.00 0.00 N ATOM 1795 CA ARG A 120 6.469 9.961 2.148 1.00 0.00 C ATOM 1796 C ARG A 120 6.204 11.474 2.072 1.00 0.00 C ATOM 1797 O ARG A 120 5.176 11.973 2.510 1.00 0.00 O ATOM 1798 CB ARG A 120 7.116 9.574 3.553 1.00 0.00 C ATOM 1799 CG ARG A 120 8.289 10.465 4.031 1.00 0.00 C ATOM 1800 CD ARG A 120 8.830 10.038 5.402 1.00 0.00 C ATOM 1801 NE ARG A 120 10.065 10.841 5.701 1.00 0.00 N ATOM 1802 CZ ARG A 120 10.789 10.695 6.853 1.00 0.00 C ATOM 1803 NH1 ARG A 120 10.398 9.815 7.820 1.00 0.00 N ATOM 1804 NH2 ARG A 120 11.917 11.442 7.038 1.00 0.00 N ATOM 0 H ARG A 120 7.882 8.673 1.376 1.00 0.00 H new ATOM 0 HA ARG A 120 5.462 9.558 2.040 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.333 9.602 4.311 1.00 0.00 H new ATOM 0 HB3 ARG A 120 7.468 8.544 3.497 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.094 10.424 3.297 1.00 0.00 H new ATOM 0 HG3 ARG A 120 7.956 11.502 4.082 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.077 10.201 6.173 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.062 8.973 5.402 1.00 0.00 H new ATOM 0 HE ARG A 120 10.378 11.526 5.013 1.00 0.00 H new ATOM 0 HH11 ARG A 120 9.556 9.255 7.689 1.00 0.00 H new ATOM 0 HH12 ARG A 120 10.948 9.717 8.673 1.00 0.00 H new ATOM 0 HH21 ARG A 120 12.214 12.103 6.320 1.00 0.00 H new ATOM 0 HH22 ARG A 120 12.462 11.339 7.894 1.00 0.00 H new ATOM 1818 N GLU A 121 7.158 12.197 1.441 1.00 0.00 N ATOM 1819 CA GLU A 121 7.187 13.614 1.146 1.00 0.00 C ATOM 1820 C GLU A 121 6.661 13.980 -0.254 1.00 0.00 C ATOM 1821 O GLU A 121 6.367 15.147 -0.503 1.00 0.00 O ATOM 1822 CB GLU A 121 8.648 14.122 1.326 1.00 0.00 C ATOM 1823 CG GLU A 121 9.713 13.293 0.574 1.00 0.00 C ATOM 1824 CD GLU A 121 11.100 13.881 0.835 1.00 0.00 C ATOM 1825 OE1 GLU A 121 11.336 15.047 0.420 1.00 0.00 O ATOM 1826 OE2 GLU A 121 11.941 13.169 1.447 1.00 0.00 O ATOM 0 H GLU A 121 8.003 11.739 1.099 1.00 0.00 H new ATOM 0 HA GLU A 121 6.506 14.104 1.842 1.00 0.00 H new ATOM 0 HB2 GLU A 121 8.704 15.156 0.986 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.890 14.123 2.389 1.00 0.00 H new ATOM 0 HG2 GLU A 121 9.679 12.255 0.904 1.00 0.00 H new ATOM 0 HG3 GLU A 121 9.502 13.295 -0.495 1.00 0.00 H new ATOM 1833 N GLN A 122 6.542 13.005 -1.204 1.00 0.00 N ATOM 1834 CA GLN A 122 6.075 13.213 -2.566 1.00 0.00 C ATOM 1835 C GLN A 122 4.651 12.713 -2.784 1.00 0.00 C ATOM 1836 O GLN A 122 3.886 13.417 -3.442 1.00 0.00 O ATOM 1837 CB GLN A 122 7.056 12.665 -3.665 1.00 0.00 C ATOM 1838 CG GLN A 122 7.537 11.204 -3.479 1.00 0.00 C ATOM 1839 CD GLN A 122 8.229 10.558 -4.695 1.00 0.00 C ATOM 1840 OE1 GLN A 122 7.899 9.419 -5.028 1.00 0.00 O ATOM 1841 NE2 GLN A 122 9.178 11.259 -5.354 1.00 0.00 N ATOM 0 H GLN A 122 6.781 12.032 -1.014 1.00 0.00 H new ATOM 0 HA GLN A 122 6.060 14.296 -2.690 1.00 0.00 H new ATOM 0 HB2 GLN A 122 6.564 12.744 -4.635 1.00 0.00 H new ATOM 0 HB3 GLN A 122 7.932 13.313 -3.698 1.00 0.00 H new ATOM 0 HG2 GLN A 122 8.227 11.175 -2.636 1.00 0.00 H new ATOM 0 HG3 GLN A 122 6.677 10.592 -3.208 1.00 0.00 H new ATOM 0 HE21 GLN A 122 9.423 12.200 -5.046 1.00 0.00 H new ATOM 0 HE22 GLN A 122 9.650 10.847 -6.159 1.00 0.00 H new ATOM 1850 N TYR A 123 4.241 11.490 -2.305 1.00 0.00 N ATOM 1851 CA TYR A 123 2.884 11.016 -2.668 1.00 0.00 C ATOM 1852 C TYR A 123 1.984 10.483 -1.573 1.00 0.00 C ATOM 1853 O TYR A 123 0.954 9.908 -1.923 1.00 0.00 O ATOM 1854 CB TYR A 123 2.873 9.888 -3.758 1.00 0.00 C ATOM 1855 CG TYR A 123 3.691 10.207 -4.956 1.00 0.00 C ATOM 1856 CD1 TYR A 123 3.467 11.322 -5.740 1.00 0.00 C ATOM 1857 CD2 TYR A 123 4.671 9.319 -5.318 1.00 0.00 C ATOM 1858 CE1 TYR A 123 4.244 11.554 -6.859 1.00 0.00 C ATOM 1859 CE2 TYR A 123 5.399 9.513 -6.459 1.00 0.00 C ATOM 1860 CZ TYR A 123 5.215 10.642 -7.224 1.00 0.00 C ATOM 1861 OH TYR A 123 6.026 10.860 -8.355 1.00 0.00 O ATOM 0 H TYR A 123 4.791 10.867 -1.714 1.00 0.00 H new ATOM 0 HA TYR A 123 2.486 11.970 -3.015 1.00 0.00 H new ATOM 0 HB2 TYR A 123 3.240 8.963 -3.314 1.00 0.00 H new ATOM 0 HB3 TYR A 123 1.844 9.706 -4.069 1.00 0.00 H new ATOM 0 HD1 TYR A 123 2.682 12.015 -5.477 1.00 0.00 H new ATOM 0 HD2 TYR A 123 4.870 8.459 -4.696 1.00 0.00 H new ATOM 0 HE1 TYR A 123 4.092 12.447 -7.447 1.00 0.00 H new ATOM 0 HE2 TYR A 123 6.125 8.773 -6.763 1.00 0.00 H new ATOM 0 HH TYR A 123 6.653 10.114 -8.456 1.00 0.00 H new ATOM 1871 N GLY A 124 2.277 10.519 -0.241 1.00 0.00 N ATOM 1872 CA GLY A 124 1.390 9.720 0.558 1.00 0.00 C ATOM 1873 C GLY A 124 1.925 9.737 1.920 1.00 0.00 C ATOM 1874 O GLY A 124 1.359 10.469 2.717 1.00 0.00 O ATOM 0 H GLY A 124 3.025 11.030 0.228 1.00 0.00 H new ATOM 0 HA2 GLY A 124 0.378 10.123 0.534 1.00 0.00 H new ATOM 0 HA3 GLY A 124 1.336 8.701 0.176 1.00 0.00 H new ATOM 1878 N LEU A 125 3.006 8.939 2.226 1.00 0.00 N ATOM 1879 CA LEU A 125 3.522 8.491 3.547 1.00 0.00 C ATOM 1880 C LEU A 125 3.755 9.490 4.710 1.00 0.00 C ATOM 1881 O LEU A 125 4.232 9.120 5.782 1.00 0.00 O ATOM 1882 CB LEU A 125 4.612 7.342 3.459 1.00 0.00 C ATOM 1883 CG LEU A 125 4.115 5.880 3.528 1.00 0.00 C ATOM 1884 CD1 LEU A 125 3.157 5.596 4.723 1.00 0.00 C ATOM 1885 CD2 LEU A 125 3.722 5.424 2.101 1.00 0.00 C ATOM 0 H LEU A 125 3.584 8.565 1.474 1.00 0.00 H new ATOM 0 HA LEU A 125 2.587 8.070 3.916 1.00 0.00 H new ATOM 0 HB2 LEU A 125 5.158 7.468 2.524 1.00 0.00 H new ATOM 0 HB3 LEU A 125 5.326 7.493 4.269 1.00 0.00 H new ATOM 0 HG LEU A 125 4.913 5.196 3.818 1.00 0.00 H new ATOM 0 HD11 LEU A 125 2.851 4.550 4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 125 3.672 5.806 5.660 1.00 0.00 H new ATOM 0 HD13 LEU A 125 2.276 6.233 4.642 1.00 0.00 H new ATOM 0 HD21 LEU A 125 3.369 4.393 2.133 1.00 0.00 H new ATOM 0 HD22 LEU A 125 2.930 6.067 1.719 1.00 0.00 H new ATOM 0 HD23 LEU A 125 4.591 5.490 1.446 1.00 0.00 H new ATOM 1897 N GLY A 126 3.296 10.760 4.559 1.00 0.00 N ATOM 1898 CA GLY A 126 3.237 11.710 5.687 1.00 0.00 C ATOM 1899 C GLY A 126 2.404 12.981 5.551 1.00 0.00 C ATOM 1900 O GLY A 126 2.989 13.992 5.177 1.00 0.00 O ATOM 0 H GLY A 126 2.965 11.142 3.673 1.00 0.00 H new ATOM 0 HA2 GLY A 126 2.864 11.165 6.555 1.00 0.00 H new ATOM 0 HA3 GLY A 126 4.259 12.011 5.915 1.00 0.00 H new ATOM 1904 N PRO A 127 1.083 13.098 5.852 1.00 0.00 N ATOM 1905 CA PRO A 127 0.347 14.366 5.787 1.00 0.00 C ATOM 1906 C PRO A 127 0.281 15.053 7.175 1.00 0.00 C ATOM 1907 O PRO A 127 -0.734 15.684 7.471 1.00 0.00 O ATOM 1908 CB PRO A 127 -1.053 13.852 5.390 1.00 0.00 C ATOM 1909 CG PRO A 127 -1.223 12.600 6.262 1.00 0.00 C ATOM 1910 CD PRO A 127 0.200 11.997 6.259 1.00 0.00 C ATOM 0 HA PRO A 127 0.787 15.105 5.118 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -1.827 14.593 5.592 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -1.109 13.614 4.328 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -1.556 12.849 7.269 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -1.957 11.911 5.844 1.00 0.00 H new ATOM 0 HD2 PRO A 127 0.470 11.620 7.245 1.00 0.00 H new ATOM 0 HD3 PRO A 127 0.271 11.158 5.566 1.00 0.00 H new ATOM 1918 N TYR A 128 1.310 14.936 8.055 1.00 0.00 N ATOM 1919 CA TYR A 128 1.299 15.433 9.427 1.00 0.00 C ATOM 1920 C TYR A 128 2.336 16.525 9.658 1.00 0.00 C ATOM 1921 O TYR A 128 3.502 16.397 9.294 1.00 0.00 O ATOM 1922 CB TYR A 128 1.377 14.271 10.484 1.00 0.00 C ATOM 1923 CG TYR A 128 2.679 13.487 10.568 1.00 0.00 C ATOM 1924 CD1 TYR A 128 3.057 12.619 9.561 1.00 0.00 C ATOM 1925 CD2 TYR A 128 3.488 13.572 11.695 1.00 0.00 C ATOM 1926 CE1 TYR A 128 4.197 11.848 9.676 1.00 0.00 C ATOM 1927 CE2 TYR A 128 4.626 12.792 11.819 1.00 0.00 C ATOM 1928 CZ TYR A 128 4.974 11.916 10.811 1.00 0.00 C ATOM 1929 OH TYR A 128 6.103 11.071 10.919 1.00 0.00 O ATOM 0 H TYR A 128 2.187 14.478 7.808 1.00 0.00 H new ATOM 0 HA TYR A 128 0.330 15.909 9.580 1.00 0.00 H new ATOM 0 HB2 TYR A 128 1.176 14.696 11.467 1.00 0.00 H new ATOM 0 HB3 TYR A 128 0.573 13.567 10.270 1.00 0.00 H new ATOM 0 HD1 TYR A 128 2.451 12.542 8.670 1.00 0.00 H new ATOM 0 HD2 TYR A 128 3.225 14.257 12.487 1.00 0.00 H new ATOM 0 HE1 TYR A 128 4.481 11.187 8.870 1.00 0.00 H new ATOM 0 HE2 TYR A 128 5.240 12.869 12.704 1.00 0.00 H new ATOM 0 HH TYR A 128 6.553 11.234 11.774 1.00 0.00 H new ATOM 1939 N GLU A 129 1.913 17.635 10.304 1.00 0.00 N ATOM 1940 CA GLU A 129 2.758 18.762 10.647 1.00 0.00 C ATOM 1941 C GLU A 129 2.151 19.389 11.886 1.00 0.00 C ATOM 1942 O GLU A 129 0.977 19.149 12.176 1.00 0.00 O ATOM 1943 CB GLU A 129 2.863 19.790 9.484 1.00 0.00 C ATOM 1944 CG GLU A 129 3.830 20.960 9.748 1.00 0.00 C ATOM 1945 CD GLU A 129 3.968 21.808 8.484 1.00 0.00 C ATOM 1946 OE1 GLU A 129 2.941 22.391 8.045 1.00 0.00 O ATOM 1947 OE2 GLU A 129 5.103 21.885 7.941 1.00 0.00 O ATOM 0 H GLU A 129 0.945 17.758 10.602 1.00 0.00 H new ATOM 0 HA GLU A 129 3.780 18.431 10.833 1.00 0.00 H new ATOM 0 HB2 GLU A 129 3.183 19.268 8.583 1.00 0.00 H new ATOM 0 HB3 GLU A 129 1.871 20.194 9.283 1.00 0.00 H new ATOM 0 HG2 GLU A 129 3.460 21.572 10.570 1.00 0.00 H new ATOM 0 HG3 GLU A 129 4.805 20.578 10.050 1.00 0.00 H new TER 1954 GLU A 129