USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 768 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 88 THR OG1 : rot 5:sc= 1.4 USER MOD Set 1.2: A 89 HIS : no HE2:sc= -2.17! C(o=-3!,f=-10!) USER MOD Set 1.3: A 107 LYS NZ :NH3+ 146:sc= -2.2 (180deg=-0.786) USER MOD Set 2.1: A 79 HIS : no HD1:sc= -5.68! C(o=-4.3!,f=-9.5!) USER MOD Set 2.2: A 87 THR OG1 : rot -16:sc= 1.35 USER MOD Set 3.1: A 55 TYR OH : rot -133:sc= 1.3 USER MOD Set 3.2: A 57 ASN : amide:sc= 1.08 K(o=2.4,f=1.3) USER MOD Single : A 38 SER OG : rot 21:sc= 1.2 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 55:sc= 0.439 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 75:sc= -0.837 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -155:sc= -0.641 (180deg=-1.99!) USER MOD Single : A 71 MET CE :methyl -111:sc= -1.84! (180deg=-5.19!) USER MOD Single : A 72 MET CE :methyl 167:sc= 0 (180deg=-0.196) USER MOD Single : A 74 HIS : no HE2:sc= -1.48! C(o=-1.5!,f=-2.9!) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 160:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot -140:sc= -0.39 USER MOD Single : A 94 ASN : amide:sc= -0.685 K(o=-0.69,f=-2.6) USER MOD Single : A 97 ASN : amide:sc= -0.867 K(o=-0.87,f=-1.6!) USER MOD Single : A 99 LYS NZ :NH3+ -178:sc= -0.0628 (180deg=-0.0893) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 98:sc= 1.05 USER MOD Single : A 119 LYS NZ :NH3+ -137:sc= 0 (180deg=-1.88!) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= -4.68! K(o=-4.7!,f=-2.3) USER MOD Single : A 132 TYR OH : rot 130:sc= -0.0701 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 37 -8.580 23.520 -10.836 1.00 0.00 N ATOM 2 CA GLY A 37 -9.092 23.256 -9.504 1.00 0.00 C ATOM 3 C GLY A 37 -8.009 22.802 -8.546 1.00 0.00 C ATOM 4 O GLY A 37 -7.257 21.874 -8.843 1.00 0.00 O ATOM 0 HA2 GLY A 37 -9.563 24.158 -9.114 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -9.866 22.491 -9.561 1.00 0.00 H new ATOM 8 N SER A 38 -7.928 23.459 -7.393 1.00 0.00 N ATOM 9 CA SER A 38 -6.925 23.121 -6.390 1.00 0.00 C ATOM 10 C SER A 38 -7.254 23.775 -5.051 1.00 0.00 C ATOM 11 O SER A 38 -7.955 24.785 -4.997 1.00 0.00 O ATOM 12 CB SER A 38 -5.536 23.562 -6.858 1.00 0.00 C ATOM 13 OG SER A 38 -4.961 22.599 -7.724 1.00 0.00 O ATOM 0 H SER A 38 -8.545 24.228 -7.131 1.00 0.00 H new ATOM 0 HA SER A 38 -6.930 22.039 -6.257 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.609 24.520 -7.372 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.888 23.712 -5.994 1.00 0.00 H new ATOM 0 HG SER A 38 -5.669 22.039 -8.107 1.00 0.00 H new ATOM 19 N SER A 39 -6.741 23.191 -3.973 1.00 0.00 N ATOM 20 CA SER A 39 -6.983 23.713 -2.633 1.00 0.00 C ATOM 21 C SER A 39 -5.813 24.574 -2.166 1.00 0.00 C ATOM 22 O SER A 39 -4.738 24.557 -2.764 1.00 0.00 O ATOM 23 CB SER A 39 -7.211 22.565 -1.648 1.00 0.00 C ATOM 24 OG SER A 39 -8.574 22.180 -1.620 1.00 0.00 O ATOM 0 H SER A 39 -6.155 22.356 -4.001 1.00 0.00 H new ATOM 0 HA SER A 39 -7.878 24.334 -2.668 1.00 0.00 H new ATOM 0 HB2 SER A 39 -6.595 21.712 -1.930 1.00 0.00 H new ATOM 0 HB3 SER A 39 -6.895 22.870 -0.650 1.00 0.00 H new ATOM 0 HG SER A 39 -8.693 21.444 -0.984 1.00 0.00 H new ATOM 30 N GLY A 40 -6.032 25.328 -1.093 1.00 0.00 N ATOM 31 CA GLY A 40 -4.988 26.185 -0.563 1.00 0.00 C ATOM 32 C GLY A 40 -3.947 25.413 0.224 1.00 0.00 C ATOM 33 O GLY A 40 -2.769 25.407 -0.133 1.00 0.00 O ATOM 0 H GLY A 40 -6.914 25.360 -0.581 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -4.502 26.710 -1.385 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -5.436 26.943 0.079 1.00 0.00 H new ATOM 37 N SER A 41 -4.382 24.762 1.298 1.00 0.00 N ATOM 38 CA SER A 41 -3.478 23.988 2.140 1.00 0.00 C ATOM 39 C SER A 41 -3.995 22.565 2.328 1.00 0.00 C ATOM 40 O SER A 41 -4.810 22.300 3.212 1.00 0.00 O ATOM 41 CB SER A 41 -3.311 24.666 3.502 1.00 0.00 C ATOM 42 OG SER A 41 -2.259 24.070 4.242 1.00 0.00 O ATOM 0 H SER A 41 -5.355 24.755 1.605 1.00 0.00 H new ATOM 0 HA SER A 41 -2.509 23.941 1.643 1.00 0.00 H new ATOM 0 HB2 SER A 41 -3.105 25.727 3.361 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.242 24.594 4.064 1.00 0.00 H new ATOM 0 HG SER A 41 -2.171 24.521 5.107 1.00 0.00 H new ATOM 48 N SER A 42 -3.515 21.653 1.489 1.00 0.00 N ATOM 49 CA SER A 42 -3.931 20.257 1.559 1.00 0.00 C ATOM 50 C SER A 42 -3.674 19.682 2.948 1.00 0.00 C ATOM 51 O SER A 42 -4.554 19.071 3.552 1.00 0.00 O ATOM 52 CB SER A 42 -3.190 19.429 0.506 1.00 0.00 C ATOM 53 OG SER A 42 -3.631 18.082 0.514 1.00 0.00 O ATOM 0 H SER A 42 -2.838 21.855 0.753 1.00 0.00 H new ATOM 0 HA SER A 42 -5.002 20.212 1.359 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.351 19.862 -0.481 1.00 0.00 H new ATOM 0 HB3 SER A 42 -2.118 19.465 0.699 1.00 0.00 H new ATOM 0 HG SER A 42 -3.144 17.574 -0.168 1.00 0.00 H new ATOM 59 N GLY A 43 -2.458 19.883 3.449 1.00 0.00 N ATOM 60 CA GLY A 43 -2.105 19.379 4.763 1.00 0.00 C ATOM 61 C GLY A 43 -0.680 18.867 4.824 1.00 0.00 C ATOM 62 O GLY A 43 0.229 19.585 5.242 1.00 0.00 O ATOM 0 H GLY A 43 -1.712 20.386 2.968 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.235 20.172 5.500 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.789 18.575 5.036 1.00 0.00 H new ATOM 66 N THR A 44 -0.482 17.620 4.408 1.00 0.00 N ATOM 67 CA THR A 44 0.842 17.011 4.419 1.00 0.00 C ATOM 68 C THR A 44 1.339 16.749 3.002 1.00 0.00 C ATOM 69 O THR A 44 1.138 15.665 2.454 1.00 0.00 O ATOM 70 CB THR A 44 0.845 15.687 5.205 1.00 0.00 C ATOM 71 OG1 THR A 44 -0.195 14.828 4.723 1.00 0.00 O ATOM 72 CG2 THR A 44 0.651 15.940 6.693 1.00 0.00 C ATOM 0 H THR A 44 -1.223 17.012 4.059 1.00 0.00 H new ATOM 0 HA THR A 44 1.510 17.718 4.910 1.00 0.00 H new ATOM 0 HB THR A 44 1.811 15.205 5.057 1.00 0.00 H new ATOM 0 HG1 THR A 44 -0.092 14.700 3.757 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.657 14.990 7.227 1.00 0.00 H new ATOM 0 HG22 THR A 44 1.460 16.570 7.064 1.00 0.00 H new ATOM 0 HG23 THR A 44 -0.303 16.442 6.855 1.00 0.00 H new ATOM 80 N SER A 45 1.990 17.747 2.414 1.00 0.00 N ATOM 81 CA SER A 45 2.513 17.625 1.058 1.00 0.00 C ATOM 82 C SER A 45 3.695 16.661 1.017 1.00 0.00 C ATOM 83 O SER A 45 4.830 17.039 1.307 1.00 0.00 O ATOM 84 CB SER A 45 2.940 18.995 0.528 1.00 0.00 C ATOM 85 OG SER A 45 1.888 19.938 0.645 1.00 0.00 O ATOM 0 H SER A 45 2.168 18.649 2.855 1.00 0.00 H new ATOM 0 HA SER A 45 1.720 17.229 0.423 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.811 19.347 1.081 1.00 0.00 H new ATOM 0 HB3 SER A 45 3.239 18.907 -0.516 1.00 0.00 H new ATOM 0 HG SER A 45 2.187 20.806 0.301 1.00 0.00 H new ATOM 91 N SER A 46 3.419 15.412 0.655 1.00 0.00 N ATOM 92 CA SER A 46 4.457 14.391 0.579 1.00 0.00 C ATOM 93 C SER A 46 4.141 13.375 -0.515 1.00 0.00 C ATOM 94 O SER A 46 3.056 12.794 -0.545 1.00 0.00 O ATOM 95 CB SER A 46 4.601 13.679 1.925 1.00 0.00 C ATOM 96 OG SER A 46 5.162 14.542 2.900 1.00 0.00 O ATOM 0 H SER A 46 2.485 15.083 0.410 1.00 0.00 H new ATOM 0 HA SER A 46 5.398 14.883 0.333 1.00 0.00 H new ATOM 0 HB2 SER A 46 3.625 13.330 2.262 1.00 0.00 H new ATOM 0 HB3 SER A 46 5.232 12.798 1.808 1.00 0.00 H new ATOM 0 HG SER A 46 5.242 14.065 3.752 1.00 0.00 H new ATOM 102 N THR A 47 5.098 13.166 -1.414 1.00 0.00 N ATOM 103 CA THR A 47 4.923 12.222 -2.510 1.00 0.00 C ATOM 104 C THR A 47 5.731 10.950 -2.275 1.00 0.00 C ATOM 105 O THR A 47 6.385 10.442 -3.186 1.00 0.00 O ATOM 106 CB THR A 47 5.343 12.841 -3.857 1.00 0.00 C ATOM 107 OG1 THR A 47 6.606 13.501 -3.720 1.00 0.00 O ATOM 108 CG2 THR A 47 4.297 13.832 -4.346 1.00 0.00 C ATOM 0 H THR A 47 6.002 13.638 -1.404 1.00 0.00 H new ATOM 0 HA THR A 47 3.862 11.974 -2.547 1.00 0.00 H new ATOM 0 HB THR A 47 5.431 12.039 -4.589 1.00 0.00 H new ATOM 0 HG1 THR A 47 6.867 13.890 -4.581 1.00 0.00 H new ATOM 0 HG21 THR A 47 4.615 14.256 -5.298 1.00 0.00 H new ATOM 0 HG22 THR A 47 3.344 13.320 -4.477 1.00 0.00 H new ATOM 0 HG23 THR A 47 4.182 14.631 -3.613 1.00 0.00 H new ATOM 116 N ILE A 48 5.679 10.441 -1.049 1.00 0.00 N ATOM 117 CA ILE A 48 6.405 9.227 -0.696 1.00 0.00 C ATOM 118 C ILE A 48 5.770 7.999 -1.342 1.00 0.00 C ATOM 119 O ILE A 48 6.411 6.958 -1.483 1.00 0.00 O ATOM 120 CB ILE A 48 6.453 9.023 0.830 1.00 0.00 C ATOM 121 CG1 ILE A 48 5.037 8.984 1.406 1.00 0.00 C ATOM 122 CG2 ILE A 48 7.267 10.129 1.486 1.00 0.00 C ATOM 123 CD1 ILE A 48 4.963 8.374 2.788 1.00 0.00 C ATOM 0 H ILE A 48 5.142 10.850 -0.284 1.00 0.00 H new ATOM 0 HA ILE A 48 7.422 9.347 -1.070 1.00 0.00 H new ATOM 0 HB ILE A 48 6.936 8.069 1.039 1.00 0.00 H new ATOM 0 HG12 ILE A 48 4.641 9.999 1.444 1.00 0.00 H new ATOM 0 HG13 ILE A 48 4.395 8.416 0.732 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.292 9.972 2.564 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.284 10.114 1.093 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.809 11.094 1.271 1.00 0.00 H new ATOM 0 HD11 ILE A 48 3.929 8.379 3.133 1.00 0.00 H new ATOM 0 HD12 ILE A 48 5.328 7.348 2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.578 8.955 3.475 1.00 0.00 H new ATOM 135 N PHE A 49 4.507 8.130 -1.733 1.00 0.00 N ATOM 136 CA PHE A 49 3.785 7.032 -2.364 1.00 0.00 C ATOM 137 C PHE A 49 3.310 7.425 -3.760 1.00 0.00 C ATOM 138 O PHE A 49 2.203 7.078 -4.171 1.00 0.00 O ATOM 139 CB PHE A 49 2.589 6.618 -1.504 1.00 0.00 C ATOM 140 CG PHE A 49 2.972 5.829 -0.285 1.00 0.00 C ATOM 141 CD1 PHE A 49 3.632 4.617 -0.407 1.00 0.00 C ATOM 142 CD2 PHE A 49 2.670 6.299 0.983 1.00 0.00 C ATOM 143 CE1 PHE A 49 3.986 3.889 0.713 1.00 0.00 C ATOM 144 CE2 PHE A 49 3.022 5.575 2.107 1.00 0.00 C ATOM 145 CZ PHE A 49 3.680 4.368 1.971 1.00 0.00 C ATOM 0 H PHE A 49 3.962 8.986 -1.624 1.00 0.00 H new ATOM 0 HA PHE A 49 4.467 6.187 -2.455 1.00 0.00 H new ATOM 0 HB2 PHE A 49 2.048 7.512 -1.193 1.00 0.00 H new ATOM 0 HB3 PHE A 49 1.904 6.025 -2.110 1.00 0.00 H new ATOM 0 HD1 PHE A 49 3.873 4.237 -1.389 1.00 0.00 H new ATOM 0 HD2 PHE A 49 2.154 7.241 1.095 1.00 0.00 H new ATOM 0 HE1 PHE A 49 4.502 2.946 0.604 1.00 0.00 H new ATOM 0 HE2 PHE A 49 2.783 5.953 3.090 1.00 0.00 H new ATOM 0 HZ PHE A 49 3.955 3.800 2.848 1.00 0.00 H new ATOM 155 N SER A 50 4.156 8.151 -4.484 1.00 0.00 N ATOM 156 CA SER A 50 3.822 8.596 -5.832 1.00 0.00 C ATOM 157 C SER A 50 3.830 7.423 -6.808 1.00 0.00 C ATOM 158 O SER A 50 4.778 6.641 -6.848 1.00 0.00 O ATOM 159 CB SER A 50 4.809 9.668 -6.297 1.00 0.00 C ATOM 160 OG SER A 50 4.209 10.539 -7.240 1.00 0.00 O ATOM 0 H SER A 50 5.078 8.444 -4.160 1.00 0.00 H new ATOM 0 HA SER A 50 2.819 9.021 -5.810 1.00 0.00 H new ATOM 0 HB2 SER A 50 5.159 10.242 -5.439 1.00 0.00 H new ATOM 0 HB3 SER A 50 5.684 9.193 -6.741 1.00 0.00 H new ATOM 0 HG SER A 50 4.860 11.216 -7.520 1.00 0.00 H new ATOM 166 N GLY A 51 2.764 7.309 -7.595 1.00 0.00 N ATOM 167 CA GLY A 51 2.667 6.230 -8.560 1.00 0.00 C ATOM 168 C GLY A 51 2.766 4.863 -7.914 1.00 0.00 C ATOM 169 O GLY A 51 3.349 3.939 -8.483 1.00 0.00 O ATOM 0 H GLY A 51 1.966 7.945 -7.581 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.720 6.308 -9.094 1.00 0.00 H new ATOM 0 HA3 GLY A 51 3.460 6.337 -9.300 1.00 0.00 H new ATOM 173 N VAL A 52 2.197 4.732 -6.719 1.00 0.00 N ATOM 174 CA VAL A 52 2.224 3.467 -5.994 1.00 0.00 C ATOM 175 C VAL A 52 0.814 2.941 -5.754 1.00 0.00 C ATOM 176 O VAL A 52 0.133 3.364 -4.820 1.00 0.00 O ATOM 177 CB VAL A 52 2.944 3.612 -4.640 1.00 0.00 C ATOM 178 CG1 VAL A 52 2.942 2.289 -3.890 1.00 0.00 C ATOM 179 CG2 VAL A 52 4.364 4.118 -4.844 1.00 0.00 C ATOM 0 H VAL A 52 1.712 5.486 -6.233 1.00 0.00 H new ATOM 0 HA VAL A 52 2.772 2.758 -6.614 1.00 0.00 H new ATOM 0 HB VAL A 52 2.406 4.344 -4.038 1.00 0.00 H new ATOM 0 HG11 VAL A 52 3.455 2.411 -2.936 1.00 0.00 H new ATOM 0 HG12 VAL A 52 1.914 1.973 -3.712 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.456 1.533 -4.484 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.858 4.215 -3.877 1.00 0.00 H new ATOM 0 HG22 VAL A 52 4.916 3.412 -5.465 1.00 0.00 H new ATOM 0 HG23 VAL A 52 4.337 5.090 -5.336 1.00 0.00 H new ATOM 189 N ALA A 53 0.381 2.015 -6.603 1.00 0.00 N ATOM 190 CA ALA A 53 -0.948 1.428 -6.481 1.00 0.00 C ATOM 191 C ALA A 53 -0.932 0.220 -5.551 1.00 0.00 C ATOM 192 O ALA A 53 -0.083 -0.663 -5.680 1.00 0.00 O ATOM 193 CB ALA A 53 -1.478 1.034 -7.852 1.00 0.00 C ATOM 0 H ALA A 53 0.931 1.655 -7.383 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.611 2.177 -6.048 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -2.471 0.597 -7.746 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.536 1.918 -8.487 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -0.807 0.305 -8.306 1.00 0.00 H new ATOM 199 N ILE A 54 -1.874 0.188 -4.615 1.00 0.00 N ATOM 200 CA ILE A 54 -1.968 -0.913 -3.663 1.00 0.00 C ATOM 201 C ILE A 54 -3.325 -1.601 -3.751 1.00 0.00 C ATOM 202 O ILE A 54 -4.318 -0.992 -4.150 1.00 0.00 O ATOM 203 CB ILE A 54 -1.743 -0.428 -2.219 1.00 0.00 C ATOM 204 CG1 ILE A 54 -2.956 0.365 -1.729 1.00 0.00 C ATOM 205 CG2 ILE A 54 -0.481 0.417 -2.134 1.00 0.00 C ATOM 206 CD1 ILE A 54 -2.903 0.701 -0.255 1.00 0.00 C ATOM 0 H ILE A 54 -2.583 0.911 -4.495 1.00 0.00 H new ATOM 0 HA ILE A 54 -1.185 -1.625 -3.925 1.00 0.00 H new ATOM 0 HB ILE A 54 -1.618 -1.298 -1.575 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -3.031 1.289 -2.302 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -3.861 -0.209 -1.930 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.336 0.752 -1.107 1.00 0.00 H new ATOM 0 HG22 ILE A 54 0.377 -0.178 -2.446 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.579 1.284 -2.788 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -3.795 1.263 0.022 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -2.859 -0.220 0.327 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -2.017 1.302 -0.050 1.00 0.00 H new ATOM 218 N TYR A 55 -3.361 -2.875 -3.375 1.00 0.00 N ATOM 219 CA TYR A 55 -4.597 -3.648 -3.412 1.00 0.00 C ATOM 220 C TYR A 55 -4.723 -4.534 -2.176 1.00 0.00 C ATOM 221 O TYR A 55 -4.014 -5.531 -2.038 1.00 0.00 O ATOM 222 CB TYR A 55 -4.649 -4.507 -4.677 1.00 0.00 C ATOM 223 CG TYR A 55 -5.693 -5.599 -4.625 1.00 0.00 C ATOM 224 CD1 TYR A 55 -7.024 -5.328 -4.918 1.00 0.00 C ATOM 225 CD2 TYR A 55 -5.350 -6.900 -4.282 1.00 0.00 C ATOM 226 CE1 TYR A 55 -7.983 -6.322 -4.871 1.00 0.00 C ATOM 227 CE2 TYR A 55 -6.301 -7.901 -4.234 1.00 0.00 C ATOM 228 CZ TYR A 55 -7.616 -7.607 -4.529 1.00 0.00 C ATOM 229 OH TYR A 55 -8.567 -8.601 -4.481 1.00 0.00 O ATOM 0 H TYR A 55 -2.549 -3.394 -3.041 1.00 0.00 H new ATOM 0 HA TYR A 55 -5.433 -2.948 -3.422 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -4.850 -3.864 -5.534 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -3.671 -4.959 -4.840 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -7.314 -4.323 -5.187 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -4.322 -7.134 -4.049 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -9.013 -6.094 -5.101 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -6.016 -8.908 -3.967 1.00 0.00 H new ATOM 0 HH TYR A 55 -8.459 -9.117 -3.655 1.00 0.00 H new ATOM 239 N VAL A 56 -5.631 -4.162 -1.280 1.00 0.00 N ATOM 240 CA VAL A 56 -5.852 -4.923 -0.056 1.00 0.00 C ATOM 241 C VAL A 56 -6.699 -6.162 -0.324 1.00 0.00 C ATOM 242 O VAL A 56 -7.797 -6.070 -0.870 1.00 0.00 O ATOM 243 CB VAL A 56 -6.544 -4.065 1.021 1.00 0.00 C ATOM 244 CG1 VAL A 56 -6.695 -4.851 2.314 1.00 0.00 C ATOM 245 CG2 VAL A 56 -5.768 -2.779 1.256 1.00 0.00 C ATOM 0 H VAL A 56 -6.225 -3.339 -1.378 1.00 0.00 H new ATOM 0 HA VAL A 56 -4.871 -5.229 0.308 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.540 -3.801 0.667 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -7.186 -4.229 3.063 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.297 -5.741 2.131 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -5.711 -5.147 2.677 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -6.271 -2.185 2.019 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -4.758 -3.019 1.589 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -5.718 -2.210 0.328 1.00 0.00 H new ATOM 255 N ASN A 57 -6.179 -7.322 0.064 1.00 0.00 N ATOM 256 CA ASN A 57 -6.887 -8.582 -0.135 1.00 0.00 C ATOM 257 C ASN A 57 -7.074 -9.316 1.189 1.00 0.00 C ATOM 258 O ASN A 57 -6.104 -9.685 1.849 1.00 0.00 O ATOM 259 CB ASN A 57 -6.124 -9.470 -1.120 1.00 0.00 C ATOM 260 CG ASN A 57 -7.009 -10.530 -1.748 1.00 0.00 C ATOM 261 OD1 ASN A 57 -7.765 -10.251 -2.678 1.00 0.00 O ATOM 262 ND2 ASN A 57 -6.918 -11.753 -1.240 1.00 0.00 N ATOM 0 H ASN A 57 -5.270 -7.416 0.518 1.00 0.00 H new ATOM 0 HA ASN A 57 -7.871 -8.356 -0.547 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -5.692 -8.849 -1.905 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -5.295 -9.953 -0.603 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -7.489 -12.507 -1.621 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -6.277 -11.938 -0.469 1.00 0.00 H new ATOM 269 N GLY A 58 -8.331 -9.524 1.572 1.00 0.00 N ATOM 270 CA GLY A 58 -8.623 -10.213 2.815 1.00 0.00 C ATOM 271 C GLY A 58 -8.489 -9.309 4.025 1.00 0.00 C ATOM 272 O GLY A 58 -8.381 -8.090 3.888 1.00 0.00 O ATOM 0 H GLY A 58 -9.151 -9.227 1.043 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -9.636 -10.614 2.775 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -7.948 -11.062 2.923 1.00 0.00 H new ATOM 276 N TYR A 59 -8.498 -9.906 5.211 1.00 0.00 N ATOM 277 CA TYR A 59 -8.382 -9.146 6.450 1.00 0.00 C ATOM 278 C TYR A 59 -7.028 -8.446 6.535 1.00 0.00 C ATOM 279 O TYR A 59 -5.986 -9.051 6.282 1.00 0.00 O ATOM 280 CB TYR A 59 -8.569 -10.066 7.657 1.00 0.00 C ATOM 281 CG TYR A 59 -8.507 -9.344 8.984 1.00 0.00 C ATOM 282 CD1 TYR A 59 -7.293 -8.924 9.513 1.00 0.00 C ATOM 283 CD2 TYR A 59 -9.663 -9.082 9.710 1.00 0.00 C ATOM 284 CE1 TYR A 59 -7.231 -8.265 10.726 1.00 0.00 C ATOM 285 CE2 TYR A 59 -9.611 -8.422 10.922 1.00 0.00 C ATOM 286 CZ TYR A 59 -8.393 -8.016 11.426 1.00 0.00 C ATOM 287 OH TYR A 59 -8.338 -7.359 12.634 1.00 0.00 O ATOM 0 H TYR A 59 -8.584 -10.914 5.341 1.00 0.00 H new ATOM 0 HA TYR A 59 -9.164 -8.387 6.455 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -9.531 -10.571 7.572 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -7.800 -10.839 7.637 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -6.381 -9.116 8.966 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -10.618 -9.400 9.320 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -6.279 -7.947 11.123 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -10.519 -8.225 11.472 1.00 0.00 H new ATOM 0 HH TYR A 59 -9.244 -7.263 12.996 1.00 0.00 H new ATOM 297 N THR A 60 -7.053 -7.166 6.893 1.00 0.00 N ATOM 298 CA THR A 60 -5.830 -6.382 7.011 1.00 0.00 C ATOM 299 C THR A 60 -5.979 -5.285 8.059 1.00 0.00 C ATOM 300 O THR A 60 -7.089 -4.842 8.354 1.00 0.00 O ATOM 301 CB THR A 60 -5.441 -5.742 5.665 1.00 0.00 C ATOM 302 OG1 THR A 60 -6.511 -4.920 5.186 1.00 0.00 O ATOM 303 CG2 THR A 60 -5.112 -6.809 4.632 1.00 0.00 C ATOM 0 H THR A 60 -7.907 -6.650 7.106 1.00 0.00 H new ATOM 0 HA THR A 60 -5.042 -7.070 7.319 1.00 0.00 H new ATOM 0 HB THR A 60 -4.554 -5.128 5.823 1.00 0.00 H new ATOM 0 HG1 THR A 60 -6.545 -4.091 5.707 1.00 0.00 H new ATOM 0 HG21 THR A 60 -4.840 -6.332 3.690 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.277 -7.414 4.987 1.00 0.00 H new ATOM 0 HG23 THR A 60 -5.982 -7.447 4.478 1.00 0.00 H new ATOM 311 N ASP A 61 -4.854 -4.850 8.617 1.00 0.00 N ATOM 312 CA ASP A 61 -4.860 -3.802 9.631 1.00 0.00 C ATOM 313 C ASP A 61 -3.887 -2.686 9.265 1.00 0.00 C ATOM 314 O ASP A 61 -2.683 -2.902 9.122 1.00 0.00 O ATOM 315 CB ASP A 61 -4.497 -4.384 10.998 1.00 0.00 C ATOM 316 CG ASP A 61 -3.043 -4.805 11.081 1.00 0.00 C ATOM 317 OD1 ASP A 61 -2.606 -5.601 10.224 1.00 0.00 O ATOM 318 OD2 ASP A 61 -2.342 -4.337 12.003 1.00 0.00 O ATOM 0 H ASP A 61 -3.927 -5.207 8.384 1.00 0.00 H new ATOM 0 HA ASP A 61 -5.865 -3.382 9.678 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -4.702 -3.643 11.771 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -5.134 -5.245 11.204 1.00 0.00 H new ATOM 323 N PRO A 62 -4.418 -1.465 9.109 1.00 0.00 N ATOM 324 CA PRO A 62 -5.849 -1.196 9.277 1.00 0.00 C ATOM 325 C PRO A 62 -6.689 -1.811 8.162 1.00 0.00 C ATOM 326 O PRO A 62 -6.167 -2.506 7.290 1.00 0.00 O ATOM 327 CB PRO A 62 -5.932 0.331 9.229 1.00 0.00 C ATOM 328 CG PRO A 62 -4.739 0.751 8.442 1.00 0.00 C ATOM 329 CD PRO A 62 -3.662 -0.251 8.757 1.00 0.00 C ATOM 0 HA PRO A 62 -6.239 -1.628 10.198 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -6.856 0.662 8.755 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -5.916 0.760 10.231 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -4.960 0.764 7.375 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -4.426 1.759 8.715 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -3.007 -0.419 7.902 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -3.031 0.083 9.581 1.00 0.00 H new ATOM 337 N SER A 63 -7.992 -1.550 8.196 1.00 0.00 N ATOM 338 CA SER A 63 -8.904 -2.081 7.190 1.00 0.00 C ATOM 339 C SER A 63 -8.568 -1.529 5.808 1.00 0.00 C ATOM 340 O SER A 63 -7.734 -0.635 5.670 1.00 0.00 O ATOM 341 CB SER A 63 -10.351 -1.738 7.551 1.00 0.00 C ATOM 342 OG SER A 63 -10.519 -0.339 7.708 1.00 0.00 O ATOM 0 H SER A 63 -8.440 -0.974 8.909 1.00 0.00 H new ATOM 0 HA SER A 63 -8.790 -3.165 7.167 1.00 0.00 H new ATOM 0 HB2 SER A 63 -11.020 -2.103 6.772 1.00 0.00 H new ATOM 0 HB3 SER A 63 -10.629 -2.247 8.474 1.00 0.00 H new ATOM 0 HG SER A 63 -11.452 -0.145 7.937 1.00 0.00 H new ATOM 348 N ALA A 64 -9.225 -2.070 4.787 1.00 0.00 N ATOM 349 CA ALA A 64 -8.999 -1.631 3.415 1.00 0.00 C ATOM 350 C ALA A 64 -9.463 -0.192 3.215 1.00 0.00 C ATOM 351 O ALA A 64 -8.810 0.588 2.523 1.00 0.00 O ATOM 352 CB ALA A 64 -9.712 -2.558 2.441 1.00 0.00 C ATOM 0 H ALA A 64 -9.918 -2.813 4.884 1.00 0.00 H new ATOM 0 HA ALA A 64 -7.927 -1.670 3.219 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.535 -2.219 1.420 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.330 -3.572 2.558 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -10.782 -2.548 2.646 1.00 0.00 H new ATOM 358 N GLU A 65 -10.593 0.151 3.825 1.00 0.00 N ATOM 359 CA GLU A 65 -11.143 1.496 3.712 1.00 0.00 C ATOM 360 C GLU A 65 -10.126 2.540 4.161 1.00 0.00 C ATOM 361 O GLU A 65 -9.976 3.587 3.532 1.00 0.00 O ATOM 362 CB GLU A 65 -12.420 1.621 4.545 1.00 0.00 C ATOM 363 CG GLU A 65 -13.113 2.965 4.401 1.00 0.00 C ATOM 364 CD GLU A 65 -14.146 3.209 5.483 1.00 0.00 C ATOM 365 OE1 GLU A 65 -13.887 2.832 6.646 1.00 0.00 O ATOM 366 OE2 GLU A 65 -15.214 3.776 5.169 1.00 0.00 O ATOM 0 H GLU A 65 -11.145 -0.484 4.402 1.00 0.00 H new ATOM 0 HA GLU A 65 -11.383 1.675 2.664 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -13.113 0.832 4.253 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -12.176 1.458 5.595 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -12.367 3.759 4.431 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -13.596 3.018 3.425 1.00 0.00 H new ATOM 373 N GLU A 66 -9.429 2.247 5.255 1.00 0.00 N ATOM 374 CA GLU A 66 -8.427 3.161 5.790 1.00 0.00 C ATOM 375 C GLU A 66 -7.297 3.376 4.788 1.00 0.00 C ATOM 376 O GLU A 66 -6.935 4.512 4.477 1.00 0.00 O ATOM 377 CB GLU A 66 -7.861 2.620 7.105 1.00 0.00 C ATOM 378 CG GLU A 66 -8.817 2.751 8.279 1.00 0.00 C ATOM 379 CD GLU A 66 -9.110 4.195 8.634 1.00 0.00 C ATOM 380 OE1 GLU A 66 -10.059 4.767 8.058 1.00 0.00 O ATOM 381 OE2 GLU A 66 -8.390 4.754 9.488 1.00 0.00 O ATOM 0 H GLU A 66 -9.540 1.384 5.788 1.00 0.00 H new ATOM 0 HA GLU A 66 -8.910 4.120 5.978 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -7.602 1.569 6.974 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.937 3.150 7.339 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -9.751 2.243 8.040 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.392 2.246 9.147 1.00 0.00 H new ATOM 388 N LEU A 67 -6.743 2.278 4.285 1.00 0.00 N ATOM 389 CA LEU A 67 -5.653 2.345 3.318 1.00 0.00 C ATOM 390 C LEU A 67 -6.130 2.948 2.000 1.00 0.00 C ATOM 391 O LEU A 67 -5.332 3.459 1.215 1.00 0.00 O ATOM 392 CB LEU A 67 -5.075 0.950 3.073 1.00 0.00 C ATOM 393 CG LEU A 67 -4.652 0.171 4.319 1.00 0.00 C ATOM 394 CD1 LEU A 67 -4.226 -1.241 3.947 1.00 0.00 C ATOM 395 CD2 LEU A 67 -3.527 0.896 5.044 1.00 0.00 C ATOM 0 H LEU A 67 -7.031 1.331 4.531 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.875 2.987 3.730 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -5.817 0.360 2.535 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.209 1.047 2.418 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.508 0.105 4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -3.928 -1.780 4.846 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -5.059 -1.759 3.472 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.385 -1.197 3.255 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -3.238 0.328 5.928 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.669 0.993 4.379 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.867 1.887 5.345 1.00 0.00 H new ATOM 407 N ARG A 68 -7.437 2.887 1.767 1.00 0.00 N ATOM 408 CA ARG A 68 -8.021 3.428 0.545 1.00 0.00 C ATOM 409 C ARG A 68 -7.769 4.929 0.440 1.00 0.00 C ATOM 410 O ARG A 68 -7.349 5.427 -0.604 1.00 0.00 O ATOM 411 CB ARG A 68 -9.525 3.149 0.507 1.00 0.00 C ATOM 412 CG ARG A 68 -10.183 3.539 -0.807 1.00 0.00 C ATOM 413 CD ARG A 68 -11.566 2.920 -0.942 1.00 0.00 C ATOM 414 NE ARG A 68 -12.559 3.618 -0.129 1.00 0.00 N ATOM 415 CZ ARG A 68 -12.999 4.842 -0.397 1.00 0.00 C ATOM 416 NH1 ARG A 68 -12.535 5.501 -1.450 1.00 0.00 N ATOM 417 NH2 ARG A 68 -13.904 5.410 0.390 1.00 0.00 N ATOM 0 H ARG A 68 -8.111 2.469 2.408 1.00 0.00 H new ATOM 0 HA ARG A 68 -7.545 2.937 -0.304 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -9.694 2.087 0.687 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -10.007 3.691 1.320 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.261 4.624 -0.868 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -9.556 3.217 -1.639 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -11.873 2.942 -1.988 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -11.525 1.872 -0.644 1.00 0.00 H new ATOM 0 HE ARG A 68 -12.935 3.139 0.689 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -11.838 5.068 -2.056 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -12.875 6.441 -1.654 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -14.262 4.906 1.201 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -14.241 6.350 0.183 1.00 0.00 H new ATOM 431 N LYS A 69 -8.028 5.645 1.529 1.00 0.00 N ATOM 432 CA LYS A 69 -7.828 7.089 1.561 1.00 0.00 C ATOM 433 C LYS A 69 -6.357 7.430 1.772 1.00 0.00 C ATOM 434 O LYS A 69 -5.752 8.139 0.966 1.00 0.00 O ATOM 435 CB LYS A 69 -8.672 7.716 2.673 1.00 0.00 C ATOM 436 CG LYS A 69 -10.157 7.767 2.355 1.00 0.00 C ATOM 437 CD LYS A 69 -10.862 6.491 2.782 1.00 0.00 C ATOM 438 CE LYS A 69 -11.286 6.549 4.241 1.00 0.00 C ATOM 439 NZ LYS A 69 -10.224 6.032 5.148 1.00 0.00 N ATOM 0 H LYS A 69 -8.377 5.248 2.402 1.00 0.00 H new ATOM 0 HA LYS A 69 -8.143 7.496 0.600 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -8.525 7.149 3.592 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.315 8.728 2.862 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -10.609 8.620 2.860 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -10.296 7.920 1.285 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -11.738 6.331 2.154 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -10.199 5.639 2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -11.524 7.578 4.510 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -12.196 5.966 4.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -10.657 5.690 6.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -9.721 5.249 4.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -9.551 6.795 5.365 1.00 0.00 H new ATOM 453 N LEU A 70 -5.785 6.920 2.857 1.00 0.00 N ATOM 454 CA LEU A 70 -4.383 7.170 3.172 1.00 0.00 C ATOM 455 C LEU A 70 -3.545 7.255 1.900 1.00 0.00 C ATOM 456 O LEU A 70 -2.582 8.017 1.829 1.00 0.00 O ATOM 457 CB LEU A 70 -3.839 6.066 4.081 1.00 0.00 C ATOM 458 CG LEU A 70 -4.440 5.996 5.485 1.00 0.00 C ATOM 459 CD1 LEU A 70 -4.173 4.637 6.113 1.00 0.00 C ATOM 460 CD2 LEU A 70 -3.881 7.109 6.360 1.00 0.00 C ATOM 0 H LEU A 70 -6.270 6.331 3.533 1.00 0.00 H new ATOM 0 HA LEU A 70 -4.319 8.126 3.692 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -4.001 5.106 3.590 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -2.761 6.199 4.175 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.519 6.130 5.405 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -4.608 4.606 7.112 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.622 3.857 5.497 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.098 4.472 6.180 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -4.320 7.044 7.356 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -2.798 7.006 6.433 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.124 8.076 5.919 1.00 0.00 H new ATOM 472 N MET A 71 -3.922 6.470 0.896 1.00 0.00 N ATOM 473 CA MET A 71 -3.208 6.460 -0.375 1.00 0.00 C ATOM 474 C MET A 71 -3.421 7.768 -1.130 1.00 0.00 C ATOM 475 O MET A 71 -2.491 8.556 -1.300 1.00 0.00 O ATOM 476 CB MET A 71 -3.669 5.281 -1.235 1.00 0.00 C ATOM 477 CG MET A 71 -3.114 3.942 -0.778 1.00 0.00 C ATOM 478 SD MET A 71 -1.361 3.752 -1.155 1.00 0.00 S ATOM 479 CE MET A 71 -0.621 4.517 0.285 1.00 0.00 C ATOM 0 H MET A 71 -4.717 5.833 0.938 1.00 0.00 H new ATOM 0 HA MET A 71 -2.144 6.352 -0.163 1.00 0.00 H new ATOM 0 HB2 MET A 71 -4.758 5.237 -1.223 1.00 0.00 H new ATOM 0 HB3 MET A 71 -3.369 5.456 -2.268 1.00 0.00 H new ATOM 0 HG2 MET A 71 -3.264 3.839 0.297 1.00 0.00 H new ATOM 0 HG3 MET A 71 -3.674 3.139 -1.257 1.00 0.00 H new ATOM 0 HE1 MET A 71 -0.140 5.451 -0.006 1.00 0.00 H new ATOM 0 HE2 MET A 71 -1.394 4.722 1.026 1.00 0.00 H new ATOM 0 HE3 MET A 71 0.122 3.844 0.713 1.00 0.00 H new ATOM 489 N MET A 72 -4.652 7.993 -1.580 1.00 0.00 N ATOM 490 CA MET A 72 -4.986 9.207 -2.315 1.00 0.00 C ATOM 491 C MET A 72 -4.404 10.437 -1.627 1.00 0.00 C ATOM 492 O MET A 72 -3.831 11.312 -2.278 1.00 0.00 O ATOM 493 CB MET A 72 -6.504 9.350 -2.442 1.00 0.00 C ATOM 494 CG MET A 72 -7.172 8.162 -3.114 1.00 0.00 C ATOM 495 SD MET A 72 -8.866 7.906 -2.550 1.00 0.00 S ATOM 496 CE MET A 72 -9.581 9.514 -2.886 1.00 0.00 C ATOM 0 H MET A 72 -5.433 7.351 -1.448 1.00 0.00 H new ATOM 0 HA MET A 72 -4.550 9.130 -3.311 1.00 0.00 H new ATOM 0 HB2 MET A 72 -6.933 9.483 -1.449 1.00 0.00 H new ATOM 0 HB3 MET A 72 -6.729 10.252 -3.010 1.00 0.00 H new ATOM 0 HG2 MET A 72 -7.172 8.313 -4.194 1.00 0.00 H new ATOM 0 HG3 MET A 72 -6.588 7.263 -2.918 1.00 0.00 H new ATOM 0 HE1 MET A 72 -10.667 9.452 -2.811 1.00 0.00 H new ATOM 0 HE2 MET A 72 -9.208 10.237 -2.161 1.00 0.00 H new ATOM 0 HE3 MET A 72 -9.304 9.832 -3.891 1.00 0.00 H new ATOM 506 N LEU A 73 -4.553 10.499 -0.308 1.00 0.00 N ATOM 507 CA LEU A 73 -4.042 11.623 0.469 1.00 0.00 C ATOM 508 C LEU A 73 -2.522 11.704 0.373 1.00 0.00 C ATOM 509 O LEU A 73 -1.941 12.786 0.457 1.00 0.00 O ATOM 510 CB LEU A 73 -4.466 11.491 1.932 1.00 0.00 C ATOM 511 CG LEU A 73 -5.845 12.051 2.285 1.00 0.00 C ATOM 512 CD1 LEU A 73 -6.941 11.137 1.760 1.00 0.00 C ATOM 513 CD2 LEU A 73 -5.976 12.236 3.789 1.00 0.00 C ATOM 0 H LEU A 73 -5.024 9.784 0.246 1.00 0.00 H new ATOM 0 HA LEU A 73 -4.463 12.540 0.057 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -4.445 10.435 2.202 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -3.723 11.993 2.551 1.00 0.00 H new ATOM 0 HG LEU A 73 -5.954 13.026 1.809 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -7.915 11.551 2.020 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -6.859 11.056 0.676 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -6.836 10.148 2.207 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -6.963 12.635 4.022 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -5.847 11.275 4.286 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -5.212 12.931 4.138 1.00 0.00 H new ATOM 525 N HIS A 74 -1.883 10.552 0.194 1.00 0.00 N ATOM 526 CA HIS A 74 -0.430 10.493 0.084 1.00 0.00 C ATOM 527 C HIS A 74 -0.002 10.325 -1.371 1.00 0.00 C ATOM 528 O HIS A 74 1.059 9.770 -1.657 1.00 0.00 O ATOM 529 CB HIS A 74 0.121 9.342 0.926 1.00 0.00 C ATOM 530 CG HIS A 74 0.384 9.715 2.352 1.00 0.00 C ATOM 531 ND1 HIS A 74 1.619 10.125 2.807 1.00 0.00 N ATOM 532 CD2 HIS A 74 -0.439 9.740 3.427 1.00 0.00 C ATOM 533 CE1 HIS A 74 1.545 10.385 4.100 1.00 0.00 C ATOM 534 NE2 HIS A 74 0.307 10.159 4.501 1.00 0.00 N ATOM 0 H HIS A 74 -2.349 9.647 0.122 1.00 0.00 H new ATOM 0 HA HIS A 74 -0.024 11.433 0.458 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -0.586 8.513 0.901 1.00 0.00 H new ATOM 0 HB3 HIS A 74 1.047 8.985 0.476 1.00 0.00 H new ATOM 0 HD1 HIS A 74 2.459 10.214 2.235 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -1.487 9.479 3.438 1.00 0.00 H new ATOM 0 HE1 HIS A 74 2.359 10.725 4.724 1.00 0.00 H new ATOM 542 N GLY A 75 -0.835 10.807 -2.288 1.00 0.00 N ATOM 543 CA GLY A 75 -0.526 10.700 -3.702 1.00 0.00 C ATOM 544 C GLY A 75 -0.426 9.260 -4.166 1.00 0.00 C ATOM 545 O GLY A 75 0.456 8.912 -4.950 1.00 0.00 O ATOM 0 H GLY A 75 -1.719 11.270 -2.077 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.296 11.212 -4.279 1.00 0.00 H new ATOM 0 HA3 GLY A 75 0.416 11.210 -3.905 1.00 0.00 H new ATOM 549 N GLY A 76 -1.334 8.419 -3.678 1.00 0.00 N ATOM 550 CA GLY A 76 -1.325 7.018 -4.057 1.00 0.00 C ATOM 551 C GLY A 76 -2.522 6.640 -4.907 1.00 0.00 C ATOM 552 O GLY A 76 -3.357 7.487 -5.225 1.00 0.00 O ATOM 0 H GLY A 76 -2.074 8.683 -3.028 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -0.409 6.799 -4.606 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.312 6.402 -3.158 1.00 0.00 H new ATOM 556 N GLN A 77 -2.605 5.366 -5.278 1.00 0.00 N ATOM 557 CA GLN A 77 -3.708 4.880 -6.098 1.00 0.00 C ATOM 558 C GLN A 77 -4.371 3.666 -5.456 1.00 0.00 C ATOM 559 O GLN A 77 -3.696 2.803 -4.893 1.00 0.00 O ATOM 560 CB GLN A 77 -3.209 4.521 -7.499 1.00 0.00 C ATOM 561 CG GLN A 77 -2.832 5.731 -8.339 1.00 0.00 C ATOM 562 CD GLN A 77 -2.106 5.353 -9.615 1.00 0.00 C ATOM 563 OE1 GLN A 77 -2.291 4.258 -10.147 1.00 0.00 O ATOM 564 NE2 GLN A 77 -1.272 6.259 -10.113 1.00 0.00 N ATOM 0 H GLN A 77 -1.922 4.653 -5.024 1.00 0.00 H new ATOM 0 HA GLN A 77 -4.448 5.676 -6.175 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -2.342 3.866 -7.410 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -3.983 3.956 -8.018 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -3.734 6.289 -8.590 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.200 6.395 -7.749 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -1.149 7.154 -9.639 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -0.755 6.060 -10.969 1.00 0.00 H new ATOM 573 N TYR A 78 -5.695 3.607 -5.542 1.00 0.00 N ATOM 574 CA TYR A 78 -6.449 2.500 -4.966 1.00 0.00 C ATOM 575 C TYR A 78 -7.261 1.778 -6.038 1.00 0.00 C ATOM 576 O TYR A 78 -7.935 2.409 -6.852 1.00 0.00 O ATOM 577 CB TYR A 78 -7.378 3.008 -3.862 1.00 0.00 C ATOM 578 CG TYR A 78 -8.143 1.909 -3.161 1.00 0.00 C ATOM 579 CD1 TYR A 78 -7.601 1.250 -2.063 1.00 0.00 C ATOM 580 CD2 TYR A 78 -9.406 1.527 -3.595 1.00 0.00 C ATOM 581 CE1 TYR A 78 -8.296 0.245 -1.419 1.00 0.00 C ATOM 582 CE2 TYR A 78 -10.108 0.523 -2.956 1.00 0.00 C ATOM 583 CZ TYR A 78 -9.549 -0.115 -1.869 1.00 0.00 C ATOM 584 OH TYR A 78 -10.245 -1.116 -1.231 1.00 0.00 O ATOM 0 H TYR A 78 -6.268 4.312 -6.005 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.738 1.794 -4.537 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -6.789 3.555 -3.126 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -8.087 3.715 -4.292 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -6.620 1.529 -1.708 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -9.847 2.023 -4.447 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -7.860 -0.256 -0.567 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -11.090 0.239 -3.306 1.00 0.00 H new ATOM 0 HH TYR A 78 -11.110 -1.245 -1.672 1.00 0.00 H new ATOM 594 N HIS A 79 -7.192 0.451 -6.030 1.00 0.00 N ATOM 595 CA HIS A 79 -7.921 -0.358 -6.999 1.00 0.00 C ATOM 596 C HIS A 79 -8.843 -1.351 -6.296 1.00 0.00 C ATOM 597 O HIS A 79 -8.404 -2.124 -5.445 1.00 0.00 O ATOM 598 CB HIS A 79 -6.945 -1.107 -7.907 1.00 0.00 C ATOM 599 CG HIS A 79 -5.957 -0.212 -8.591 1.00 0.00 C ATOM 600 ND1 HIS A 79 -4.695 -0.628 -8.958 1.00 0.00 N ATOM 601 CD2 HIS A 79 -6.052 1.082 -8.975 1.00 0.00 C ATOM 602 CE1 HIS A 79 -4.056 0.373 -9.537 1.00 0.00 C ATOM 603 NE2 HIS A 79 -4.858 1.422 -9.560 1.00 0.00 N ATOM 0 H HIS A 79 -6.639 -0.087 -5.363 1.00 0.00 H new ATOM 0 HA HIS A 79 -8.531 0.311 -7.606 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -6.405 -1.846 -7.315 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -7.510 -1.654 -8.661 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -6.908 1.727 -8.845 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -3.049 0.339 -9.926 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -4.627 2.336 -9.949 1.00 0.00 H new ATOM 611 N VAL A 80 -10.122 -1.321 -6.656 1.00 0.00 N ATOM 612 CA VAL A 80 -11.105 -2.218 -6.060 1.00 0.00 C ATOM 613 C VAL A 80 -10.829 -3.668 -6.443 1.00 0.00 C ATOM 614 O VAL A 80 -10.958 -4.574 -5.618 1.00 0.00 O ATOM 615 CB VAL A 80 -12.536 -1.848 -6.491 1.00 0.00 C ATOM 616 CG1 VAL A 80 -13.545 -2.800 -5.867 1.00 0.00 C ATOM 617 CG2 VAL A 80 -12.849 -0.407 -6.116 1.00 0.00 C ATOM 0 H VAL A 80 -10.502 -0.685 -7.357 1.00 0.00 H new ATOM 0 HA VAL A 80 -11.020 -2.108 -4.979 1.00 0.00 H new ATOM 0 HB VAL A 80 -12.606 -1.942 -7.575 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -14.551 -2.523 -6.183 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -13.331 -3.819 -6.189 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -13.477 -2.741 -4.781 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -13.864 -0.162 -6.428 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -12.762 -0.285 -5.036 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.146 0.260 -6.615 1.00 0.00 H new ATOM 627 N TYR A 81 -10.449 -3.881 -7.697 1.00 0.00 N ATOM 628 CA TYR A 81 -10.157 -5.221 -8.191 1.00 0.00 C ATOM 629 C TYR A 81 -8.654 -5.427 -8.353 1.00 0.00 C ATOM 630 O TYR A 81 -7.903 -4.471 -8.551 1.00 0.00 O ATOM 631 CB TYR A 81 -10.863 -5.461 -9.526 1.00 0.00 C ATOM 632 CG TYR A 81 -12.351 -5.693 -9.391 1.00 0.00 C ATOM 633 CD1 TYR A 81 -13.169 -4.751 -8.779 1.00 0.00 C ATOM 634 CD2 TYR A 81 -12.940 -6.854 -9.877 1.00 0.00 C ATOM 635 CE1 TYR A 81 -14.528 -4.959 -8.653 1.00 0.00 C ATOM 636 CE2 TYR A 81 -14.299 -7.070 -9.757 1.00 0.00 C ATOM 637 CZ TYR A 81 -15.089 -6.120 -9.143 1.00 0.00 C ATOM 638 OH TYR A 81 -16.444 -6.330 -9.021 1.00 0.00 O ATOM 0 H TYR A 81 -10.336 -3.142 -8.391 1.00 0.00 H new ATOM 0 HA TYR A 81 -10.527 -5.939 -7.458 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -10.695 -4.602 -10.176 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -10.412 -6.324 -10.016 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -12.734 -3.840 -8.395 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -12.324 -7.600 -10.357 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -15.149 -4.217 -8.173 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -14.741 -7.977 -10.142 1.00 0.00 H new ATOM 0 HH TYR A 81 -16.678 -7.195 -9.418 1.00 0.00 H new ATOM 648 N TYR A 82 -8.223 -6.680 -8.269 1.00 0.00 N ATOM 649 CA TYR A 82 -6.810 -7.013 -8.405 1.00 0.00 C ATOM 650 C TYR A 82 -6.365 -6.918 -9.861 1.00 0.00 C ATOM 651 O TYR A 82 -6.865 -7.641 -10.723 1.00 0.00 O ATOM 652 CB TYR A 82 -6.541 -8.420 -7.869 1.00 0.00 C ATOM 653 CG TYR A 82 -5.183 -8.964 -8.250 1.00 0.00 C ATOM 654 CD1 TYR A 82 -4.077 -8.128 -8.333 1.00 0.00 C ATOM 655 CD2 TYR A 82 -5.007 -10.314 -8.527 1.00 0.00 C ATOM 656 CE1 TYR A 82 -2.834 -8.621 -8.682 1.00 0.00 C ATOM 657 CE2 TYR A 82 -3.767 -10.816 -8.874 1.00 0.00 C ATOM 658 CZ TYR A 82 -2.684 -9.965 -8.950 1.00 0.00 C ATOM 659 OH TYR A 82 -1.448 -10.461 -9.298 1.00 0.00 O ATOM 0 H TYR A 82 -8.832 -7.482 -8.107 1.00 0.00 H new ATOM 0 HA TYR A 82 -6.236 -6.293 -7.821 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -6.626 -8.408 -6.782 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -7.311 -9.095 -8.242 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -4.190 -7.075 -8.121 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -5.853 -10.982 -8.470 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -1.985 -7.957 -8.744 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -3.647 -11.868 -9.084 1.00 0.00 H new ATOM 0 HH TYR A 82 -1.515 -11.426 -9.453 1.00 0.00 H new ATOM 669 N SER A 83 -5.421 -6.020 -10.128 1.00 0.00 N ATOM 670 CA SER A 83 -4.910 -5.827 -11.480 1.00 0.00 C ATOM 671 C SER A 83 -3.415 -6.123 -11.543 1.00 0.00 C ATOM 672 O SER A 83 -2.675 -5.842 -10.599 1.00 0.00 O ATOM 673 CB SER A 83 -5.179 -4.396 -11.950 1.00 0.00 C ATOM 674 OG SER A 83 -5.372 -4.348 -13.353 1.00 0.00 O ATOM 0 H SER A 83 -4.995 -5.415 -9.426 1.00 0.00 H new ATOM 0 HA SER A 83 -5.428 -6.522 -12.141 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.062 -4.004 -11.445 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.342 -3.755 -11.673 1.00 0.00 H new ATOM 0 HG SER A 83 -5.846 -3.524 -13.590 1.00 0.00 H new ATOM 680 N ARG A 84 -2.977 -6.691 -12.661 1.00 0.00 N ATOM 681 CA ARG A 84 -1.571 -7.027 -12.848 1.00 0.00 C ATOM 682 C ARG A 84 -0.814 -5.864 -13.484 1.00 0.00 C ATOM 683 O ARG A 84 0.414 -5.802 -13.423 1.00 0.00 O ATOM 684 CB ARG A 84 -1.434 -8.276 -13.720 1.00 0.00 C ATOM 685 CG ARG A 84 -2.189 -9.481 -13.182 1.00 0.00 C ATOM 686 CD ARG A 84 -1.658 -10.779 -13.769 1.00 0.00 C ATOM 687 NE ARG A 84 -1.697 -10.775 -15.229 1.00 0.00 N ATOM 688 CZ ARG A 84 -1.491 -11.857 -15.972 1.00 0.00 C ATOM 689 NH1 ARG A 84 -1.234 -13.022 -15.396 1.00 0.00 N ATOM 690 NH2 ARG A 84 -1.542 -11.773 -17.296 1.00 0.00 N ATOM 0 H ARG A 84 -3.576 -6.928 -13.452 1.00 0.00 H new ATOM 0 HA ARG A 84 -1.138 -7.228 -11.868 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.795 -8.050 -14.723 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -0.378 -8.531 -13.812 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -2.103 -9.510 -12.096 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.249 -9.382 -13.416 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -0.633 -10.936 -13.434 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -2.248 -11.615 -13.393 1.00 0.00 H new ATOM 0 HE ARG A 84 -1.893 -9.894 -15.704 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -1.194 -13.090 -14.379 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -1.076 -13.851 -15.969 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -1.739 -10.878 -17.743 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -1.384 -12.604 -17.866 1.00 0.00 H new ATOM 704 N SER A 85 -1.556 -4.946 -14.094 1.00 0.00 N ATOM 705 CA SER A 85 -0.955 -3.787 -14.745 1.00 0.00 C ATOM 706 C SER A 85 -1.099 -2.541 -13.877 1.00 0.00 C ATOM 707 O SER A 85 -0.129 -1.821 -13.637 1.00 0.00 O ATOM 708 CB SER A 85 -1.604 -3.549 -16.110 1.00 0.00 C ATOM 709 OG SER A 85 -1.480 -4.691 -16.940 1.00 0.00 O ATOM 0 H SER A 85 -2.574 -4.982 -14.151 1.00 0.00 H new ATOM 0 HA SER A 85 0.107 -3.990 -14.886 1.00 0.00 H new ATOM 0 HB2 SER A 85 -2.658 -3.305 -15.977 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.136 -2.691 -16.594 1.00 0.00 H new ATOM 0 HG SER A 85 -1.904 -4.514 -17.806 1.00 0.00 H new ATOM 715 N LYS A 86 -2.316 -2.292 -13.408 1.00 0.00 N ATOM 716 CA LYS A 86 -2.590 -1.134 -12.565 1.00 0.00 C ATOM 717 C LYS A 86 -1.890 -1.265 -11.216 1.00 0.00 C ATOM 718 O LYS A 86 -0.913 -0.567 -10.940 1.00 0.00 O ATOM 719 CB LYS A 86 -4.097 -0.974 -12.355 1.00 0.00 C ATOM 720 CG LYS A 86 -4.895 -0.974 -13.648 1.00 0.00 C ATOM 721 CD LYS A 86 -4.719 0.328 -14.411 1.00 0.00 C ATOM 722 CE LYS A 86 -5.443 0.292 -15.749 1.00 0.00 C ATOM 723 NZ LYS A 86 -4.960 1.358 -16.669 1.00 0.00 N ATOM 0 H LYS A 86 -3.130 -2.877 -13.597 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.204 -0.249 -13.071 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -4.454 -1.783 -11.717 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -4.284 -0.042 -11.822 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.577 -1.809 -14.273 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -5.951 -1.126 -13.425 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -5.099 1.156 -13.813 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.658 0.514 -14.575 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -5.298 -0.683 -16.215 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -6.514 0.411 -15.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.477 1.300 -17.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.122 2.290 -16.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.943 1.230 -16.845 1.00 0.00 H new ATOM 737 N THR A 87 -2.393 -2.166 -10.378 1.00 0.00 N ATOM 738 CA THR A 87 -1.815 -2.389 -9.059 1.00 0.00 C ATOM 739 C THR A 87 -0.335 -2.741 -9.158 1.00 0.00 C ATOM 740 O THR A 87 0.058 -3.599 -9.950 1.00 0.00 O ATOM 741 CB THR A 87 -2.550 -3.516 -8.307 1.00 0.00 C ATOM 742 OG1 THR A 87 -3.947 -3.216 -8.218 1.00 0.00 O ATOM 743 CG2 THR A 87 -1.975 -3.699 -6.911 1.00 0.00 C ATOM 0 H THR A 87 -3.200 -2.753 -10.590 1.00 0.00 H new ATOM 0 HA THR A 87 -1.927 -1.458 -8.504 1.00 0.00 H new ATOM 0 HB THR A 87 -2.413 -4.443 -8.863 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.091 -2.268 -8.420 1.00 0.00 H new ATOM 0 HG21 THR A 87 -2.509 -4.500 -6.399 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.918 -3.957 -6.984 1.00 0.00 H new ATOM 0 HG23 THR A 87 -2.085 -2.772 -6.348 1.00 0.00 H new ATOM 751 N THR A 88 0.483 -2.074 -8.350 1.00 0.00 N ATOM 752 CA THR A 88 1.920 -2.316 -8.348 1.00 0.00 C ATOM 753 C THR A 88 2.309 -3.308 -7.257 1.00 0.00 C ATOM 754 O THR A 88 3.278 -4.054 -7.399 1.00 0.00 O ATOM 755 CB THR A 88 2.709 -1.009 -8.142 1.00 0.00 C ATOM 756 OG1 THR A 88 2.169 -0.279 -7.035 1.00 0.00 O ATOM 757 CG2 THR A 88 2.664 -0.147 -9.395 1.00 0.00 C ATOM 0 H THR A 88 0.174 -1.362 -7.688 1.00 0.00 H new ATOM 0 HA THR A 88 2.172 -2.734 -9.323 1.00 0.00 H new ATOM 0 HB THR A 88 3.747 -1.267 -7.934 1.00 0.00 H new ATOM 0 HG1 THR A 88 1.467 -0.810 -6.604 1.00 0.00 H new ATOM 0 HG21 THR A 88 3.228 0.770 -9.226 1.00 0.00 H new ATOM 0 HG22 THR A 88 3.103 -0.694 -10.229 1.00 0.00 H new ATOM 0 HG23 THR A 88 1.629 0.101 -9.629 1.00 0.00 H new ATOM 765 N HIS A 89 1.546 -3.313 -6.169 1.00 0.00 N ATOM 766 CA HIS A 89 1.811 -4.215 -5.054 1.00 0.00 C ATOM 767 C HIS A 89 0.513 -4.818 -4.523 1.00 0.00 C ATOM 768 O HIS A 89 -0.576 -4.321 -4.810 1.00 0.00 O ATOM 769 CB HIS A 89 2.539 -3.474 -3.932 1.00 0.00 C ATOM 770 CG HIS A 89 3.794 -2.791 -4.382 1.00 0.00 C ATOM 771 ND1 HIS A 89 3.794 -1.650 -5.155 1.00 0.00 N ATOM 772 CD2 HIS A 89 5.094 -3.094 -4.160 1.00 0.00 C ATOM 773 CE1 HIS A 89 5.040 -1.281 -5.392 1.00 0.00 C ATOM 774 NE2 HIS A 89 5.849 -2.141 -4.799 1.00 0.00 N ATOM 0 H HIS A 89 0.740 -2.703 -6.036 1.00 0.00 H new ATOM 0 HA HIS A 89 2.446 -5.024 -5.416 1.00 0.00 H new ATOM 0 HB2 HIS A 89 1.866 -2.733 -3.501 1.00 0.00 H new ATOM 0 HB3 HIS A 89 2.784 -4.181 -3.140 1.00 0.00 H new ATOM 0 HD1 HIS A 89 2.962 -1.166 -5.492 1.00 0.00 H new ATOM 0 HD2 HIS A 89 5.468 -3.930 -3.587 1.00 0.00 H new ATOM 0 HE1 HIS A 89 5.345 -0.423 -5.972 1.00 0.00 H new ATOM 782 N ILE A 90 0.638 -5.890 -3.748 1.00 0.00 N ATOM 783 CA ILE A 90 -0.524 -6.559 -3.178 1.00 0.00 C ATOM 784 C ILE A 90 -0.485 -6.524 -1.654 1.00 0.00 C ATOM 785 O ILE A 90 0.239 -7.295 -1.023 1.00 0.00 O ATOM 786 CB ILE A 90 -0.615 -8.024 -3.644 1.00 0.00 C ATOM 787 CG1 ILE A 90 -0.928 -8.088 -5.140 1.00 0.00 C ATOM 788 CG2 ILE A 90 -1.673 -8.770 -2.844 1.00 0.00 C ATOM 789 CD1 ILE A 90 -0.848 -9.484 -5.716 1.00 0.00 C ATOM 0 H ILE A 90 1.532 -6.314 -3.501 1.00 0.00 H new ATOM 0 HA ILE A 90 -1.403 -6.019 -3.530 1.00 0.00 H new ATOM 0 HB ILE A 90 0.348 -8.504 -3.473 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -1.928 -7.690 -5.311 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -0.233 -7.442 -5.676 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.725 -9.804 -3.185 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.411 -8.750 -1.786 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.642 -8.291 -2.987 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -1.082 -9.452 -6.780 1.00 0.00 H new ATOM 0 HD12 ILE A 90 0.159 -9.878 -5.577 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -1.563 -10.129 -5.206 1.00 0.00 H new ATOM 801 N ILE A 91 -1.271 -5.626 -1.068 1.00 0.00 N ATOM 802 CA ILE A 91 -1.328 -5.493 0.382 1.00 0.00 C ATOM 803 C ILE A 91 -2.105 -6.646 1.010 1.00 0.00 C ATOM 804 O ILE A 91 -3.235 -6.934 0.616 1.00 0.00 O ATOM 805 CB ILE A 91 -1.981 -4.162 0.800 1.00 0.00 C ATOM 806 CG1 ILE A 91 -1.181 -2.981 0.246 1.00 0.00 C ATOM 807 CG2 ILE A 91 -2.085 -4.075 2.315 1.00 0.00 C ATOM 808 CD1 ILE A 91 0.152 -2.780 0.932 1.00 0.00 C ATOM 0 H ILE A 91 -1.876 -4.981 -1.575 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.299 -5.513 0.741 1.00 0.00 H new ATOM 0 HB ILE A 91 -2.988 -4.122 0.384 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -1.013 -3.135 -0.820 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.773 -2.072 0.347 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -2.548 -3.129 2.594 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -2.693 -4.900 2.686 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -1.088 -4.134 2.752 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.664 -1.926 0.488 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.010 -2.595 1.994 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.763 -3.674 0.809 1.00 0.00 H new ATOM 820 N ALA A 92 -1.491 -7.301 1.989 1.00 0.00 N ATOM 821 CA ALA A 92 -2.126 -8.420 2.675 1.00 0.00 C ATOM 822 C ALA A 92 -1.340 -8.819 3.919 1.00 0.00 C ATOM 823 O ALA A 92 -0.127 -8.620 3.991 1.00 0.00 O ATOM 824 CB ALA A 92 -2.263 -9.607 1.732 1.00 0.00 C ATOM 0 H ALA A 92 -0.555 -7.076 2.325 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.120 -8.104 2.991 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -2.739 -10.436 2.257 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -2.873 -9.322 0.875 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -1.275 -9.914 1.388 1.00 0.00 H new ATOM 830 N THR A 93 -2.039 -9.383 4.900 1.00 0.00 N ATOM 831 CA THR A 93 -1.407 -9.808 6.142 1.00 0.00 C ATOM 832 C THR A 93 -1.138 -11.308 6.137 1.00 0.00 C ATOM 833 O THR A 93 -0.098 -11.763 6.611 1.00 0.00 O ATOM 834 CB THR A 93 -2.279 -9.458 7.364 1.00 0.00 C ATOM 835 OG1 THR A 93 -3.013 -8.255 7.113 1.00 0.00 O ATOM 836 CG2 THR A 93 -1.421 -9.285 8.608 1.00 0.00 C ATOM 0 H THR A 93 -3.043 -9.556 4.857 1.00 0.00 H new ATOM 0 HA THR A 93 -0.460 -9.273 6.214 1.00 0.00 H new ATOM 0 HB THR A 93 -2.976 -10.279 7.534 1.00 0.00 H new ATOM 0 HG1 THR A 93 -3.030 -7.707 7.925 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.058 -9.038 9.458 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.886 -10.212 8.813 1.00 0.00 H new ATOM 0 HG23 THR A 93 -0.704 -8.480 8.446 1.00 0.00 H new ATOM 844 N ASN A 94 -2.081 -12.072 5.597 1.00 0.00 N ATOM 845 CA ASN A 94 -1.945 -13.523 5.530 1.00 0.00 C ATOM 846 C ASN A 94 -2.683 -14.083 4.318 1.00 0.00 C ATOM 847 O ASN A 94 -3.723 -13.560 3.914 1.00 0.00 O ATOM 848 CB ASN A 94 -2.481 -14.166 6.810 1.00 0.00 C ATOM 849 CG ASN A 94 -2.311 -15.673 6.815 1.00 0.00 C ATOM 850 OD1 ASN A 94 -2.960 -16.384 6.047 1.00 0.00 O ATOM 851 ND2 ASN A 94 -1.437 -16.167 7.683 1.00 0.00 N ATOM 0 H ASN A 94 -2.948 -11.711 5.199 1.00 0.00 H new ATOM 0 HA ASN A 94 -0.886 -13.760 5.429 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -1.964 -13.742 7.671 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -3.537 -13.922 6.921 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -1.281 -17.174 7.733 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -0.921 -15.540 8.300 1.00 0.00 H new ATOM 858 N LEU A 95 -2.140 -15.150 3.743 1.00 0.00 N ATOM 859 CA LEU A 95 -2.746 -15.783 2.577 1.00 0.00 C ATOM 860 C LEU A 95 -2.724 -17.303 2.709 1.00 0.00 C ATOM 861 O LEU A 95 -1.779 -17.891 3.235 1.00 0.00 O ATOM 862 CB LEU A 95 -2.014 -15.360 1.303 1.00 0.00 C ATOM 863 CG LEU A 95 -2.012 -13.862 0.996 1.00 0.00 C ATOM 864 CD1 LEU A 95 -0.918 -13.523 -0.005 1.00 0.00 C ATOM 865 CD2 LEU A 95 -3.372 -13.423 0.472 1.00 0.00 C ATOM 0 H LEU A 95 -1.281 -15.595 4.065 1.00 0.00 H new ATOM 0 HA LEU A 95 -3.784 -15.457 2.517 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -0.980 -15.698 1.373 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -2.464 -15.883 0.459 1.00 0.00 H new ATOM 0 HG LEU A 95 -1.809 -13.322 1.921 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -0.932 -12.453 -0.211 1.00 0.00 H new ATOM 0 HD12 LEU A 95 0.052 -13.800 0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -1.089 -14.073 -0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -3.352 -12.354 0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -3.604 -13.971 -0.441 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.135 -13.629 1.223 1.00 0.00 H new ATOM 877 N PRO A 96 -3.788 -17.955 2.218 1.00 0.00 N ATOM 878 CA PRO A 96 -3.913 -19.415 2.267 1.00 0.00 C ATOM 879 C PRO A 96 -2.931 -20.113 1.332 1.00 0.00 C ATOM 880 O PRO A 96 -2.600 -19.595 0.266 1.00 0.00 O ATOM 881 CB PRO A 96 -5.353 -19.663 1.812 1.00 0.00 C ATOM 882 CG PRO A 96 -5.696 -18.478 0.976 1.00 0.00 C ATOM 883 CD PRO A 96 -4.951 -17.319 1.577 1.00 0.00 C ATOM 0 HA PRO A 96 -3.691 -19.810 3.258 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.434 -20.587 1.240 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -6.027 -19.755 2.664 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.403 -18.635 -0.062 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -6.771 -18.295 0.980 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.647 -16.599 0.817 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -5.563 -16.780 2.300 1.00 0.00 H new ATOM 891 N ASN A 97 -2.468 -21.290 1.739 1.00 0.00 N ATOM 892 CA ASN A 97 -1.523 -22.059 0.937 1.00 0.00 C ATOM 893 C ASN A 97 -1.909 -22.026 -0.538 1.00 0.00 C ATOM 894 O ASN A 97 -1.047 -21.975 -1.415 1.00 0.00 O ATOM 895 CB ASN A 97 -1.465 -23.507 1.428 1.00 0.00 C ATOM 896 CG ASN A 97 -0.311 -24.278 0.817 1.00 0.00 C ATOM 897 OD1 ASN A 97 0.151 -23.961 -0.279 1.00 0.00 O ATOM 898 ND2 ASN A 97 0.160 -25.298 1.525 1.00 0.00 N ATOM 0 H ASN A 97 -2.732 -21.732 2.619 1.00 0.00 H new ATOM 0 HA ASN A 97 -0.538 -21.605 1.047 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -1.370 -23.516 2.514 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -2.402 -24.008 1.186 1.00 0.00 H new ATOM 0 HD21 ASN A 97 0.935 -25.854 1.165 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -0.254 -25.525 2.429 1.00 0.00 H new ATOM 905 N ALA A 98 -3.211 -22.054 -0.805 1.00 0.00 N ATOM 906 CA ALA A 98 -3.712 -22.025 -2.173 1.00 0.00 C ATOM 907 C ALA A 98 -3.375 -20.702 -2.853 1.00 0.00 C ATOM 908 O ALA A 98 -2.749 -20.678 -3.913 1.00 0.00 O ATOM 909 CB ALA A 98 -5.215 -22.261 -2.190 1.00 0.00 C ATOM 0 H ALA A 98 -3.938 -22.097 -0.091 1.00 0.00 H new ATOM 0 HA ALA A 98 -3.223 -22.825 -2.730 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -5.576 -22.237 -3.218 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -5.435 -23.234 -1.751 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -5.712 -21.482 -1.613 1.00 0.00 H new ATOM 915 N LYS A 99 -3.794 -19.602 -2.237 1.00 0.00 N ATOM 916 CA LYS A 99 -3.537 -18.274 -2.781 1.00 0.00 C ATOM 917 C LYS A 99 -2.053 -18.089 -3.085 1.00 0.00 C ATOM 918 O LYS A 99 -1.687 -17.584 -4.147 1.00 0.00 O ATOM 919 CB LYS A 99 -4.004 -17.198 -1.798 1.00 0.00 C ATOM 920 CG LYS A 99 -5.464 -16.814 -1.966 1.00 0.00 C ATOM 921 CD LYS A 99 -5.687 -16.012 -3.238 1.00 0.00 C ATOM 922 CE LYS A 99 -7.093 -16.213 -3.784 1.00 0.00 C ATOM 923 NZ LYS A 99 -7.343 -17.630 -4.164 1.00 0.00 N ATOM 0 H LYS A 99 -4.314 -19.604 -1.359 1.00 0.00 H new ATOM 0 HA LYS A 99 -4.097 -18.175 -3.711 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -3.845 -17.554 -0.780 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.386 -16.309 -1.925 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.078 -17.715 -1.990 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.789 -16.230 -1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.522 -14.954 -3.036 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.957 -16.311 -3.990 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -7.821 -15.904 -3.034 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.240 -15.572 -4.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -8.299 -17.719 -4.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -6.643 -17.928 -4.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -7.261 -18.235 -3.322 1.00 0.00 H new ATOM 937 N ILE A 100 -1.206 -18.502 -2.149 1.00 0.00 N ATOM 938 CA ILE A 100 0.237 -18.384 -2.320 1.00 0.00 C ATOM 939 C ILE A 100 0.688 -19.009 -3.636 1.00 0.00 C ATOM 940 O ILE A 100 1.800 -18.764 -4.104 1.00 0.00 O ATOM 941 CB ILE A 100 0.998 -19.052 -1.159 1.00 0.00 C ATOM 942 CG1 ILE A 100 0.704 -18.328 0.156 1.00 0.00 C ATOM 943 CG2 ILE A 100 2.492 -19.062 -1.442 1.00 0.00 C ATOM 944 CD1 ILE A 100 1.152 -19.093 1.381 1.00 0.00 C ATOM 0 H ILE A 100 -1.493 -18.921 -1.265 1.00 0.00 H new ATOM 0 HA ILE A 100 0.468 -17.319 -2.329 1.00 0.00 H new ATOM 0 HB ILE A 100 0.658 -20.084 -1.067 1.00 0.00 H new ATOM 0 HG12 ILE A 100 1.197 -17.356 0.144 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -0.367 -18.141 0.226 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.016 -19.537 -0.613 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.685 -19.618 -2.359 1.00 0.00 H new ATOM 0 HG23 ILE A 100 2.847 -18.038 -1.557 1.00 0.00 H new ATOM 0 HD11 ILE A 100 0.911 -18.520 2.276 1.00 0.00 H new ATOM 0 HD12 ILE A 100 0.639 -20.054 1.417 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.229 -19.257 1.334 1.00 0.00 H new ATOM 956 N LYS A 101 -0.183 -19.818 -4.229 1.00 0.00 N ATOM 957 CA LYS A 101 0.123 -20.478 -5.493 1.00 0.00 C ATOM 958 C LYS A 101 -0.283 -19.603 -6.675 1.00 0.00 C ATOM 959 O LYS A 101 0.299 -19.696 -7.755 1.00 0.00 O ATOM 960 CB LYS A 101 -0.593 -21.828 -5.574 1.00 0.00 C ATOM 961 CG LYS A 101 0.090 -22.825 -6.494 1.00 0.00 C ATOM 962 CD LYS A 101 -0.867 -23.917 -6.942 1.00 0.00 C ATOM 963 CE LYS A 101 -0.274 -24.748 -8.070 1.00 0.00 C ATOM 964 NZ LYS A 101 -0.610 -24.187 -9.408 1.00 0.00 N ATOM 0 H LYS A 101 -1.107 -20.033 -3.854 1.00 0.00 H new ATOM 0 HA LYS A 101 1.200 -20.642 -5.538 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -0.659 -22.256 -4.573 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -1.614 -21.668 -5.920 1.00 0.00 H new ATOM 0 HG2 LYS A 101 0.484 -22.305 -7.367 1.00 0.00 H new ATOM 0 HG3 LYS A 101 0.940 -23.273 -5.979 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -1.104 -24.564 -6.097 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -1.804 -23.468 -7.272 1.00 0.00 H new ATOM 0 HE2 LYS A 101 0.809 -24.793 -7.957 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -0.645 -25.771 -8.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -0.188 -24.781 -10.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.643 -24.167 -9.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -0.234 -23.220 -9.483 1.00 0.00 H new ATOM 978 N GLU A 102 -1.284 -18.755 -6.462 1.00 0.00 N ATOM 979 CA GLU A 102 -1.766 -17.864 -7.510 1.00 0.00 C ATOM 980 C GLU A 102 -0.970 -16.562 -7.527 1.00 0.00 C ATOM 981 O GLU A 102 -1.044 -15.788 -8.482 1.00 0.00 O ATOM 982 CB GLU A 102 -3.253 -17.562 -7.311 1.00 0.00 C ATOM 983 CG GLU A 102 -3.515 -16.334 -6.456 1.00 0.00 C ATOM 984 CD GLU A 102 -4.992 -16.005 -6.345 1.00 0.00 C ATOM 985 OE1 GLU A 102 -5.810 -16.948 -6.330 1.00 0.00 O ATOM 986 OE2 GLU A 102 -5.328 -14.804 -6.272 1.00 0.00 O ATOM 0 H GLU A 102 -1.777 -18.666 -5.573 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.630 -18.366 -8.468 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -3.720 -17.422 -8.286 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -3.732 -18.425 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -3.107 -16.496 -5.458 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.987 -15.480 -6.881 1.00 0.00 H new ATOM 993 N LEU A 103 -0.208 -16.328 -6.464 1.00 0.00 N ATOM 994 CA LEU A 103 0.602 -15.120 -6.355 1.00 0.00 C ATOM 995 C LEU A 103 2.088 -15.463 -6.320 1.00 0.00 C ATOM 996 O LEU A 103 2.862 -14.846 -5.588 1.00 0.00 O ATOM 997 CB LEU A 103 0.218 -14.336 -5.098 1.00 0.00 C ATOM 998 CG LEU A 103 -1.278 -14.110 -4.880 1.00 0.00 C ATOM 999 CD1 LEU A 103 -1.567 -13.836 -3.412 1.00 0.00 C ATOM 1000 CD2 LEU A 103 -1.776 -12.962 -5.747 1.00 0.00 C ATOM 0 H LEU A 103 -0.134 -16.959 -5.666 1.00 0.00 H new ATOM 0 HA LEU A 103 0.411 -14.503 -7.233 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.616 -14.862 -4.230 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.710 -13.364 -5.135 1.00 0.00 H new ATOM 0 HG LEU A 103 -1.810 -15.016 -5.171 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.637 -13.677 -3.275 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.247 -14.688 -2.813 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -1.025 -12.945 -3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.843 -12.815 -5.579 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.239 -12.050 -5.487 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.603 -13.198 -6.797 1.00 0.00 H new ATOM 1012 N LYS A 104 2.481 -16.449 -7.119 1.00 0.00 N ATOM 1013 CA LYS A 104 3.875 -16.873 -7.183 1.00 0.00 C ATOM 1014 C LYS A 104 4.680 -15.957 -8.100 1.00 0.00 C ATOM 1015 O LYS A 104 4.765 -16.188 -9.305 1.00 0.00 O ATOM 1016 CB LYS A 104 3.968 -18.318 -7.678 1.00 0.00 C ATOM 1017 CG LYS A 104 5.319 -18.963 -7.422 1.00 0.00 C ATOM 1018 CD LYS A 104 5.391 -20.360 -8.016 1.00 0.00 C ATOM 1019 CE LYS A 104 6.364 -21.242 -7.248 1.00 0.00 C ATOM 1020 NZ LYS A 104 5.695 -21.961 -6.128 1.00 0.00 N ATOM 0 H LYS A 104 1.854 -16.970 -7.732 1.00 0.00 H new ATOM 0 HA LYS A 104 4.294 -16.812 -6.179 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.194 -18.911 -7.191 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.761 -18.341 -8.748 1.00 0.00 H new ATOM 0 HG2 LYS A 104 6.106 -18.343 -7.851 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.502 -19.013 -6.349 1.00 0.00 H new ATOM 0 HD2 LYS A 104 4.400 -20.813 -8.004 1.00 0.00 H new ATOM 0 HD3 LYS A 104 5.700 -20.298 -9.059 1.00 0.00 H new ATOM 0 HE2 LYS A 104 6.812 -21.966 -7.928 1.00 0.00 H new ATOM 0 HE3 LYS A 104 7.175 -20.630 -6.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 6.391 -22.551 -5.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 5.289 -21.270 -5.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.937 -22.565 -6.506 1.00 0.00 H new ATOM 1034 N GLY A 105 5.272 -14.917 -7.519 1.00 0.00 N ATOM 1035 CA GLY A 105 6.063 -13.984 -8.299 1.00 0.00 C ATOM 1036 C GLY A 105 5.836 -12.544 -7.885 1.00 0.00 C ATOM 1037 O GLY A 105 6.784 -11.769 -7.766 1.00 0.00 O ATOM 0 H GLY A 105 5.218 -14.705 -6.523 1.00 0.00 H new ATOM 0 HA2 GLY A 105 7.120 -14.228 -8.189 1.00 0.00 H new ATOM 0 HA3 GLY A 105 5.817 -14.098 -9.355 1.00 0.00 H new ATOM 1041 N GLU A 106 4.575 -12.184 -7.666 1.00 0.00 N ATOM 1042 CA GLU A 106 4.226 -10.826 -7.265 1.00 0.00 C ATOM 1043 C GLU A 106 4.830 -10.489 -5.905 1.00 0.00 C ATOM 1044 O GLU A 106 5.411 -11.347 -5.240 1.00 0.00 O ATOM 1045 CB GLU A 106 2.706 -10.659 -7.217 1.00 0.00 C ATOM 1046 CG GLU A 106 2.018 -10.966 -8.536 1.00 0.00 C ATOM 1047 CD GLU A 106 2.346 -9.952 -9.615 1.00 0.00 C ATOM 1048 OE1 GLU A 106 1.822 -8.821 -9.546 1.00 0.00 O ATOM 1049 OE2 GLU A 106 3.129 -10.291 -10.528 1.00 0.00 O ATOM 0 H GLU A 106 3.778 -12.814 -7.760 1.00 0.00 H new ATOM 0 HA GLU A 106 4.636 -10.139 -8.005 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.301 -11.313 -6.445 1.00 0.00 H new ATOM 0 HB3 GLU A 106 2.470 -9.636 -6.924 1.00 0.00 H new ATOM 0 HG2 GLU A 106 2.315 -11.959 -8.874 1.00 0.00 H new ATOM 0 HG3 GLU A 106 0.939 -10.991 -8.382 1.00 0.00 H new ATOM 1056 N LYS A 107 4.688 -9.232 -5.497 1.00 0.00 N ATOM 1057 CA LYS A 107 5.218 -8.779 -4.216 1.00 0.00 C ATOM 1058 C LYS A 107 4.088 -8.417 -3.258 1.00 0.00 C ATOM 1059 O LYS A 107 3.437 -7.384 -3.411 1.00 0.00 O ATOM 1060 CB LYS A 107 6.135 -7.570 -4.419 1.00 0.00 C ATOM 1061 CG LYS A 107 7.429 -7.903 -5.140 1.00 0.00 C ATOM 1062 CD LYS A 107 8.455 -6.793 -4.986 1.00 0.00 C ATOM 1063 CE LYS A 107 8.135 -5.610 -5.887 1.00 0.00 C ATOM 1064 NZ LYS A 107 7.238 -4.629 -5.216 1.00 0.00 N ATOM 0 H LYS A 107 4.210 -8.509 -6.035 1.00 0.00 H new ATOM 0 HA LYS A 107 5.794 -9.595 -3.780 1.00 0.00 H new ATOM 0 HB2 LYS A 107 5.599 -6.809 -4.986 1.00 0.00 H new ATOM 0 HB3 LYS A 107 6.371 -7.137 -3.447 1.00 0.00 H new ATOM 0 HG2 LYS A 107 7.837 -8.834 -4.746 1.00 0.00 H new ATOM 0 HG3 LYS A 107 7.225 -8.067 -6.198 1.00 0.00 H new ATOM 0 HD2 LYS A 107 8.483 -6.464 -3.947 1.00 0.00 H new ATOM 0 HD3 LYS A 107 9.447 -7.177 -5.226 1.00 0.00 H new ATOM 0 HE2 LYS A 107 9.061 -5.115 -6.179 1.00 0.00 H new ATOM 0 HE3 LYS A 107 7.663 -5.968 -6.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 7.478 -3.667 -5.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 6.249 -4.837 -5.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 7.359 -4.697 -4.185 1.00 0.00 H new ATOM 1078 N VAL A 108 3.861 -9.275 -2.268 1.00 0.00 N ATOM 1079 CA VAL A 108 2.811 -9.045 -1.282 1.00 0.00 C ATOM 1080 C VAL A 108 3.379 -8.433 -0.007 1.00 0.00 C ATOM 1081 O VAL A 108 3.995 -9.125 0.805 1.00 0.00 O ATOM 1082 CB VAL A 108 2.077 -10.352 -0.929 1.00 0.00 C ATOM 1083 CG1 VAL A 108 1.005 -10.095 0.119 1.00 0.00 C ATOM 1084 CG2 VAL A 108 1.474 -10.979 -2.177 1.00 0.00 C ATOM 0 H VAL A 108 4.390 -10.136 -2.127 1.00 0.00 H new ATOM 0 HA VAL A 108 2.102 -8.349 -1.731 1.00 0.00 H new ATOM 0 HB VAL A 108 2.800 -11.053 -0.512 1.00 0.00 H new ATOM 0 HG11 VAL A 108 0.497 -11.030 0.356 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.467 -9.694 1.021 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.282 -9.377 -0.268 1.00 0.00 H new ATOM 0 HG21 VAL A 108 0.959 -11.902 -1.908 1.00 0.00 H new ATOM 0 HG22 VAL A 108 0.764 -10.285 -2.626 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.266 -11.201 -2.892 1.00 0.00 H new ATOM 1094 N ILE A 109 3.169 -7.132 0.163 1.00 0.00 N ATOM 1095 CA ILE A 109 3.659 -6.427 1.341 1.00 0.00 C ATOM 1096 C ILE A 109 2.561 -6.277 2.388 1.00 0.00 C ATOM 1097 O ILE A 109 1.394 -6.070 2.054 1.00 0.00 O ATOM 1098 CB ILE A 109 4.201 -5.032 0.978 1.00 0.00 C ATOM 1099 CG1 ILE A 109 5.048 -5.106 -0.294 1.00 0.00 C ATOM 1100 CG2 ILE A 109 5.014 -4.463 2.130 1.00 0.00 C ATOM 1101 CD1 ILE A 109 6.284 -5.966 -0.148 1.00 0.00 C ATOM 0 H ILE A 109 2.663 -6.545 -0.500 1.00 0.00 H new ATOM 0 HA ILE A 109 4.471 -7.027 1.753 1.00 0.00 H new ATOM 0 HB ILE A 109 3.357 -4.367 0.792 1.00 0.00 H new ATOM 0 HG12 ILE A 109 4.436 -5.499 -1.106 1.00 0.00 H new ATOM 0 HG13 ILE A 109 5.348 -4.098 -0.580 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.390 -3.477 1.858 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.382 -4.379 3.014 1.00 0.00 H new ATOM 0 HG23 ILE A 109 5.853 -5.125 2.345 1.00 0.00 H new ATOM 0 HD11 ILE A 109 6.836 -5.972 -1.088 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.917 -5.562 0.642 1.00 0.00 H new ATOM 0 HD13 ILE A 109 5.991 -6.984 0.108 1.00 0.00 H new ATOM 1113 N ARG A 110 2.942 -6.380 3.657 1.00 0.00 N ATOM 1114 CA ARG A 110 1.990 -6.255 4.754 1.00 0.00 C ATOM 1115 C ARG A 110 1.428 -4.838 4.827 1.00 0.00 C ATOM 1116 O ARG A 110 2.056 -3.871 4.394 1.00 0.00 O ATOM 1117 CB ARG A 110 2.658 -6.619 6.081 1.00 0.00 C ATOM 1118 CG ARG A 110 3.044 -8.085 6.187 1.00 0.00 C ATOM 1119 CD ARG A 110 4.368 -8.364 5.493 1.00 0.00 C ATOM 1120 NE ARG A 110 5.031 -9.548 6.034 1.00 0.00 N ATOM 1121 CZ ARG A 110 5.744 -9.544 7.155 1.00 0.00 C ATOM 1122 NH1 ARG A 110 5.885 -8.424 7.850 1.00 0.00 N ATOM 1123 NH2 ARG A 110 6.316 -10.662 7.582 1.00 0.00 N ATOM 0 H ARG A 110 3.904 -6.550 3.951 1.00 0.00 H new ATOM 0 HA ARG A 110 1.167 -6.945 4.568 1.00 0.00 H new ATOM 0 HB2 ARG A 110 3.551 -6.007 6.208 1.00 0.00 H new ATOM 0 HB3 ARG A 110 1.982 -6.370 6.899 1.00 0.00 H new ATOM 0 HG2 ARG A 110 3.116 -8.369 7.237 1.00 0.00 H new ATOM 0 HG3 ARG A 110 2.262 -8.701 5.743 1.00 0.00 H new ATOM 0 HD2 ARG A 110 4.196 -8.501 4.425 1.00 0.00 H new ATOM 0 HD3 ARG A 110 5.023 -7.500 5.602 1.00 0.00 H new ATOM 0 HE ARG A 110 4.942 -10.426 5.523 1.00 0.00 H new ATOM 0 HH11 ARG A 110 5.446 -7.563 7.524 1.00 0.00 H new ATOM 0 HH12 ARG A 110 6.433 -8.423 8.710 1.00 0.00 H new ATOM 0 HH21 ARG A 110 6.209 -11.525 7.050 1.00 0.00 H new ATOM 0 HH22 ARG A 110 6.863 -10.658 8.443 1.00 0.00 H new ATOM 1137 N PRO A 111 0.216 -4.710 5.387 1.00 0.00 N ATOM 1138 CA PRO A 111 -0.457 -3.416 5.530 1.00 0.00 C ATOM 1139 C PRO A 111 0.222 -2.520 6.560 1.00 0.00 C ATOM 1140 O PRO A 111 -0.238 -1.410 6.829 1.00 0.00 O ATOM 1141 CB PRO A 111 -1.864 -3.797 5.998 1.00 0.00 C ATOM 1142 CG PRO A 111 -1.696 -5.119 6.665 1.00 0.00 C ATOM 1143 CD PRO A 111 -0.590 -5.819 5.925 1.00 0.00 C ATOM 0 HA PRO A 111 -0.442 -2.845 4.602 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -2.267 -3.054 6.687 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -2.556 -3.862 5.159 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -1.444 -4.995 7.718 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -2.619 -5.697 6.624 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -0.005 -6.457 6.587 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -0.979 -6.456 5.130 1.00 0.00 H new ATOM 1151 N GLU A 112 1.318 -3.008 7.133 1.00 0.00 N ATOM 1152 CA GLU A 112 2.059 -2.250 8.134 1.00 0.00 C ATOM 1153 C GLU A 112 3.157 -1.416 7.481 1.00 0.00 C ATOM 1154 O GLU A 112 3.629 -0.434 8.055 1.00 0.00 O ATOM 1155 CB GLU A 112 2.669 -3.194 9.172 1.00 0.00 C ATOM 1156 CG GLU A 112 1.754 -3.476 10.351 1.00 0.00 C ATOM 1157 CD GLU A 112 1.114 -2.218 10.906 1.00 0.00 C ATOM 1158 OE1 GLU A 112 1.767 -1.526 11.715 1.00 0.00 O ATOM 1159 OE2 GLU A 112 -0.041 -1.926 10.531 1.00 0.00 O ATOM 0 H GLU A 112 1.712 -3.925 6.921 1.00 0.00 H new ATOM 0 HA GLU A 112 1.362 -1.576 8.632 1.00 0.00 H new ATOM 0 HB2 GLU A 112 2.924 -4.137 8.688 1.00 0.00 H new ATOM 0 HB3 GLU A 112 3.600 -2.763 9.540 1.00 0.00 H new ATOM 0 HG2 GLU A 112 0.973 -4.171 10.042 1.00 0.00 H new ATOM 0 HG3 GLU A 112 2.324 -3.967 11.139 1.00 0.00 H new ATOM 1166 N TRP A 113 3.558 -1.813 6.279 1.00 0.00 N ATOM 1167 CA TRP A 113 4.601 -1.103 5.548 1.00 0.00 C ATOM 1168 C TRP A 113 4.163 0.320 5.219 1.00 0.00 C ATOM 1169 O TRP A 113 4.979 1.242 5.200 1.00 0.00 O ATOM 1170 CB TRP A 113 4.952 -1.852 4.261 1.00 0.00 C ATOM 1171 CG TRP A 113 5.716 -1.019 3.278 1.00 0.00 C ATOM 1172 CD1 TRP A 113 6.922 -0.410 3.482 1.00 0.00 C ATOM 1173 CD2 TRP A 113 5.325 -0.700 1.938 1.00 0.00 C ATOM 1174 NE1 TRP A 113 7.304 0.267 2.349 1.00 0.00 N ATOM 1175 CE2 TRP A 113 6.342 0.104 1.387 1.00 0.00 C ATOM 1176 CE3 TRP A 113 4.217 -1.018 1.149 1.00 0.00 C ATOM 1177 CZ2 TRP A 113 6.280 0.594 0.085 1.00 0.00 C ATOM 1178 CZ3 TRP A 113 4.157 -0.531 -0.143 1.00 0.00 C ATOM 1179 CH2 TRP A 113 5.184 0.267 -0.665 1.00 0.00 C ATOM 0 H TRP A 113 3.177 -2.623 5.790 1.00 0.00 H new ATOM 0 HA TRP A 113 5.485 -1.054 6.184 1.00 0.00 H new ATOM 0 HB2 TRP A 113 5.540 -2.735 4.512 1.00 0.00 H new ATOM 0 HB3 TRP A 113 4.033 -2.203 3.792 1.00 0.00 H new ATOM 0 HD1 TRP A 113 7.491 -0.454 4.399 1.00 0.00 H new ATOM 0 HE1 TRP A 113 8.164 0.804 2.241 1.00 0.00 H new ATOM 0 HE3 TRP A 113 3.421 -1.634 1.542 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 7.070 1.211 -0.318 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 3.304 -0.770 -0.761 1.00 0.00 H new ATOM 0 HH2 TRP A 113 5.109 0.631 -1.679 1.00 0.00 H new ATOM 1190 N ILE A 114 2.871 0.491 4.961 1.00 0.00 N ATOM 1191 CA ILE A 114 2.325 1.803 4.635 1.00 0.00 C ATOM 1192 C ILE A 114 2.001 2.594 5.897 1.00 0.00 C ATOM 1193 O ILE A 114 2.427 3.739 6.053 1.00 0.00 O ATOM 1194 CB ILE A 114 1.052 1.685 3.776 1.00 0.00 C ATOM 1195 CG1 ILE A 114 1.371 1.007 2.442 1.00 0.00 C ATOM 1196 CG2 ILE A 114 0.440 3.059 3.545 1.00 0.00 C ATOM 1197 CD1 ILE A 114 0.146 0.709 1.607 1.00 0.00 C ATOM 0 H ILE A 114 2.183 -0.262 4.971 1.00 0.00 H new ATOM 0 HA ILE A 114 3.091 2.330 4.066 1.00 0.00 H new ATOM 0 HB ILE A 114 0.327 1.071 4.310 1.00 0.00 H new ATOM 0 HG12 ILE A 114 2.043 1.647 1.870 1.00 0.00 H new ATOM 0 HG13 ILE A 114 1.904 0.076 2.635 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -0.459 2.959 2.936 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.181 3.508 4.504 1.00 0.00 H new ATOM 0 HG23 ILE A 114 1.159 3.695 3.029 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.448 0.229 0.676 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.518 0.044 2.159 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.376 1.639 1.383 1.00 0.00 H new ATOM 1209 N VAL A 115 1.246 1.975 6.799 1.00 0.00 N ATOM 1210 CA VAL A 115 0.867 2.620 8.051 1.00 0.00 C ATOM 1211 C VAL A 115 2.078 3.241 8.738 1.00 0.00 C ATOM 1212 O VAL A 115 2.076 4.426 9.069 1.00 0.00 O ATOM 1213 CB VAL A 115 0.199 1.623 9.016 1.00 0.00 C ATOM 1214 CG1 VAL A 115 -0.186 2.313 10.316 1.00 0.00 C ATOM 1215 CG2 VAL A 115 -1.017 0.983 8.363 1.00 0.00 C ATOM 0 H VAL A 115 0.885 1.028 6.686 1.00 0.00 H new ATOM 0 HA VAL A 115 0.154 3.405 7.799 1.00 0.00 H new ATOM 0 HB VAL A 115 0.915 0.835 9.249 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -0.657 1.592 10.985 1.00 0.00 H new ATOM 0 HG12 VAL A 115 0.707 2.719 10.791 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -0.885 3.122 10.105 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -1.477 0.281 9.059 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -1.738 1.757 8.099 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -0.709 0.452 7.463 1.00 0.00 H new ATOM 1225 N GLU A 116 3.112 2.431 8.949 1.00 0.00 N ATOM 1226 CA GLU A 116 4.330 2.902 9.597 1.00 0.00 C ATOM 1227 C GLU A 116 4.959 4.046 8.807 1.00 0.00 C ATOM 1228 O GLU A 116 5.321 5.079 9.371 1.00 0.00 O ATOM 1229 CB GLU A 116 5.333 1.756 9.743 1.00 0.00 C ATOM 1230 CG GLU A 116 5.003 0.798 10.875 1.00 0.00 C ATOM 1231 CD GLU A 116 5.616 1.221 12.195 1.00 0.00 C ATOM 1232 OE1 GLU A 116 6.676 1.882 12.171 1.00 0.00 O ATOM 1233 OE2 GLU A 116 5.038 0.893 13.252 1.00 0.00 O ATOM 0 H GLU A 116 3.130 1.447 8.681 1.00 0.00 H new ATOM 0 HA GLU A 116 4.064 3.271 10.588 1.00 0.00 H new ATOM 0 HB2 GLU A 116 5.374 1.199 8.807 1.00 0.00 H new ATOM 0 HB3 GLU A 116 6.326 2.173 9.909 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.921 0.732 10.986 1.00 0.00 H new ATOM 0 HG3 GLU A 116 5.358 -0.200 10.617 1.00 0.00 H new ATOM 1240 N SER A 117 5.088 3.853 7.498 1.00 0.00 N ATOM 1241 CA SER A 117 5.677 4.866 6.631 1.00 0.00 C ATOM 1242 C SER A 117 4.949 6.199 6.778 1.00 0.00 C ATOM 1243 O SER A 117 5.570 7.262 6.764 1.00 0.00 O ATOM 1244 CB SER A 117 5.633 4.406 5.172 1.00 0.00 C ATOM 1245 OG SER A 117 6.602 3.402 4.924 1.00 0.00 O ATOM 0 H SER A 117 4.792 3.005 7.015 1.00 0.00 H new ATOM 0 HA SER A 117 6.716 5.005 6.930 1.00 0.00 H new ATOM 0 HB2 SER A 117 4.640 4.023 4.938 1.00 0.00 H new ATOM 0 HB3 SER A 117 5.810 5.257 4.514 1.00 0.00 H new ATOM 0 HG SER A 117 6.178 2.520 4.970 1.00 0.00 H new ATOM 1251 N ILE A 118 3.630 6.132 6.919 1.00 0.00 N ATOM 1252 CA ILE A 118 2.817 7.332 7.071 1.00 0.00 C ATOM 1253 C ILE A 118 3.042 7.980 8.433 1.00 0.00 C ATOM 1254 O ILE A 118 3.347 9.170 8.524 1.00 0.00 O ATOM 1255 CB ILE A 118 1.318 7.022 6.904 1.00 0.00 C ATOM 1256 CG1 ILE A 118 1.039 6.487 5.498 1.00 0.00 C ATOM 1257 CG2 ILE A 118 0.485 8.265 7.178 1.00 0.00 C ATOM 1258 CD1 ILE A 118 -0.332 5.864 5.349 1.00 0.00 C ATOM 0 H ILE A 118 3.101 5.260 6.931 1.00 0.00 H new ATOM 0 HA ILE A 118 3.126 8.023 6.287 1.00 0.00 H new ATOM 0 HB ILE A 118 1.039 6.255 7.627 1.00 0.00 H new ATOM 0 HG12 ILE A 118 1.138 7.302 4.781 1.00 0.00 H new ATOM 0 HG13 ILE A 118 1.796 5.745 5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -0.572 8.029 7.056 1.00 0.00 H new ATOM 0 HG22 ILE A 118 0.665 8.606 8.197 1.00 0.00 H new ATOM 0 HG23 ILE A 118 0.764 9.052 6.477 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -0.460 5.507 4.327 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -0.429 5.027 6.041 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -1.096 6.609 5.571 1.00 0.00 H new ATOM 1270 N LYS A 119 2.891 7.190 9.490 1.00 0.00 N ATOM 1271 CA LYS A 119 3.080 7.684 10.849 1.00 0.00 C ATOM 1272 C LYS A 119 4.422 8.397 10.986 1.00 0.00 C ATOM 1273 O LYS A 119 4.542 9.377 11.721 1.00 0.00 O ATOM 1274 CB LYS A 119 2.999 6.530 11.849 1.00 0.00 C ATOM 1275 CG LYS A 119 1.583 6.213 12.299 1.00 0.00 C ATOM 1276 CD LYS A 119 1.488 4.823 12.905 1.00 0.00 C ATOM 1277 CE LYS A 119 0.083 4.530 13.410 1.00 0.00 C ATOM 1278 NZ LYS A 119 -0.180 3.067 13.501 1.00 0.00 N ATOM 0 H LYS A 119 2.638 6.204 9.432 1.00 0.00 H new ATOM 0 HA LYS A 119 2.285 8.398 11.064 1.00 0.00 H new ATOM 0 HB2 LYS A 119 3.436 5.639 11.399 1.00 0.00 H new ATOM 0 HB3 LYS A 119 3.603 6.775 12.723 1.00 0.00 H new ATOM 0 HG2 LYS A 119 1.259 6.953 13.031 1.00 0.00 H new ATOM 0 HG3 LYS A 119 0.905 6.287 11.449 1.00 0.00 H new ATOM 0 HD2 LYS A 119 1.770 4.080 12.159 1.00 0.00 H new ATOM 0 HD3 LYS A 119 2.197 4.734 13.728 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -0.052 4.985 14.391 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -0.646 4.989 12.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -1.130 2.862 13.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 0.528 2.551 12.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -0.122 2.765 14.494 1.00 0.00 H new ATOM 1292 N ALA A 120 5.427 7.898 10.274 1.00 0.00 N ATOM 1293 CA ALA A 120 6.759 8.490 10.315 1.00 0.00 C ATOM 1294 C ALA A 120 6.868 9.664 9.348 1.00 0.00 C ATOM 1295 O ALA A 120 7.680 10.567 9.542 1.00 0.00 O ATOM 1296 CB ALA A 120 7.812 7.440 9.994 1.00 0.00 C ATOM 0 H ALA A 120 5.345 7.086 9.662 1.00 0.00 H new ATOM 0 HA ALA A 120 6.932 8.867 11.323 1.00 0.00 H new ATOM 0 HB1 ALA A 120 8.802 7.895 10.028 1.00 0.00 H new ATOM 0 HB2 ALA A 120 7.758 6.634 10.726 1.00 0.00 H new ATOM 0 HB3 ALA A 120 7.632 7.037 8.997 1.00 0.00 H new ATOM 1302 N GLY A 121 6.044 9.644 8.305 1.00 0.00 N ATOM 1303 CA GLY A 121 6.065 10.712 7.323 1.00 0.00 C ATOM 1304 C GLY A 121 7.121 10.499 6.256 1.00 0.00 C ATOM 1305 O GLY A 121 7.553 11.448 5.603 1.00 0.00 O ATOM 0 H GLY A 121 5.362 8.907 8.123 1.00 0.00 H new ATOM 0 HA2 GLY A 121 5.086 10.786 6.851 1.00 0.00 H new ATOM 0 HA3 GLY A 121 6.248 11.661 7.827 1.00 0.00 H new ATOM 1309 N ARG A 122 7.538 9.249 6.080 1.00 0.00 N ATOM 1310 CA ARG A 122 8.552 8.915 5.088 1.00 0.00 C ATOM 1311 C ARG A 122 8.408 7.466 4.630 1.00 0.00 C ATOM 1312 O ARG A 122 7.998 6.598 5.402 1.00 0.00 O ATOM 1313 CB ARG A 122 9.952 9.143 5.661 1.00 0.00 C ATOM 1314 CG ARG A 122 10.321 8.174 6.772 1.00 0.00 C ATOM 1315 CD ARG A 122 10.931 6.897 6.217 1.00 0.00 C ATOM 1316 NE ARG A 122 11.862 6.281 7.159 1.00 0.00 N ATOM 1317 CZ ARG A 122 12.840 5.459 6.795 1.00 0.00 C ATOM 1318 NH1 ARG A 122 13.015 5.157 5.516 1.00 0.00 N ATOM 1319 NH2 ARG A 122 13.647 4.939 7.711 1.00 0.00 N ATOM 0 H ARG A 122 7.189 8.452 6.612 1.00 0.00 H new ATOM 0 HA ARG A 122 8.409 9.567 4.226 1.00 0.00 H new ATOM 0 HB2 ARG A 122 10.683 9.056 4.857 1.00 0.00 H new ATOM 0 HB3 ARG A 122 10.018 10.162 6.043 1.00 0.00 H new ATOM 0 HG2 ARG A 122 11.027 8.650 7.452 1.00 0.00 H new ATOM 0 HG3 ARG A 122 9.432 7.931 7.354 1.00 0.00 H new ATOM 0 HD2 ARG A 122 10.137 6.190 5.978 1.00 0.00 H new ATOM 0 HD3 ARG A 122 11.452 7.119 5.285 1.00 0.00 H new ATOM 0 HE ARG A 122 11.755 6.494 8.151 1.00 0.00 H new ATOM 0 HH11 ARG A 122 12.398 5.556 4.809 1.00 0.00 H new ATOM 0 HH12 ARG A 122 13.767 4.526 5.239 1.00 0.00 H new ATOM 0 HH21 ARG A 122 13.517 5.170 8.696 1.00 0.00 H new ATOM 0 HH22 ARG A 122 14.398 4.308 7.430 1.00 0.00 H new ATOM 1333 N LEU A 123 8.747 7.213 3.371 1.00 0.00 N ATOM 1334 CA LEU A 123 8.656 5.870 2.810 1.00 0.00 C ATOM 1335 C LEU A 123 9.668 4.935 3.465 1.00 0.00 C ATOM 1336 O LEU A 123 10.864 5.228 3.505 1.00 0.00 O ATOM 1337 CB LEU A 123 8.887 5.910 1.298 1.00 0.00 C ATOM 1338 CG LEU A 123 8.179 4.828 0.482 1.00 0.00 C ATOM 1339 CD1 LEU A 123 8.476 4.998 -1.000 1.00 0.00 C ATOM 1340 CD2 LEU A 123 8.598 3.444 0.956 1.00 0.00 C ATOM 0 H LEU A 123 9.087 7.920 2.719 1.00 0.00 H new ATOM 0 HA LEU A 123 7.655 5.488 3.009 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.567 6.884 0.927 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.958 5.834 1.112 1.00 0.00 H new ATOM 0 HG LEU A 123 7.104 4.932 0.631 1.00 0.00 H new ATOM 0 HD11 LEU A 123 7.964 4.219 -1.565 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.127 5.976 -1.331 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.550 4.921 -1.167 1.00 0.00 H new ATOM 0 HD21 LEU A 123 8.085 2.686 0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 123 9.675 3.329 0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 123 8.335 3.324 2.007 1.00 0.00 H new ATOM 1352 N LEU A 124 9.181 3.810 3.976 1.00 0.00 N ATOM 1353 CA LEU A 124 10.044 2.830 4.628 1.00 0.00 C ATOM 1354 C LEU A 124 10.386 1.687 3.677 1.00 0.00 C ATOM 1355 O LEU A 124 9.941 1.667 2.530 1.00 0.00 O ATOM 1356 CB LEU A 124 9.364 2.279 5.883 1.00 0.00 C ATOM 1357 CG LEU A 124 8.831 3.318 6.869 1.00 0.00 C ATOM 1358 CD1 LEU A 124 7.680 2.744 7.680 1.00 0.00 C ATOM 1359 CD2 LEU A 124 9.944 3.801 7.788 1.00 0.00 C ATOM 0 H LEU A 124 8.194 3.553 3.952 1.00 0.00 H new ATOM 0 HA LEU A 124 10.970 3.330 4.913 1.00 0.00 H new ATOM 0 HB2 LEU A 124 8.535 1.643 5.573 1.00 0.00 H new ATOM 0 HB3 LEU A 124 10.076 1.642 6.407 1.00 0.00 H new ATOM 0 HG LEU A 124 8.459 4.171 6.302 1.00 0.00 H new ATOM 0 HD11 LEU A 124 7.314 3.498 8.376 1.00 0.00 H new ATOM 0 HD12 LEU A 124 6.874 2.448 7.009 1.00 0.00 H new ATOM 0 HD13 LEU A 124 8.026 1.873 8.237 1.00 0.00 H new ATOM 0 HD21 LEU A 124 9.547 4.540 8.483 1.00 0.00 H new ATOM 0 HD22 LEU A 124 10.346 2.956 8.347 1.00 0.00 H new ATOM 0 HD23 LEU A 124 10.737 4.253 7.192 1.00 0.00 H new ATOM 1371 N SER A 125 11.176 0.736 4.164 1.00 0.00 N ATOM 1372 CA SER A 125 11.579 -0.410 3.357 1.00 0.00 C ATOM 1373 C SER A 125 10.428 -1.399 3.204 1.00 0.00 C ATOM 1374 O SER A 125 9.490 -1.405 4.003 1.00 0.00 O ATOM 1375 CB SER A 125 12.785 -1.107 3.990 1.00 0.00 C ATOM 1376 OG SER A 125 13.876 -0.214 4.130 1.00 0.00 O ATOM 0 H SER A 125 11.550 0.736 5.113 1.00 0.00 H new ATOM 0 HA SER A 125 11.856 -0.047 2.367 1.00 0.00 H new ATOM 0 HB2 SER A 125 12.508 -1.503 4.967 1.00 0.00 H new ATOM 0 HB3 SER A 125 13.083 -1.956 3.374 1.00 0.00 H new ATOM 0 HG SER A 125 14.633 -0.684 4.538 1.00 0.00 H new ATOM 1382 N TYR A 126 10.505 -2.232 2.173 1.00 0.00 N ATOM 1383 CA TYR A 126 9.469 -3.224 1.913 1.00 0.00 C ATOM 1384 C TYR A 126 10.030 -4.639 2.019 1.00 0.00 C ATOM 1385 O TYR A 126 9.288 -5.598 2.235 1.00 0.00 O ATOM 1386 CB TYR A 126 8.862 -3.007 0.526 1.00 0.00 C ATOM 1387 CG TYR A 126 9.718 -3.543 -0.600 1.00 0.00 C ATOM 1388 CD1 TYR A 126 9.796 -4.907 -0.851 1.00 0.00 C ATOM 1389 CD2 TYR A 126 10.450 -2.685 -1.412 1.00 0.00 C ATOM 1390 CE1 TYR A 126 10.577 -5.401 -1.878 1.00 0.00 C ATOM 1391 CE2 TYR A 126 11.232 -3.170 -2.442 1.00 0.00 C ATOM 1392 CZ TYR A 126 11.293 -4.529 -2.670 1.00 0.00 C ATOM 1393 OH TYR A 126 12.073 -5.016 -3.694 1.00 0.00 O ATOM 0 H TYR A 126 11.274 -2.240 1.503 1.00 0.00 H new ATOM 0 HA TYR A 126 8.690 -3.104 2.666 1.00 0.00 H new ATOM 0 HB2 TYR A 126 7.884 -3.486 0.488 1.00 0.00 H new ATOM 0 HB3 TYR A 126 8.700 -1.940 0.372 1.00 0.00 H new ATOM 0 HD1 TYR A 126 9.236 -5.593 -0.233 1.00 0.00 H new ATOM 0 HD2 TYR A 126 10.407 -1.621 -1.235 1.00 0.00 H new ATOM 0 HE1 TYR A 126 10.626 -6.465 -2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 126 11.793 -2.489 -3.065 1.00 0.00 H new ATOM 0 HH TYR A 126 12.510 -4.270 -4.155 1.00 0.00 H new ATOM 1403 N ILE A 127 11.344 -4.760 1.867 1.00 0.00 N ATOM 1404 CA ILE A 127 12.006 -6.056 1.948 1.00 0.00 C ATOM 1405 C ILE A 127 11.511 -6.852 3.151 1.00 0.00 C ATOM 1406 O ILE A 127 10.988 -7.959 3.022 1.00 0.00 O ATOM 1407 CB ILE A 127 13.535 -5.903 2.042 1.00 0.00 C ATOM 1408 CG1 ILE A 127 14.158 -5.916 0.644 1.00 0.00 C ATOM 1409 CG2 ILE A 127 14.127 -7.010 2.902 1.00 0.00 C ATOM 1410 CD1 ILE A 127 13.794 -7.139 -0.168 1.00 0.00 C ATOM 0 H ILE A 127 11.972 -3.976 1.687 1.00 0.00 H new ATOM 0 HA ILE A 127 11.759 -6.594 1.033 1.00 0.00 H new ATOM 0 HB ILE A 127 13.761 -4.945 2.511 1.00 0.00 H new ATOM 0 HG12 ILE A 127 13.840 -5.024 0.105 1.00 0.00 H new ATOM 0 HG13 ILE A 127 15.243 -5.862 0.738 1.00 0.00 H new ATOM 0 HG21 ILE A 127 15.209 -6.888 2.959 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.703 -6.958 3.905 1.00 0.00 H new ATOM 0 HG23 ILE A 127 13.894 -7.979 2.459 1.00 0.00 H new ATOM 0 HD11 ILE A 127 14.270 -7.081 -1.147 1.00 0.00 H new ATOM 0 HD12 ILE A 127 14.137 -8.035 0.350 1.00 0.00 H new ATOM 0 HD13 ILE A 127 12.712 -7.184 -0.293 1.00 0.00 H new ATOM 1422 N PRO A 128 11.678 -6.276 4.351 1.00 0.00 N ATOM 1423 CA PRO A 128 11.253 -6.913 5.601 1.00 0.00 C ATOM 1424 C PRO A 128 9.735 -6.975 5.733 1.00 0.00 C ATOM 1425 O PRO A 128 9.207 -7.619 6.640 1.00 0.00 O ATOM 1426 CB PRO A 128 11.847 -6.005 6.681 1.00 0.00 C ATOM 1427 CG PRO A 128 11.987 -4.676 6.024 1.00 0.00 C ATOM 1428 CD PRO A 128 12.294 -4.958 4.579 1.00 0.00 C ATOM 0 HA PRO A 128 11.586 -7.949 5.665 1.00 0.00 H new ATOM 0 HB2 PRO A 128 11.196 -5.949 7.553 1.00 0.00 H new ATOM 0 HB3 PRO A 128 12.811 -6.379 7.027 1.00 0.00 H new ATOM 0 HG2 PRO A 128 11.071 -4.094 6.122 1.00 0.00 H new ATOM 0 HG3 PRO A 128 12.785 -4.094 6.486 1.00 0.00 H new ATOM 0 HD2 PRO A 128 11.871 -4.198 3.922 1.00 0.00 H new ATOM 0 HD3 PRO A 128 13.368 -4.979 4.393 1.00 0.00 H new ATOM 1436 N TYR A 129 9.039 -6.302 4.823 1.00 0.00 N ATOM 1437 CA TYR A 129 7.581 -6.280 4.840 1.00 0.00 C ATOM 1438 C TYR A 129 7.010 -7.261 3.821 1.00 0.00 C ATOM 1439 O TYR A 129 5.811 -7.255 3.543 1.00 0.00 O ATOM 1440 CB TYR A 129 7.069 -4.869 4.548 1.00 0.00 C ATOM 1441 CG TYR A 129 7.383 -3.873 5.641 1.00 0.00 C ATOM 1442 CD1 TYR A 129 8.626 -3.255 5.709 1.00 0.00 C ATOM 1443 CD2 TYR A 129 6.438 -3.550 6.608 1.00 0.00 C ATOM 1444 CE1 TYR A 129 8.918 -2.344 6.706 1.00 0.00 C ATOM 1445 CE2 TYR A 129 6.721 -2.640 7.607 1.00 0.00 C ATOM 1446 CZ TYR A 129 7.963 -2.040 7.652 1.00 0.00 C ATOM 1447 OH TYR A 129 8.249 -1.134 8.648 1.00 0.00 O ATOM 0 H TYR A 129 9.461 -5.765 4.065 1.00 0.00 H new ATOM 0 HA TYR A 129 7.249 -6.582 5.833 1.00 0.00 H new ATOM 0 HB2 TYR A 129 7.506 -4.519 3.613 1.00 0.00 H new ATOM 0 HB3 TYR A 129 5.990 -4.906 4.401 1.00 0.00 H new ATOM 0 HD1 TYR A 129 9.377 -3.491 4.970 1.00 0.00 H new ATOM 0 HD2 TYR A 129 5.466 -4.019 6.577 1.00 0.00 H new ATOM 0 HE1 TYR A 129 9.889 -1.873 6.744 1.00 0.00 H new ATOM 0 HE2 TYR A 129 5.974 -2.399 8.349 1.00 0.00 H new ATOM 0 HH TYR A 129 7.468 -1.032 9.231 1.00 0.00 H new ATOM 1457 N GLN A 130 7.878 -8.103 3.269 1.00 0.00 N ATOM 1458 CA GLN A 130 7.460 -9.091 2.280 1.00 0.00 C ATOM 1459 C GLN A 130 7.131 -10.422 2.947 1.00 0.00 C ATOM 1460 O GLN A 130 7.994 -11.051 3.561 1.00 0.00 O ATOM 1461 CB GLN A 130 8.556 -9.289 1.232 1.00 0.00 C ATOM 1462 CG GLN A 130 8.453 -8.331 0.056 1.00 0.00 C ATOM 1463 CD GLN A 130 9.651 -8.413 -0.870 1.00 0.00 C ATOM 1464 OE1 GLN A 130 9.503 -8.526 -2.087 1.00 0.00 O ATOM 1465 NE2 GLN A 130 10.847 -8.355 -0.297 1.00 0.00 N ATOM 0 H GLN A 130 8.874 -8.121 3.489 1.00 0.00 H new ATOM 0 HA GLN A 130 6.561 -8.719 1.789 1.00 0.00 H new ATOM 0 HB2 GLN A 130 9.529 -9.164 1.708 1.00 0.00 H new ATOM 0 HB3 GLN A 130 8.512 -10.313 0.861 1.00 0.00 H new ATOM 0 HG2 GLN A 130 7.547 -8.551 -0.508 1.00 0.00 H new ATOM 0 HG3 GLN A 130 8.357 -7.312 0.430 1.00 0.00 H new ATOM 0 HE21 GLN A 130 10.923 -8.261 0.716 1.00 0.00 H new ATOM 0 HE22 GLN A 130 11.690 -8.404 -0.870 1.00 0.00 H new ATOM 1474 N LEU A 131 5.878 -10.846 2.823 1.00 0.00 N ATOM 1475 CA LEU A 131 5.434 -12.104 3.413 1.00 0.00 C ATOM 1476 C LEU A 131 6.176 -13.287 2.798 1.00 0.00 C ATOM 1477 O LEU A 131 7.064 -13.868 3.422 1.00 0.00 O ATOM 1478 CB LEU A 131 3.927 -12.277 3.221 1.00 0.00 C ATOM 1479 CG LEU A 131 3.034 -11.341 4.037 1.00 0.00 C ATOM 1480 CD1 LEU A 131 1.682 -11.170 3.362 1.00 0.00 C ATOM 1481 CD2 LEU A 131 2.862 -11.870 5.453 1.00 0.00 C ATOM 0 H LEU A 131 5.152 -10.337 2.319 1.00 0.00 H new ATOM 0 HA LEU A 131 5.657 -12.074 4.480 1.00 0.00 H new ATOM 0 HB2 LEU A 131 3.697 -12.137 2.165 1.00 0.00 H new ATOM 0 HB3 LEU A 131 3.665 -13.305 3.470 1.00 0.00 H new ATOM 0 HG LEU A 131 3.516 -10.365 4.091 1.00 0.00 H new ATOM 0 HD11 LEU A 131 1.060 -10.501 3.957 1.00 0.00 H new ATOM 0 HD12 LEU A 131 1.823 -10.746 2.368 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.192 -12.140 3.277 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.224 -11.192 6.020 1.00 0.00 H new ATOM 0 HD22 LEU A 131 2.402 -12.858 5.419 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.837 -11.940 5.936 1.00 0.00 H new ATOM 1493 N TYR A 132 5.807 -13.636 1.571 1.00 0.00 N ATOM 1494 CA TYR A 132 6.437 -14.749 0.871 1.00 0.00 C ATOM 1495 C TYR A 132 7.360 -14.245 -0.235 1.00 0.00 C ATOM 1496 O TYR A 132 6.917 -13.960 -1.349 1.00 0.00 O ATOM 1497 CB TYR A 132 5.373 -15.675 0.280 1.00 0.00 C ATOM 1498 CG TYR A 132 4.200 -15.916 1.203 1.00 0.00 C ATOM 1499 CD1 TYR A 132 4.221 -16.951 2.129 1.00 0.00 C ATOM 1500 CD2 TYR A 132 3.070 -15.109 1.148 1.00 0.00 C ATOM 1501 CE1 TYR A 132 3.151 -17.176 2.974 1.00 0.00 C ATOM 1502 CE2 TYR A 132 1.996 -15.325 1.990 1.00 0.00 C ATOM 1503 CZ TYR A 132 2.041 -16.360 2.901 1.00 0.00 C ATOM 1504 OH TYR A 132 0.973 -16.579 3.740 1.00 0.00 O ATOM 0 H TYR A 132 5.075 -13.164 1.040 1.00 0.00 H new ATOM 0 HA TYR A 132 7.035 -15.307 1.592 1.00 0.00 H new ATOM 0 HB2 TYR A 132 5.008 -15.246 -0.653 1.00 0.00 H new ATOM 0 HB3 TYR A 132 5.833 -16.632 0.033 1.00 0.00 H new ATOM 0 HD1 TYR A 132 5.089 -17.591 2.190 1.00 0.00 H new ATOM 0 HD2 TYR A 132 3.031 -14.299 0.435 1.00 0.00 H new ATOM 0 HE1 TYR A 132 3.184 -17.986 3.688 1.00 0.00 H new ATOM 0 HE2 TYR A 132 1.126 -14.687 1.935 1.00 0.00 H new ATOM 0 HH TYR A 132 0.721 -15.738 4.175 1.00 0.00 H new ATOM 1514 N THR A 133 8.647 -14.137 0.080 1.00 0.00 N ATOM 1515 CA THR A 133 9.633 -13.668 -0.884 1.00 0.00 C ATOM 1516 C THR A 133 10.868 -14.561 -0.887 1.00 0.00 C ATOM 1517 O THR A 133 11.104 -15.315 0.058 1.00 0.00 O ATOM 1518 CB THR A 133 10.063 -12.218 -0.588 1.00 0.00 C ATOM 1519 OG1 THR A 133 10.960 -11.756 -1.604 1.00 0.00 O ATOM 1520 CG2 THR A 133 10.736 -12.121 0.773 1.00 0.00 C ATOM 0 H THR A 133 9.030 -14.368 0.996 1.00 0.00 H new ATOM 0 HA THR A 133 9.158 -13.706 -1.864 1.00 0.00 H new ATOM 0 HB THR A 133 9.171 -11.592 -0.580 1.00 0.00 H new ATOM 0 HG1 THR A 133 11.227 -10.833 -1.410 1.00 0.00 H new ATOM 0 HG21 THR A 133 11.031 -11.089 0.960 1.00 0.00 H new ATOM 0 HG22 THR A 133 10.040 -12.446 1.547 1.00 0.00 H new ATOM 0 HG23 THR A 133 11.620 -12.759 0.788 1.00 0.00 H new TER 1528 THR A 133