USER MOD reduce.3.24.130724 H: found=0, std=0, add=885, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 884 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 67 MET CE :methyl 177:sc= -0.252 (180deg=-0.283) USER MOD Set 1.2: A 90 SER OG : rot 180:sc= -0.013 USER MOD Set 2.1: A 79 LYS NZ :NH3+ -179:sc= 0.91 (180deg=0) USER MOD Set 2.2: A 81 THR OG1 : rot 91:sc= 0.687 USER MOD Set 2.3: A 94 SER OG : rot 75:sc= 1.17 USER MOD Set 2.4: A 120 HIS : no HE2:sc= 1.1 K(o=3.9,f=-6.8!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.381 USER MOD Single : A 45 TYR OH : rot 32:sc= 1.27 USER MOD Single : A 47 LYS NZ :NH3+ -144:sc= 1.4 (180deg=-0.557) USER MOD Single : A 50 THR OG1 : rot -42:sc= 0.247 USER MOD Single : A 51 GLN : amide:sc= 0.657 K(o=0.66,f=-0.031) USER MOD Single : A 52 GLN : amide:sc= -0.022 X(o=-0.022,f=-0.3) USER MOD Single : A 53 MET CE :methyl -175:sc= -0.0677 (180deg=-0.0968) USER MOD Single : A 58 GLN : amide:sc= 1.8 K(o=1.8,f=-6.8!) USER MOD Single : A 65 MET CE :methyl -161:sc= -0.404 (180deg=-0.976) USER MOD Single : A 70 SER OG : rot -177:sc= 0.987 USER MOD Single : A 72 GLN : amide:sc= -0.315 K(o=-0.31,f=-1.3) USER MOD Single : A 76 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 77 SER OG : rot 180:sc= 0.191 USER MOD Single : A 83 THR OG1 : rot -81:sc= 1.19 USER MOD Single : A 85 TYR OH : rot 90:sc= 0.0388 USER MOD Single : A 95 TYR OH : rot 87:sc= 0.365 USER MOD Single : A 107 GLN : amide:sc= -0.0632 K(o=-0.063,f=-2.2!) USER MOD Single : A 112 GLN : amide:sc= -1.02 X(o=-1,f=-0.96) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= -1.37 X(o=-1.4,f=-1.4) USER MOD Single : A 124 LYS NZ :NH3+ -112:sc= 1.19 (180deg=-0.135) USER MOD Single : A 129 LYS NZ :NH3+ -127:sc= -0.0782 (180deg=-1.2) USER MOD Single : A 130 HIS : no HE2:sc= -1.68 K(o=-1.7,f=-3.7!) USER MOD Single : A 133 ASN : amide:sc= -0.0753 X(o=-0.075,f=-0.075) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 MET CE :methyl -146:sc= 0 (180deg=-0.0467) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 30 0.845 -23.918 -3.588 1.00 0.00 N ATOM 2 CA LEU A 30 1.054 -22.862 -2.585 1.00 0.00 C ATOM 3 C LEU A 30 2.470 -22.974 -2.037 1.00 0.00 C ATOM 4 O LEU A 30 2.878 -24.073 -1.665 1.00 0.00 O ATOM 5 CB LEU A 30 0.065 -22.973 -1.413 1.00 0.00 C ATOM 6 CG LEU A 30 -1.371 -22.518 -1.727 1.00 0.00 C ATOM 7 CD1 LEU A 30 -2.132 -23.482 -2.645 1.00 0.00 C ATOM 8 CD2 LEU A 30 -2.159 -22.387 -0.421 1.00 0.00 C ATOM 0 HA LEU A 30 0.893 -21.902 -3.075 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.036 -24.010 -1.079 1.00 0.00 H new ATOM 0 HB3 LEU A 30 0.444 -22.380 -0.580 1.00 0.00 H new ATOM 0 HG LEU A 30 -1.283 -21.565 -2.248 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -3.136 -23.098 -2.823 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -1.604 -23.573 -3.594 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -2.197 -24.461 -2.171 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -3.177 -22.065 -0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -2.185 -23.351 0.086 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -1.677 -21.651 0.223 1.00 0.00 H new ATOM 20 N ARG A 31 3.217 -21.866 -1.983 1.00 0.00 N ATOM 21 CA ARG A 31 4.419 -21.675 -1.159 1.00 0.00 C ATOM 22 C ARG A 31 4.469 -20.194 -0.776 1.00 0.00 C ATOM 23 O ARG A 31 3.922 -19.373 -1.521 1.00 0.00 O ATOM 24 CB ARG A 31 5.723 -22.034 -1.911 1.00 0.00 C ATOM 25 CG ARG A 31 5.969 -23.536 -2.131 1.00 0.00 C ATOM 26 CD ARG A 31 5.550 -23.985 -3.536 1.00 0.00 C ATOM 27 NE ARG A 31 5.509 -25.449 -3.700 1.00 0.00 N ATOM 28 CZ ARG A 31 5.782 -26.116 -4.833 1.00 0.00 C ATOM 29 NH1 ARG A 31 6.153 -25.468 -5.936 1.00 0.00 N ATOM 30 NH2 ARG A 31 5.679 -27.440 -4.874 1.00 0.00 N ATOM 0 H ARG A 31 2.991 -21.040 -2.537 1.00 0.00 H new ATOM 0 HA ARG A 31 4.356 -22.334 -0.293 1.00 0.00 H new ATOM 0 HB2 ARG A 31 5.709 -21.540 -2.882 1.00 0.00 H new ATOM 0 HB3 ARG A 31 6.566 -21.623 -1.356 1.00 0.00 H new ATOM 0 HG2 ARG A 31 7.026 -23.757 -1.980 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.414 -24.107 -1.387 1.00 0.00 H new ATOM 0 HD2 ARG A 31 4.565 -23.575 -3.761 1.00 0.00 H new ATOM 0 HD3 ARG A 31 6.244 -23.565 -4.264 1.00 0.00 H new ATOM 0 HE ARG A 31 5.251 -26.003 -2.883 1.00 0.00 H new ATOM 0 HH11 ARG A 31 6.233 -24.451 -5.928 1.00 0.00 H new ATOM 0 HH12 ARG A 31 6.357 -25.989 -6.789 1.00 0.00 H new ATOM 0 HH21 ARG A 31 5.391 -27.955 -4.042 1.00 0.00 H new ATOM 0 HH22 ARG A 31 5.888 -27.941 -5.737 1.00 0.00 H new ATOM 44 N SER A 32 5.174 -19.828 0.292 1.00 0.00 N ATOM 45 CA SER A 32 5.560 -18.441 0.552 1.00 0.00 C ATOM 46 C SER A 32 7.072 -18.311 0.339 1.00 0.00 C ATOM 47 O SER A 32 7.793 -19.309 0.319 1.00 0.00 O ATOM 48 CB SER A 32 5.078 -17.976 1.938 1.00 0.00 C ATOM 49 OG SER A 32 5.349 -18.917 2.964 1.00 0.00 O ATOM 0 H SER A 32 5.495 -20.485 1.003 1.00 0.00 H new ATOM 0 HA SER A 32 5.068 -17.767 -0.149 1.00 0.00 H new ATOM 0 HB2 SER A 32 5.559 -17.029 2.185 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.005 -17.788 1.899 1.00 0.00 H new ATOM 0 HG SER A 32 5.024 -18.570 3.821 1.00 0.00 H new ATOM 55 N ASN A 33 7.554 -17.086 0.126 1.00 0.00 N ATOM 56 CA ASN A 33 8.970 -16.741 0.004 1.00 0.00 C ATOM 57 C ASN A 33 9.021 -15.224 -0.080 1.00 0.00 C ATOM 58 O ASN A 33 9.432 -14.542 0.853 1.00 0.00 O ATOM 59 CB ASN A 33 9.629 -17.367 -1.248 1.00 0.00 C ATOM 60 CG ASN A 33 11.007 -16.762 -1.509 1.00 0.00 C ATOM 61 OD1 ASN A 33 11.776 -16.496 -0.592 1.00 0.00 O ATOM 62 ND2 ASN A 33 11.344 -16.494 -2.755 1.00 0.00 N ATOM 0 H ASN A 33 6.943 -16.275 0.030 1.00 0.00 H new ATOM 0 HA ASN A 33 9.525 -17.131 0.857 1.00 0.00 H new ATOM 0 HB2 ASN A 33 9.722 -18.445 -1.113 1.00 0.00 H new ATOM 0 HB3 ASN A 33 8.989 -17.209 -2.116 1.00 0.00 H new ATOM 0 HD21 ASN A 33 12.247 -16.064 -2.958 1.00 0.00 H new ATOM 0 HD22 ASN A 33 10.702 -16.716 -3.516 1.00 0.00 H new ATOM 69 N ILE A 34 8.531 -14.706 -1.202 1.00 0.00 N ATOM 70 CA ILE A 34 8.300 -13.292 -1.422 1.00 0.00 C ATOM 71 C ILE A 34 7.091 -12.903 -0.567 1.00 0.00 C ATOM 72 O ILE A 34 6.241 -13.746 -0.252 1.00 0.00 O ATOM 73 CB ILE A 34 8.053 -13.029 -2.928 1.00 0.00 C ATOM 74 CG1 ILE A 34 9.115 -13.703 -3.832 1.00 0.00 C ATOM 75 CG2 ILE A 34 8.014 -11.519 -3.244 1.00 0.00 C ATOM 76 CD1 ILE A 34 8.583 -13.903 -5.249 1.00 0.00 C ATOM 0 H ILE A 34 8.277 -15.281 -2.005 1.00 0.00 H new ATOM 0 HA ILE A 34 9.162 -12.690 -1.136 1.00 0.00 H new ATOM 0 HB ILE A 34 7.081 -13.472 -3.146 1.00 0.00 H new ATOM 0 HG12 ILE A 34 10.015 -13.089 -3.861 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.400 -14.666 -3.408 1.00 0.00 H new ATOM 0 HG21 ILE A 34 7.839 -11.375 -4.310 1.00 0.00 H new ATOM 0 HG22 ILE A 34 7.210 -11.049 -2.677 1.00 0.00 H new ATOM 0 HG23 ILE A 34 8.966 -11.065 -2.968 1.00 0.00 H new ATOM 0 HD11 ILE A 34 9.349 -14.378 -5.862 1.00 0.00 H new ATOM 0 HD12 ILE A 34 7.697 -14.538 -5.219 1.00 0.00 H new ATOM 0 HD13 ILE A 34 8.322 -12.936 -5.679 1.00 0.00 H new ATOM 88 N ASP A 35 7.006 -11.615 -0.255 1.00 0.00 N ATOM 89 CA ASP A 35 5.928 -10.978 0.489 1.00 0.00 C ATOM 90 C ASP A 35 4.550 -11.285 -0.085 1.00 0.00 C ATOM 91 O ASP A 35 4.385 -11.418 -1.305 1.00 0.00 O ATOM 92 CB ASP A 35 6.134 -9.455 0.441 1.00 0.00 C ATOM 93 CG ASP A 35 6.755 -8.914 1.715 1.00 0.00 C ATOM 94 OD1 ASP A 35 6.275 -9.299 2.805 1.00 0.00 O ATOM 95 OD2 ASP A 35 7.689 -8.091 1.624 1.00 0.00 O ATOM 0 H ASP A 35 7.729 -10.950 -0.531 1.00 0.00 H new ATOM 0 HA ASP A 35 5.961 -11.368 1.506 1.00 0.00 H new ATOM 0 HB2 ASP A 35 6.773 -9.204 -0.406 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.174 -8.967 0.272 1.00 0.00 H new ATOM 100 N LEU A 36 3.535 -11.321 0.784 1.00 0.00 N ATOM 101 CA LEU A 36 2.142 -11.173 0.394 1.00 0.00 C ATOM 102 C LEU A 36 1.873 -9.718 0.018 1.00 0.00 C ATOM 103 O LEU A 36 2.710 -8.828 0.189 1.00 0.00 O ATOM 104 CB LEU A 36 1.193 -11.679 1.502 1.00 0.00 C ATOM 105 CG LEU A 36 1.402 -11.057 2.894 1.00 0.00 C ATOM 106 CD1 LEU A 36 1.090 -9.560 2.975 1.00 0.00 C ATOM 107 CD2 LEU A 36 0.586 -11.830 3.935 1.00 0.00 C ATOM 0 H LEU A 36 3.666 -11.455 1.787 1.00 0.00 H new ATOM 0 HA LEU A 36 1.944 -11.792 -0.481 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.166 -11.489 1.190 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.306 -12.760 1.586 1.00 0.00 H new ATOM 0 HG LEU A 36 2.468 -11.141 3.104 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.265 -9.206 3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.735 -9.016 2.285 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.047 -9.391 2.706 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.737 -11.386 4.919 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.472 -11.785 3.675 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.911 -12.870 3.953 1.00 0.00 H new ATOM 119 N PHE A 37 0.670 -9.515 -0.492 1.00 0.00 N ATOM 120 CA PHE A 37 0.140 -8.320 -1.132 1.00 0.00 C ATOM 121 C PHE A 37 -1.365 -8.556 -1.291 1.00 0.00 C ATOM 122 O PHE A 37 -1.778 -9.708 -1.440 1.00 0.00 O ATOM 123 CB PHE A 37 0.808 -8.165 -2.508 1.00 0.00 C ATOM 124 CG PHE A 37 0.498 -6.897 -3.278 1.00 0.00 C ATOM 125 CD1 PHE A 37 -0.682 -6.789 -4.042 1.00 0.00 C ATOM 126 CD2 PHE A 37 1.438 -5.848 -3.300 1.00 0.00 C ATOM 127 CE1 PHE A 37 -0.900 -5.659 -4.848 1.00 0.00 C ATOM 128 CE2 PHE A 37 1.230 -4.733 -4.127 1.00 0.00 C ATOM 129 CZ PHE A 37 0.076 -4.657 -4.920 1.00 0.00 C ATOM 0 H PHE A 37 -0.030 -10.256 -0.466 1.00 0.00 H new ATOM 0 HA PHE A 37 0.330 -7.416 -0.554 1.00 0.00 H new ATOM 0 HB2 PHE A 37 1.888 -8.224 -2.370 1.00 0.00 H new ATOM 0 HB3 PHE A 37 0.519 -9.016 -3.124 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.420 -7.577 -4.008 1.00 0.00 H new ATOM 0 HD2 PHE A 37 2.320 -5.902 -2.679 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -1.817 -5.563 -5.410 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.957 -3.935 -4.152 1.00 0.00 H new ATOM 0 HZ PHE A 37 -0.061 -3.821 -5.590 1.00 0.00 H new ATOM 139 N TYR A 38 -2.170 -7.501 -1.257 1.00 0.00 N ATOM 140 CA TYR A 38 -3.625 -7.525 -1.339 1.00 0.00 C ATOM 141 C TYR A 38 -4.109 -6.382 -2.246 1.00 0.00 C ATOM 142 O TYR A 38 -3.301 -5.575 -2.707 1.00 0.00 O ATOM 143 CB TYR A 38 -4.199 -7.373 0.075 1.00 0.00 C ATOM 144 CG TYR A 38 -3.934 -8.513 1.041 1.00 0.00 C ATOM 145 CD1 TYR A 38 -2.713 -8.590 1.738 1.00 0.00 C ATOM 146 CD2 TYR A 38 -4.921 -9.493 1.257 1.00 0.00 C ATOM 147 CE1 TYR A 38 -2.463 -9.666 2.609 1.00 0.00 C ATOM 148 CE2 TYR A 38 -4.673 -10.562 2.131 1.00 0.00 C ATOM 149 CZ TYR A 38 -3.442 -10.663 2.806 1.00 0.00 C ATOM 150 OH TYR A 38 -3.173 -11.744 3.589 1.00 0.00 O ATOM 0 H TYR A 38 -1.804 -6.553 -1.166 1.00 0.00 H new ATOM 0 HA TYR A 38 -3.965 -8.469 -1.766 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -3.797 -6.458 0.509 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -5.278 -7.240 -0.007 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -1.967 -7.821 1.604 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -5.871 -9.422 0.749 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -1.518 -9.729 3.129 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -5.433 -11.314 2.287 1.00 0.00 H new ATOM 0 HH TYR A 38 -3.957 -12.331 3.617 1.00 0.00 H new ATOM 160 N THR A 39 -5.420 -6.248 -2.453 1.00 0.00 N ATOM 161 CA THR A 39 -6.029 -5.127 -3.161 1.00 0.00 C ATOM 162 C THR A 39 -7.207 -4.555 -2.363 1.00 0.00 C ATOM 163 O THR A 39 -7.620 -5.190 -1.383 1.00 0.00 O ATOM 164 CB THR A 39 -6.466 -5.573 -4.579 1.00 0.00 C ATOM 165 OG1 THR A 39 -7.465 -6.572 -4.471 1.00 0.00 O ATOM 166 CG2 THR A 39 -5.313 -6.133 -5.419 1.00 0.00 C ATOM 0 H THR A 39 -6.101 -6.933 -2.125 1.00 0.00 H new ATOM 0 HA THR A 39 -5.292 -4.331 -3.266 1.00 0.00 H new ATOM 0 HB THR A 39 -6.841 -4.682 -5.083 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.744 -6.854 -5.367 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.687 -6.427 -6.400 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.544 -5.369 -5.537 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.887 -7.002 -4.918 1.00 0.00 H new ATOM 174 N PRO A 40 -7.770 -3.394 -2.760 1.00 0.00 N ATOM 175 CA PRO A 40 -9.093 -2.924 -2.353 1.00 0.00 C ATOM 176 C PRO A 40 -10.189 -3.888 -2.839 1.00 0.00 C ATOM 177 O PRO A 40 -11.003 -3.595 -3.714 1.00 0.00 O ATOM 178 CB PRO A 40 -9.245 -1.503 -2.924 1.00 0.00 C ATOM 179 CG PRO A 40 -7.837 -1.088 -3.326 1.00 0.00 C ATOM 180 CD PRO A 40 -7.150 -2.409 -3.629 1.00 0.00 C ATOM 0 HA PRO A 40 -9.198 -2.896 -1.268 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -9.920 -1.492 -3.780 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -9.661 -0.822 -2.182 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.845 -0.431 -4.196 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -7.333 -0.548 -2.524 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -7.274 -2.681 -4.677 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -6.078 -2.343 -3.441 1.00 0.00 H new ATOM 188 N GLY A 41 -10.169 -5.096 -2.299 1.00 0.00 N ATOM 189 CA GLY A 41 -10.789 -6.233 -2.918 1.00 0.00 C ATOM 190 C GLY A 41 -10.343 -7.500 -2.235 1.00 0.00 C ATOM 191 O GLY A 41 -11.161 -8.138 -1.586 1.00 0.00 O ATOM 0 H GLY A 41 -9.715 -5.306 -1.410 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -11.874 -6.142 -2.861 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -10.528 -6.269 -3.976 1.00 0.00 H new ATOM 195 N GLU A 42 -9.052 -7.831 -2.272 1.00 0.00 N ATOM 196 CA GLU A 42 -8.581 -9.026 -1.575 1.00 0.00 C ATOM 197 C GLU A 42 -8.732 -8.898 -0.054 1.00 0.00 C ATOM 198 O GLU A 42 -8.771 -9.900 0.655 1.00 0.00 O ATOM 199 CB GLU A 42 -7.127 -9.362 -1.918 1.00 0.00 C ATOM 200 CG GLU A 42 -6.920 -9.880 -3.346 1.00 0.00 C ATOM 201 CD GLU A 42 -5.580 -10.603 -3.438 1.00 0.00 C ATOM 202 OE1 GLU A 42 -4.512 -9.959 -3.537 1.00 0.00 O ATOM 203 OE2 GLU A 42 -5.551 -11.844 -3.301 1.00 0.00 O ATOM 0 H GLU A 42 -8.331 -7.304 -2.764 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.214 -9.842 -1.923 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -6.517 -8.470 -1.775 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -6.764 -10.112 -1.216 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -7.730 -10.557 -3.619 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -6.946 -9.050 -4.052 1.00 0.00 H new ATOM 210 N ILE A 43 -8.815 -7.667 0.454 1.00 0.00 N ATOM 211 CA ILE A 43 -9.065 -7.377 1.863 1.00 0.00 C ATOM 212 C ILE A 43 -10.578 -7.397 2.177 1.00 0.00 C ATOM 213 O ILE A 43 -10.970 -7.440 3.338 1.00 0.00 O ATOM 214 CB ILE A 43 -8.369 -6.031 2.207 1.00 0.00 C ATOM 215 CG1 ILE A 43 -6.857 -6.149 1.866 1.00 0.00 C ATOM 216 CG2 ILE A 43 -8.641 -5.666 3.677 1.00 0.00 C ATOM 217 CD1 ILE A 43 -5.892 -5.209 2.586 1.00 0.00 C ATOM 0 H ILE A 43 -8.708 -6.828 -0.116 1.00 0.00 H new ATOM 0 HA ILE A 43 -8.640 -8.151 2.502 1.00 0.00 H new ATOM 0 HB ILE A 43 -8.773 -5.213 1.610 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.545 -7.173 2.073 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -6.742 -5.991 0.794 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -8.151 -4.722 3.914 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -9.715 -5.567 3.835 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -8.250 -6.450 4.325 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -4.874 -5.405 2.249 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -6.156 -4.175 2.362 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -5.957 -5.375 3.661 1.00 0.00 H new ATOM 229 N LEU A 44 -11.438 -7.377 1.159 1.00 0.00 N ATOM 230 CA LEU A 44 -12.864 -7.077 1.299 1.00 0.00 C ATOM 231 C LEU A 44 -13.735 -8.276 0.936 1.00 0.00 C ATOM 232 O LEU A 44 -14.727 -8.537 1.612 1.00 0.00 O ATOM 233 CB LEU A 44 -13.248 -5.864 0.434 1.00 0.00 C ATOM 234 CG LEU A 44 -12.293 -4.668 0.447 1.00 0.00 C ATOM 235 CD1 LEU A 44 -12.789 -3.601 -0.523 1.00 0.00 C ATOM 236 CD2 LEU A 44 -12.211 -4.110 1.848 1.00 0.00 C ATOM 0 H LEU A 44 -11.159 -7.572 0.197 1.00 0.00 H new ATOM 0 HA LEU A 44 -13.044 -6.840 2.348 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -13.352 -6.203 -0.597 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.230 -5.516 0.756 1.00 0.00 H new ATOM 0 HG LEU A 44 -11.299 -4.987 0.133 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -12.106 -2.752 -0.510 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -12.832 -4.016 -1.530 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -13.784 -3.271 -0.223 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -11.531 -3.258 1.861 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -13.202 -3.789 2.170 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -11.841 -4.880 2.525 1.00 0.00 H new ATOM 248 N TYR A 45 -13.385 -8.967 -0.144 1.00 0.00 N ATOM 249 CA TYR A 45 -14.112 -10.073 -0.753 1.00 0.00 C ATOM 250 C TYR A 45 -13.369 -11.382 -0.484 1.00 0.00 C ATOM 251 O TYR A 45 -13.977 -12.364 -0.067 1.00 0.00 O ATOM 252 CB TYR A 45 -14.236 -9.815 -2.263 1.00 0.00 C ATOM 253 CG TYR A 45 -15.098 -8.624 -2.633 1.00 0.00 C ATOM 254 CD1 TYR A 45 -14.559 -7.329 -2.591 1.00 0.00 C ATOM 255 CD2 TYR A 45 -16.442 -8.801 -3.001 1.00 0.00 C ATOM 256 CE1 TYR A 45 -15.351 -6.214 -2.890 1.00 0.00 C ATOM 257 CE2 TYR A 45 -17.241 -7.695 -3.339 1.00 0.00 C ATOM 258 CZ TYR A 45 -16.703 -6.393 -3.273 1.00 0.00 C ATOM 259 OH TYR A 45 -17.492 -5.332 -3.595 1.00 0.00 O ATOM 0 H TYR A 45 -12.526 -8.753 -0.651 1.00 0.00 H new ATOM 0 HA TYR A 45 -15.111 -10.151 -0.324 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -13.238 -9.666 -2.676 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -14.648 -10.706 -2.738 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -13.521 -7.191 -2.325 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -16.865 -9.795 -3.024 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -14.932 -5.220 -2.829 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -18.265 -7.842 -3.649 1.00 0.00 H new ATOM 0 HH TYR A 45 -16.945 -4.630 -4.004 1.00 0.00 H new ATOM 269 N GLY A 46 -12.049 -11.392 -0.687 1.00 0.00 N ATOM 270 CA GLY A 46 -11.218 -12.536 -0.365 1.00 0.00 C ATOM 271 C GLY A 46 -9.885 -12.469 -1.086 1.00 0.00 C ATOM 272 O GLY A 46 -9.811 -12.040 -2.235 1.00 0.00 O ATOM 0 H GLY A 46 -11.534 -10.604 -1.079 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -11.050 -12.575 0.711 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -11.737 -13.454 -0.640 1.00 0.00 H new ATOM 276 N LYS A 47 -8.817 -12.925 -0.429 1.00 0.00 N ATOM 277 CA LYS A 47 -7.535 -13.144 -1.078 1.00 0.00 C ATOM 278 C LYS A 47 -7.748 -14.198 -2.144 1.00 0.00 C ATOM 279 O LYS A 47 -8.152 -15.298 -1.773 1.00 0.00 O ATOM 280 CB LYS A 47 -6.525 -13.624 -0.032 1.00 0.00 C ATOM 281 CG LYS A 47 -5.104 -13.771 -0.595 1.00 0.00 C ATOM 282 CD LYS A 47 -4.340 -12.463 -0.383 1.00 0.00 C ATOM 283 CE LYS A 47 -2.965 -12.394 -1.023 1.00 0.00 C ATOM 284 NZ LYS A 47 -3.028 -12.069 -2.466 1.00 0.00 N ATOM 0 H LYS A 47 -8.822 -13.151 0.566 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.149 -12.231 -1.531 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.509 -12.920 0.800 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.853 -14.583 0.368 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.587 -14.592 -0.099 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.144 -14.014 -1.657 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.944 -11.643 -0.773 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -4.231 -12.297 0.689 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.366 -11.641 -0.510 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.458 -13.350 -0.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.282 -12.588 -2.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.957 -12.344 -2.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.890 -11.047 -2.598 1.00 0.00 H new ATOM 298 N ARG A 48 -7.305 -13.963 -3.380 1.00 0.00 N ATOM 299 CA ARG A 48 -7.988 -14.264 -4.640 1.00 0.00 C ATOM 300 C ARG A 48 -9.103 -15.297 -4.554 1.00 0.00 C ATOM 301 O ARG A 48 -10.242 -14.953 -4.837 1.00 0.00 O ATOM 302 CB ARG A 48 -6.996 -14.585 -5.775 1.00 0.00 C ATOM 303 CG ARG A 48 -5.918 -13.505 -5.958 1.00 0.00 C ATOM 304 CD ARG A 48 -5.099 -13.703 -7.236 1.00 0.00 C ATOM 305 NE ARG A 48 -3.937 -12.795 -7.246 1.00 0.00 N ATOM 306 CZ ARG A 48 -2.678 -13.087 -7.590 1.00 0.00 C ATOM 307 NH1 ARG A 48 -2.373 -14.288 -8.077 1.00 0.00 N ATOM 308 NH2 ARG A 48 -1.730 -12.170 -7.419 1.00 0.00 N ATOM 0 H ARG A 48 -6.397 -13.527 -3.538 1.00 0.00 H new ATOM 0 HA ARG A 48 -8.503 -13.335 -4.886 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -6.513 -15.540 -5.568 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -7.547 -14.702 -6.708 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.392 -12.524 -5.983 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -5.250 -13.514 -5.097 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -4.761 -14.737 -7.303 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -5.724 -13.515 -8.109 1.00 0.00 H new ATOM 0 HE ARG A 48 -4.114 -11.833 -6.957 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -3.102 -14.993 -8.190 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -1.411 -14.503 -8.337 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -1.967 -11.258 -7.030 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -0.766 -12.379 -7.677 1.00 0.00 H new ATOM 322 N GLU A 49 -8.781 -16.546 -4.213 1.00 0.00 N ATOM 323 CA GLU A 49 -9.805 -17.508 -3.841 1.00 0.00 C ATOM 324 C GLU A 49 -10.208 -17.257 -2.391 1.00 0.00 C ATOM 325 O GLU A 49 -11.184 -16.547 -2.159 1.00 0.00 O ATOM 326 CB GLU A 49 -9.354 -18.952 -4.087 1.00 0.00 C ATOM 327 CG GLU A 49 -9.132 -19.189 -5.580 1.00 0.00 C ATOM 328 CD GLU A 49 -9.163 -20.673 -5.910 1.00 0.00 C ATOM 329 OE1 GLU A 49 -10.262 -21.264 -5.948 1.00 0.00 O ATOM 330 OE2 GLU A 49 -8.089 -21.279 -6.113 1.00 0.00 O ATOM 0 H GLU A 49 -7.827 -16.907 -4.188 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.680 -17.370 -4.477 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -8.433 -19.151 -3.539 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -10.106 -19.645 -3.709 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -9.901 -18.670 -6.152 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -8.173 -18.767 -5.880 1.00 0.00 H new ATOM 337 N THR A 50 -9.502 -17.840 -1.413 1.00 0.00 N ATOM 338 CA THR A 50 -9.956 -17.811 -0.024 1.00 0.00 C ATOM 339 C THR A 50 -8.842 -18.185 0.981 1.00 0.00 C ATOM 340 O THR A 50 -9.124 -18.525 2.126 1.00 0.00 O ATOM 341 CB THR A 50 -11.245 -18.661 0.100 1.00 0.00 C ATOM 342 OG1 THR A 50 -11.903 -18.384 1.315 1.00 0.00 O ATOM 343 CG2 THR A 50 -10.998 -20.158 -0.095 1.00 0.00 C ATOM 0 H THR A 50 -8.621 -18.333 -1.560 1.00 0.00 H new ATOM 0 HA THR A 50 -10.207 -16.787 0.254 1.00 0.00 H new ATOM 0 HB THR A 50 -11.903 -18.369 -0.718 1.00 0.00 H new ATOM 0 HG1 THR A 50 -11.243 -18.311 2.035 1.00 0.00 H new ATOM 0 HG21 THR A 50 -11.940 -20.698 0.004 1.00 0.00 H new ATOM 0 HG22 THR A 50 -10.582 -20.332 -1.088 1.00 0.00 H new ATOM 0 HG23 THR A 50 -10.296 -20.512 0.660 1.00 0.00 H new ATOM 351 N GLN A 51 -7.559 -18.164 0.589 1.00 0.00 N ATOM 352 CA GLN A 51 -6.477 -18.725 1.400 1.00 0.00 C ATOM 353 C GLN A 51 -6.395 -18.080 2.791 1.00 0.00 C ATOM 354 O GLN A 51 -6.418 -18.791 3.794 1.00 0.00 O ATOM 355 CB GLN A 51 -5.141 -18.669 0.639 1.00 0.00 C ATOM 356 CG GLN A 51 -4.851 -17.348 -0.102 1.00 0.00 C ATOM 357 CD GLN A 51 -4.964 -17.498 -1.618 1.00 0.00 C ATOM 358 OE1 GLN A 51 -4.163 -18.199 -2.226 1.00 0.00 O ATOM 359 NE2 GLN A 51 -5.935 -16.882 -2.272 1.00 0.00 N ATOM 0 H GLN A 51 -7.248 -17.759 -0.294 1.00 0.00 H new ATOM 0 HA GLN A 51 -6.706 -19.776 1.579 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -4.332 -18.853 1.346 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -5.122 -19.483 -0.086 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -5.548 -16.582 0.238 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -3.849 -17.003 0.153 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -6.601 -16.299 -1.765 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -6.018 -16.990 -3.283 1.00 0.00 H new ATOM 368 N GLN A 52 -6.319 -16.749 2.858 1.00 0.00 N ATOM 369 CA GLN A 52 -6.448 -15.995 4.095 1.00 0.00 C ATOM 370 C GLN A 52 -6.604 -14.515 3.764 1.00 0.00 C ATOM 371 O GLN A 52 -5.863 -13.959 2.947 1.00 0.00 O ATOM 372 CB GLN A 52 -5.259 -16.201 5.054 1.00 0.00 C ATOM 373 CG GLN A 52 -3.862 -16.019 4.437 1.00 0.00 C ATOM 374 CD GLN A 52 -3.265 -17.303 3.860 1.00 0.00 C ATOM 375 OE1 GLN A 52 -3.301 -18.365 4.474 1.00 0.00 O ATOM 376 NE2 GLN A 52 -2.660 -17.240 2.684 1.00 0.00 N ATOM 0 H GLN A 52 -6.164 -16.161 2.039 1.00 0.00 H new ATOM 0 HA GLN A 52 -7.331 -16.367 4.614 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -5.362 -15.503 5.885 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -5.323 -17.206 5.471 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.920 -15.270 3.647 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.188 -15.627 5.199 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -2.629 -16.358 2.173 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -2.224 -18.074 2.289 1.00 0.00 H new ATOM 385 N MET A 53 -7.541 -13.880 4.448 1.00 0.00 N ATOM 386 CA MET A 53 -7.643 -12.435 4.585 1.00 0.00 C ATOM 387 C MET A 53 -6.541 -11.993 5.568 1.00 0.00 C ATOM 388 O MET A 53 -5.983 -12.844 6.273 1.00 0.00 O ATOM 389 CB MET A 53 -9.063 -12.102 5.069 1.00 0.00 C ATOM 390 CG MET A 53 -10.097 -12.704 4.106 1.00 0.00 C ATOM 391 SD MET A 53 -11.732 -11.953 4.173 1.00 0.00 S ATOM 392 CE MET A 53 -11.396 -10.477 3.184 1.00 0.00 C ATOM 0 H MET A 53 -8.282 -14.376 4.943 1.00 0.00 H new ATOM 0 HA MET A 53 -7.491 -11.900 3.647 1.00 0.00 H new ATOM 0 HB2 MET A 53 -9.216 -12.496 6.074 1.00 0.00 H new ATOM 0 HB3 MET A 53 -9.193 -11.021 5.127 1.00 0.00 H new ATOM 0 HG2 MET A 53 -9.716 -12.618 3.088 1.00 0.00 H new ATOM 0 HG3 MET A 53 -10.194 -13.768 4.321 1.00 0.00 H new ATOM 0 HE1 MET A 53 -12.274 -9.832 3.184 1.00 0.00 H new ATOM 0 HE2 MET A 53 -10.550 -9.938 3.610 1.00 0.00 H new ATOM 0 HE3 MET A 53 -11.161 -10.770 2.161 1.00 0.00 H new ATOM 402 N PRO A 54 -6.151 -10.709 5.616 1.00 0.00 N ATOM 403 CA PRO A 54 -5.085 -10.285 6.515 1.00 0.00 C ATOM 404 C PRO A 54 -5.568 -10.284 7.973 1.00 0.00 C ATOM 405 O PRO A 54 -6.769 -10.259 8.249 1.00 0.00 O ATOM 406 CB PRO A 54 -4.688 -8.891 6.027 1.00 0.00 C ATOM 407 CG PRO A 54 -5.985 -8.344 5.429 1.00 0.00 C ATOM 408 CD PRO A 54 -6.686 -9.579 4.868 1.00 0.00 C ATOM 0 HA PRO A 54 -4.230 -10.961 6.500 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -4.327 -8.266 6.844 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -3.891 -8.937 5.285 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -6.594 -7.848 6.185 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -5.786 -7.610 4.648 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -7.767 -9.505 4.990 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -6.492 -9.689 3.801 1.00 0.00 H new ATOM 416 N GLU A 55 -4.623 -10.268 8.905 1.00 0.00 N ATOM 417 CA GLU A 55 -4.840 -9.980 10.307 1.00 0.00 C ATOM 418 C GLU A 55 -4.950 -8.460 10.472 1.00 0.00 C ATOM 419 O GLU A 55 -4.201 -7.698 9.865 1.00 0.00 O ATOM 420 CB GLU A 55 -3.631 -10.495 11.117 1.00 0.00 C ATOM 421 CG GLU A 55 -3.788 -11.920 11.664 1.00 0.00 C ATOM 422 CD GLU A 55 -3.104 -12.022 13.030 1.00 0.00 C ATOM 423 OE1 GLU A 55 -1.879 -12.282 13.084 1.00 0.00 O ATOM 424 OE2 GLU A 55 -3.799 -11.777 14.046 1.00 0.00 O ATOM 0 H GLU A 55 -3.645 -10.464 8.690 1.00 0.00 H new ATOM 0 HA GLU A 55 -5.749 -10.465 10.662 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.744 -10.459 10.484 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -3.455 -9.817 11.952 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -4.845 -12.171 11.755 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -3.348 -12.637 10.971 1.00 0.00 H new ATOM 431 N VAL A 56 -5.807 -8.008 11.382 1.00 0.00 N ATOM 432 CA VAL A 56 -5.853 -6.624 11.874 1.00 0.00 C ATOM 433 C VAL A 56 -4.667 -6.334 12.820 1.00 0.00 C ATOM 434 O VAL A 56 -4.516 -5.257 13.388 1.00 0.00 O ATOM 435 CB VAL A 56 -7.276 -6.352 12.404 1.00 0.00 C ATOM 436 CG1 VAL A 56 -7.767 -7.311 13.490 1.00 0.00 C ATOM 437 CG2 VAL A 56 -7.449 -4.923 12.896 1.00 0.00 C ATOM 0 H VAL A 56 -6.511 -8.607 11.813 1.00 0.00 H new ATOM 0 HA VAL A 56 -5.696 -5.889 11.084 1.00 0.00 H new ATOM 0 HB VAL A 56 -7.897 -6.525 11.525 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.776 -7.032 13.792 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.773 -8.329 13.101 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.102 -7.256 14.352 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.468 -4.784 13.258 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -6.746 -4.730 13.706 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.258 -4.230 12.076 1.00 0.00 H new ATOM 447 N GLY A 57 -3.810 -7.323 13.027 1.00 0.00 N ATOM 448 CA GLY A 57 -2.615 -7.268 13.844 1.00 0.00 C ATOM 449 C GLY A 57 -1.312 -7.395 13.064 1.00 0.00 C ATOM 450 O GLY A 57 -0.294 -7.616 13.726 1.00 0.00 O ATOM 0 H GLY A 57 -3.942 -8.240 12.601 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -2.606 -6.325 14.391 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -2.660 -8.066 14.585 1.00 0.00 H new ATOM 454 N GLN A 58 -1.287 -7.321 11.724 1.00 0.00 N ATOM 455 CA GLN A 58 -0.062 -7.582 10.963 1.00 0.00 C ATOM 456 C GLN A 58 0.263 -6.436 10.003 1.00 0.00 C ATOM 457 O GLN A 58 -0.581 -5.589 9.694 1.00 0.00 O ATOM 458 CB GLN A 58 -0.181 -8.926 10.211 1.00 0.00 C ATOM 459 CG GLN A 58 -1.165 -8.824 9.042 1.00 0.00 C ATOM 460 CD GLN A 58 -1.170 -9.995 8.089 1.00 0.00 C ATOM 461 OE1 GLN A 58 -2.023 -10.868 8.100 1.00 0.00 O ATOM 462 NE2 GLN A 58 -0.272 -9.967 7.143 1.00 0.00 N ATOM 0 H GLN A 58 -2.097 -7.084 11.151 1.00 0.00 H new ATOM 0 HA GLN A 58 0.767 -7.650 11.667 1.00 0.00 H new ATOM 0 HB2 GLN A 58 0.799 -9.225 9.839 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.511 -9.703 10.900 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -2.170 -8.703 9.446 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.938 -7.920 8.477 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.439 -9.236 7.137 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -0.281 -10.676 6.410 1.00 0.00 H new ATOM 471 N ARG A 59 1.469 -6.498 9.438 1.00 0.00 N ATOM 472 CA ARG A 59 1.835 -5.750 8.244 1.00 0.00 C ATOM 473 C ARG A 59 1.383 -6.469 6.977 1.00 0.00 C ATOM 474 O ARG A 59 1.335 -7.700 6.948 1.00 0.00 O ATOM 475 CB ARG A 59 3.344 -5.485 8.242 1.00 0.00 C ATOM 476 CG ARG A 59 4.156 -6.770 8.064 1.00 0.00 C ATOM 477 CD ARG A 59 5.618 -6.478 8.358 1.00 0.00 C ATOM 478 NE ARG A 59 6.412 -7.698 8.198 1.00 0.00 N ATOM 479 CZ ARG A 59 6.646 -8.614 9.142 1.00 0.00 C ATOM 480 NH1 ARG A 59 6.123 -8.527 10.362 1.00 0.00 N ATOM 481 NH2 ARG A 59 7.442 -9.622 8.829 1.00 0.00 N ATOM 0 H ARG A 59 2.225 -7.077 9.804 1.00 0.00 H new ATOM 0 HA ARG A 59 1.318 -4.790 8.258 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.588 -4.789 7.439 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.628 -5.004 9.178 1.00 0.00 H new ATOM 0 HG2 ARG A 59 3.785 -7.545 8.734 1.00 0.00 H new ATOM 0 HG3 ARG A 59 4.045 -7.148 7.048 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.986 -5.704 7.685 1.00 0.00 H new ATOM 0 HD3 ARG A 59 5.724 -6.095 9.373 1.00 0.00 H new ATOM 0 HE ARG A 59 6.825 -7.864 7.280 1.00 0.00 H new ATOM 0 HH11 ARG A 59 5.520 -7.741 10.603 1.00 0.00 H new ATOM 0 HH12 ARG A 59 6.325 -9.247 11.056 1.00 0.00 H new ATOM 0 HH21 ARG A 59 7.851 -9.678 7.896 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.647 -10.343 9.520 1.00 0.00 H new ATOM 495 N LEU A 60 1.085 -5.728 5.914 1.00 0.00 N ATOM 496 CA LEU A 60 0.802 -6.204 4.573 1.00 0.00 C ATOM 497 C LEU A 60 1.099 -5.078 3.578 1.00 0.00 C ATOM 498 O LEU A 60 1.658 -4.043 3.935 1.00 0.00 O ATOM 499 CB LEU A 60 -0.629 -6.771 4.442 1.00 0.00 C ATOM 500 CG LEU A 60 -1.864 -5.995 4.942 1.00 0.00 C ATOM 501 CD1 LEU A 60 -1.935 -5.957 6.453 1.00 0.00 C ATOM 502 CD2 LEU A 60 -2.068 -4.584 4.396 1.00 0.00 C ATOM 0 H LEU A 60 1.033 -4.711 5.976 1.00 0.00 H new ATOM 0 HA LEU A 60 1.453 -7.047 4.343 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.792 -6.972 3.383 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -0.634 -7.733 4.954 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.682 -6.583 4.525 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.820 -5.401 6.762 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.992 -6.974 6.840 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.044 -5.469 6.847 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -2.971 -4.153 4.829 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.210 -3.965 4.657 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.169 -4.625 3.311 1.00 0.00 H new ATOM 514 N ARG A 61 0.750 -5.283 2.308 1.00 0.00 N ATOM 515 CA ARG A 61 0.780 -4.263 1.269 1.00 0.00 C ATOM 516 C ARG A 61 -0.491 -4.372 0.457 1.00 0.00 C ATOM 517 O ARG A 61 -1.043 -5.467 0.327 1.00 0.00 O ATOM 518 CB ARG A 61 2.060 -4.307 0.398 1.00 0.00 C ATOM 519 CG ARG A 61 2.848 -5.619 0.326 1.00 0.00 C ATOM 520 CD ARG A 61 4.320 -5.410 -0.054 1.00 0.00 C ATOM 521 NE ARG A 61 4.531 -4.951 -1.438 1.00 0.00 N ATOM 522 CZ ARG A 61 5.271 -5.569 -2.371 1.00 0.00 C ATOM 523 NH1 ARG A 61 5.854 -6.740 -2.118 1.00 0.00 N ATOM 524 NH2 ARG A 61 5.418 -5.020 -3.570 1.00 0.00 N ATOM 0 H ARG A 61 0.430 -6.190 1.968 1.00 0.00 H new ATOM 0 HA ARG A 61 0.823 -3.282 1.742 1.00 0.00 H new ATOM 0 HB2 ARG A 61 1.779 -4.032 -0.619 1.00 0.00 H new ATOM 0 HB3 ARG A 61 2.736 -3.533 0.762 1.00 0.00 H new ATOM 0 HG2 ARG A 61 2.795 -6.123 1.291 1.00 0.00 H new ATOM 0 HG3 ARG A 61 2.379 -6.279 -0.404 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.759 -4.682 0.628 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.857 -6.347 0.091 1.00 0.00 H new ATOM 0 HE ARG A 61 4.072 -4.083 -1.712 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.741 -7.179 -1.204 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.413 -7.197 -2.838 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.969 -4.129 -3.782 1.00 0.00 H new ATOM 0 HH22 ARG A 61 5.980 -5.489 -4.280 1.00 0.00 H new ATOM 538 N VAL A 62 -0.943 -3.249 -0.082 1.00 0.00 N ATOM 539 CA VAL A 62 -2.124 -3.127 -0.916 1.00 0.00 C ATOM 540 C VAL A 62 -1.689 -2.497 -2.235 1.00 0.00 C ATOM 541 O VAL A 62 -0.824 -1.625 -2.231 1.00 0.00 O ATOM 542 CB VAL A 62 -3.187 -2.289 -0.174 1.00 0.00 C ATOM 543 CG1 VAL A 62 -4.417 -1.994 -1.041 1.00 0.00 C ATOM 544 CG2 VAL A 62 -3.653 -3.033 1.079 1.00 0.00 C ATOM 0 H VAL A 62 -0.471 -2.356 0.059 1.00 0.00 H new ATOM 0 HA VAL A 62 -2.580 -4.094 -1.128 1.00 0.00 H new ATOM 0 HB VAL A 62 -2.714 -1.341 0.083 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.132 -1.402 -0.469 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.112 -1.438 -1.928 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.882 -2.932 -1.343 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -4.403 -2.437 1.598 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.086 -3.992 0.793 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.802 -3.202 1.739 1.00 0.00 H new ATOM 554 N GLY A 63 -2.309 -2.882 -3.346 1.00 0.00 N ATOM 555 CA GLY A 63 -2.230 -2.168 -4.609 1.00 0.00 C ATOM 556 C GLY A 63 -3.628 -1.790 -5.040 1.00 0.00 C ATOM 557 O GLY A 63 -4.485 -2.671 -5.124 1.00 0.00 O ATOM 0 H GLY A 63 -2.892 -3.718 -3.391 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -1.614 -1.276 -4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -1.757 -2.792 -5.367 1.00 0.00 H new ATOM 561 N GLY A 64 -3.875 -0.505 -5.279 1.00 0.00 N ATOM 562 CA GLY A 64 -5.201 -0.004 -5.631 1.00 0.00 C ATOM 563 C GLY A 64 -5.139 1.352 -6.320 1.00 0.00 C ATOM 564 O GLY A 64 -4.120 2.039 -6.256 1.00 0.00 O ATOM 0 H GLY A 64 -3.159 0.220 -5.234 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -5.696 -0.720 -6.287 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -5.809 0.076 -4.730 1.00 0.00 H new ATOM 568 N MET A 65 -6.231 1.751 -6.969 1.00 0.00 N ATOM 569 CA MET A 65 -6.305 2.935 -7.812 1.00 0.00 C ATOM 570 C MET A 65 -6.852 4.113 -7.020 1.00 0.00 C ATOM 571 O MET A 65 -7.904 3.981 -6.410 1.00 0.00 O ATOM 572 CB MET A 65 -7.154 2.632 -9.047 1.00 0.00 C ATOM 573 CG MET A 65 -6.741 3.566 -10.191 1.00 0.00 C ATOM 574 SD MET A 65 -7.429 3.224 -11.828 1.00 0.00 S ATOM 575 CE MET A 65 -7.216 1.429 -11.899 1.00 0.00 C ATOM 0 H MET A 65 -7.113 1.242 -6.919 1.00 0.00 H new ATOM 0 HA MET A 65 -5.306 3.210 -8.150 1.00 0.00 H new ATOM 0 HB2 MET A 65 -7.022 1.592 -9.346 1.00 0.00 H new ATOM 0 HB3 MET A 65 -8.211 2.766 -8.817 1.00 0.00 H new ATOM 0 HG2 MET A 65 -7.019 4.583 -9.914 1.00 0.00 H new ATOM 0 HG3 MET A 65 -5.654 3.543 -10.270 1.00 0.00 H new ATOM 0 HE1 MET A 65 -7.267 1.097 -12.936 1.00 0.00 H new ATOM 0 HE2 MET A 65 -6.247 1.161 -11.479 1.00 0.00 H new ATOM 0 HE3 MET A 65 -8.006 0.946 -11.325 1.00 0.00 H new ATOM 585 N VAL A 66 -6.131 5.231 -6.916 1.00 0.00 N ATOM 586 CA VAL A 66 -6.553 6.313 -6.026 1.00 0.00 C ATOM 587 C VAL A 66 -7.792 6.998 -6.585 1.00 0.00 C ATOM 588 O VAL A 66 -7.827 7.339 -7.760 1.00 0.00 O ATOM 589 CB VAL A 66 -5.397 7.265 -5.697 1.00 0.00 C ATOM 590 CG1 VAL A 66 -4.319 7.590 -6.677 1.00 0.00 C ATOM 591 CG2 VAL A 66 -5.767 8.470 -4.826 1.00 0.00 C ATOM 0 H VAL A 66 -5.267 5.409 -7.428 1.00 0.00 H new ATOM 0 HA VAL A 66 -6.842 5.893 -5.062 1.00 0.00 H new ATOM 0 HB VAL A 66 -4.865 6.518 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -3.611 8.283 -6.223 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -3.799 6.676 -6.962 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -4.759 8.049 -7.563 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -4.880 9.079 -4.652 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.524 9.068 -5.334 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -6.161 8.122 -3.871 1.00 0.00 H new ATOM 601 N MET A 67 -8.801 7.210 -5.748 1.00 0.00 N ATOM 602 CA MET A 67 -9.973 8.009 -6.075 1.00 0.00 C ATOM 603 C MET A 67 -9.579 9.457 -6.397 1.00 0.00 C ATOM 604 O MET A 67 -8.601 9.986 -5.859 1.00 0.00 O ATOM 605 CB MET A 67 -10.912 8.002 -4.870 1.00 0.00 C ATOM 606 CG MET A 67 -11.760 6.749 -4.748 1.00 0.00 C ATOM 607 SD MET A 67 -12.741 6.796 -3.239 1.00 0.00 S ATOM 608 CE MET A 67 -13.511 5.173 -3.361 1.00 0.00 C ATOM 0 H MET A 67 -8.826 6.823 -4.805 1.00 0.00 H new ATOM 0 HA MET A 67 -10.461 7.583 -6.952 1.00 0.00 H new ATOM 0 HB2 MET A 67 -10.320 8.116 -3.962 1.00 0.00 H new ATOM 0 HB3 MET A 67 -11.571 8.868 -4.932 1.00 0.00 H new ATOM 0 HG2 MET A 67 -12.417 6.662 -5.613 1.00 0.00 H new ATOM 0 HG3 MET A 67 -11.119 5.868 -4.745 1.00 0.00 H new ATOM 0 HE1 MET A 67 -14.123 4.994 -2.477 1.00 0.00 H new ATOM 0 HE2 MET A 67 -14.138 5.134 -4.251 1.00 0.00 H new ATOM 0 HE3 MET A 67 -12.738 4.408 -3.428 1.00 0.00 H new ATOM 618 N PRO A 68 -10.375 10.133 -7.235 1.00 0.00 N ATOM 619 CA PRO A 68 -10.196 11.531 -7.580 1.00 0.00 C ATOM 620 C PRO A 68 -10.456 12.397 -6.345 1.00 0.00 C ATOM 621 O PRO A 68 -11.597 12.548 -5.898 1.00 0.00 O ATOM 622 CB PRO A 68 -11.162 11.793 -8.740 1.00 0.00 C ATOM 623 CG PRO A 68 -12.235 10.711 -8.600 1.00 0.00 C ATOM 624 CD PRO A 68 -11.564 9.582 -7.858 1.00 0.00 C ATOM 0 HA PRO A 68 -9.183 11.780 -7.895 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -11.595 12.791 -8.678 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -10.654 11.726 -9.702 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -13.100 11.083 -8.052 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -12.593 10.383 -9.576 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -12.233 9.162 -7.107 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -11.303 8.773 -8.540 1.00 0.00 H new ATOM 632 N GLY A 69 -9.384 12.940 -5.766 1.00 0.00 N ATOM 633 CA GLY A 69 -9.474 13.830 -4.621 1.00 0.00 C ATOM 634 C GLY A 69 -9.982 13.140 -3.362 1.00 0.00 C ATOM 635 O GLY A 69 -10.720 13.768 -2.610 1.00 0.00 O ATOM 0 H GLY A 69 -8.429 12.771 -6.083 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -8.491 14.256 -4.422 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -10.137 14.660 -4.865 1.00 0.00 H new ATOM 639 N SER A 70 -9.620 11.876 -3.116 1.00 0.00 N ATOM 640 CA SER A 70 -9.744 11.291 -1.778 1.00 0.00 C ATOM 641 C SER A 70 -8.579 11.693 -0.869 1.00 0.00 C ATOM 642 O SER A 70 -8.619 11.458 0.339 1.00 0.00 O ATOM 643 CB SER A 70 -9.773 9.770 -1.891 1.00 0.00 C ATOM 644 OG SER A 70 -8.617 9.295 -2.580 1.00 0.00 O ATOM 0 H SER A 70 -9.242 11.243 -3.821 1.00 0.00 H new ATOM 0 HA SER A 70 -10.668 11.666 -1.338 1.00 0.00 H new ATOM 0 HB2 SER A 70 -9.818 9.327 -0.896 1.00 0.00 H new ATOM 0 HB3 SER A 70 -10.673 9.456 -2.420 1.00 0.00 H new ATOM 0 HG SER A 70 -8.678 8.323 -2.689 1.00 0.00 H new ATOM 650 N VAL A 71 -7.495 12.206 -1.447 1.00 0.00 N ATOM 651 CA VAL A 71 -6.231 12.420 -0.777 1.00 0.00 C ATOM 652 C VAL A 71 -6.268 13.736 0.007 1.00 0.00 C ATOM 653 O VAL A 71 -6.023 14.823 -0.518 1.00 0.00 O ATOM 654 CB VAL A 71 -5.071 12.200 -1.772 1.00 0.00 C ATOM 655 CG1 VAL A 71 -5.341 12.751 -3.163 1.00 0.00 C ATOM 656 CG2 VAL A 71 -3.709 12.623 -1.233 1.00 0.00 C ATOM 0 H VAL A 71 -7.480 12.491 -2.426 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.040 11.679 -0.000 1.00 0.00 H new ATOM 0 HB VAL A 71 -5.022 11.117 -1.887 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.481 12.558 -3.804 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -6.222 12.265 -3.582 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -5.514 13.825 -3.102 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.945 12.438 -1.988 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.728 13.685 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -3.478 12.049 -0.336 1.00 0.00 H new ATOM 666 N GLN A 72 -6.571 13.618 1.298 1.00 0.00 N ATOM 667 CA GLN A 72 -6.425 14.655 2.298 1.00 0.00 C ATOM 668 C GLN A 72 -4.957 14.673 2.729 1.00 0.00 C ATOM 669 O GLN A 72 -4.592 14.095 3.753 1.00 0.00 O ATOM 670 CB GLN A 72 -7.443 14.443 3.446 1.00 0.00 C ATOM 671 CG GLN A 72 -7.440 13.146 4.258 1.00 0.00 C ATOM 672 CD GLN A 72 -7.228 13.405 5.751 1.00 0.00 C ATOM 673 OE1 GLN A 72 -8.118 13.231 6.576 1.00 0.00 O ATOM 674 NE2 GLN A 72 -6.028 13.804 6.125 1.00 0.00 N ATOM 0 H GLN A 72 -6.943 12.751 1.687 1.00 0.00 H new ATOM 0 HA GLN A 72 -6.662 15.645 1.907 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -7.309 15.264 4.151 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -8.439 14.551 3.017 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -8.386 12.624 4.111 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -6.653 12.489 3.889 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -5.297 13.945 5.428 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -5.831 13.972 7.112 1.00 0.00 H new ATOM 683 N ARG A 73 -4.070 15.273 1.931 1.00 0.00 N ATOM 684 CA ARG A 73 -2.767 15.711 2.453 1.00 0.00 C ATOM 685 C ARG A 73 -3.037 16.892 3.361 1.00 0.00 C ATOM 686 O ARG A 73 -3.878 17.731 3.029 1.00 0.00 O ATOM 687 CB ARG A 73 -1.721 16.051 1.373 1.00 0.00 C ATOM 688 CG ARG A 73 -2.303 16.417 0.012 1.00 0.00 C ATOM 689 CD ARG A 73 -1.235 16.979 -0.931 1.00 0.00 C ATOM 690 NE ARG A 73 -1.154 18.444 -0.837 1.00 0.00 N ATOM 691 CZ ARG A 73 -0.070 19.204 -0.660 1.00 0.00 C ATOM 692 NH1 ARG A 73 1.123 18.692 -0.380 1.00 0.00 N ATOM 693 NH2 ARG A 73 -0.198 20.520 -0.752 1.00 0.00 N ATOM 0 H ARG A 73 -4.222 15.465 0.941 1.00 0.00 H new ATOM 0 HA ARG A 73 -2.311 14.880 2.992 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -1.111 16.882 1.727 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -1.055 15.197 1.250 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -2.757 15.534 -0.438 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -3.097 17.153 0.142 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -0.266 16.543 -0.687 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -1.465 16.691 -1.957 1.00 0.00 H new ATOM 0 HE ARG A 73 -2.039 18.944 -0.917 1.00 0.00 H new ATOM 0 HH11 ARG A 73 1.237 17.682 -0.293 1.00 0.00 H new ATOM 0 HH12 ARG A 73 1.925 19.309 -0.252 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.109 20.931 -0.954 1.00 0.00 H new ATOM 0 HH22 ARG A 73 0.615 21.122 -0.621 1.00 0.00 H new ATOM 707 N ASP A 74 -2.362 16.959 4.505 1.00 0.00 N ATOM 708 CA ASP A 74 -2.398 18.161 5.315 1.00 0.00 C ATOM 709 C ASP A 74 -1.559 19.164 4.524 1.00 0.00 C ATOM 710 O ASP A 74 -0.379 18.877 4.296 1.00 0.00 O ATOM 711 CB ASP A 74 -1.772 17.914 6.694 1.00 0.00 C ATOM 712 CG ASP A 74 -2.315 18.851 7.777 1.00 0.00 C ATOM 713 OD1 ASP A 74 -3.331 19.540 7.567 1.00 0.00 O ATOM 714 OD2 ASP A 74 -1.710 18.907 8.869 1.00 0.00 O ATOM 0 H ASP A 74 -1.792 16.203 4.884 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.415 18.507 5.499 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.956 16.881 6.990 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -0.691 18.038 6.623 1.00 0.00 H new ATOM 719 N PRO A 75 -2.101 20.286 4.031 1.00 0.00 N ATOM 720 CA PRO A 75 -1.412 21.121 3.045 1.00 0.00 C ATOM 721 C PRO A 75 -0.204 21.883 3.620 1.00 0.00 C ATOM 722 O PRO A 75 0.475 22.607 2.891 1.00 0.00 O ATOM 723 CB PRO A 75 -2.502 22.052 2.512 1.00 0.00 C ATOM 724 CG PRO A 75 -3.447 22.199 3.700 1.00 0.00 C ATOM 725 CD PRO A 75 -3.432 20.802 4.310 1.00 0.00 C ATOM 0 HA PRO A 75 -0.962 20.518 2.256 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.094 23.014 2.201 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -3.008 21.625 1.646 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -3.098 22.953 4.405 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -4.449 22.494 3.387 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.625 20.837 5.382 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -4.202 20.169 3.868 1.00 0.00 H new ATOM 733 N ASN A 76 0.052 21.739 4.921 1.00 0.00 N ATOM 734 CA ASN A 76 1.118 22.352 5.703 1.00 0.00 C ATOM 735 C ASN A 76 1.749 21.358 6.700 1.00 0.00 C ATOM 736 O ASN A 76 2.642 21.745 7.461 1.00 0.00 O ATOM 737 CB ASN A 76 0.598 23.612 6.422 1.00 0.00 C ATOM 738 CG ASN A 76 -0.845 23.515 6.907 1.00 0.00 C ATOM 739 OD1 ASN A 76 -1.274 22.470 7.378 1.00 0.00 O ATOM 740 ND2 ASN A 76 -1.647 24.557 6.744 1.00 0.00 N ATOM 0 H ASN A 76 -0.534 21.138 5.501 1.00 0.00 H new ATOM 0 HA ASN A 76 1.908 22.648 5.013 1.00 0.00 H new ATOM 0 HB2 ASN A 76 1.242 23.819 7.277 1.00 0.00 H new ATOM 0 HB3 ASN A 76 0.684 24.462 5.745 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -2.629 24.492 7.012 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -1.282 25.425 6.351 1.00 0.00 H new ATOM 747 N SER A 77 1.363 20.083 6.670 1.00 0.00 N ATOM 748 CA SER A 77 2.052 18.960 7.314 1.00 0.00 C ATOM 749 C SER A 77 2.445 17.937 6.241 1.00 0.00 C ATOM 750 O SER A 77 2.550 18.281 5.059 1.00 0.00 O ATOM 751 CB SER A 77 1.219 18.350 8.454 1.00 0.00 C ATOM 752 OG SER A 77 2.054 17.634 9.334 1.00 0.00 O ATOM 0 H SER A 77 0.522 19.789 6.173 1.00 0.00 H new ATOM 0 HA SER A 77 2.963 19.319 7.793 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.698 19.139 8.996 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.457 17.688 8.044 1.00 0.00 H new ATOM 0 HG SER A 77 1.515 17.251 10.057 1.00 0.00 H new ATOM 758 N LEU A 78 2.729 16.704 6.665 1.00 0.00 N ATOM 759 CA LEU A 78 3.069 15.557 5.823 1.00 0.00 C ATOM 760 C LEU A 78 2.134 14.388 6.109 1.00 0.00 C ATOM 761 O LEU A 78 2.133 13.430 5.335 1.00 0.00 O ATOM 762 CB LEU A 78 4.523 15.076 6.015 1.00 0.00 C ATOM 763 CG LEU A 78 5.662 15.920 5.420 1.00 0.00 C ATOM 764 CD1 LEU A 78 5.592 15.988 3.893 1.00 0.00 C ATOM 765 CD2 LEU A 78 5.773 17.323 6.026 1.00 0.00 C ATOM 0 H LEU A 78 2.728 16.467 7.657 1.00 0.00 H new ATOM 0 HA LEU A 78 2.958 15.899 4.794 1.00 0.00 H new ATOM 0 HB2 LEU A 78 4.703 14.985 7.086 1.00 0.00 H new ATOM 0 HB3 LEU A 78 4.599 14.074 5.593 1.00 0.00 H new ATOM 0 HG LEU A 78 6.576 15.394 5.696 1.00 0.00 H new ATOM 0 HD11 LEU A 78 6.416 16.595 3.518 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.665 14.982 3.480 1.00 0.00 H new ATOM 0 HD13 LEU A 78 4.645 16.436 3.592 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.598 17.858 5.556 1.00 0.00 H new ATOM 0 HD22 LEU A 78 4.844 17.867 5.856 1.00 0.00 H new ATOM 0 HD23 LEU A 78 5.956 17.243 7.098 1.00 0.00 H new ATOM 777 N LYS A 79 1.298 14.457 7.157 1.00 0.00 N ATOM 778 CA LYS A 79 0.164 13.549 7.284 1.00 0.00 C ATOM 779 C LYS A 79 -0.621 13.677 5.994 1.00 0.00 C ATOM 780 O LYS A 79 -0.862 14.789 5.517 1.00 0.00 O ATOM 781 CB LYS A 79 -0.680 13.839 8.543 1.00 0.00 C ATOM 782 CG LYS A 79 -0.805 12.578 9.421 1.00 0.00 C ATOM 783 CD LYS A 79 -1.813 11.519 8.928 1.00 0.00 C ATOM 784 CE LYS A 79 -3.199 11.711 9.570 1.00 0.00 C ATOM 785 NZ LYS A 79 -4.114 10.564 9.355 1.00 0.00 N ATOM 0 H LYS A 79 1.391 15.129 7.919 1.00 0.00 H new ATOM 0 HA LYS A 79 0.494 12.520 7.425 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -0.220 14.643 9.117 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.672 14.183 8.250 1.00 0.00 H new ATOM 0 HG2 LYS A 79 0.177 12.111 9.497 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -1.091 12.885 10.427 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.903 11.579 7.843 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -1.438 10.523 9.162 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -3.076 11.871 10.641 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.657 12.613 9.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.033 10.766 9.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.247 10.412 8.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.705 9.709 9.782 1.00 0.00 H new ATOM 799 N VAL A 80 -0.920 12.550 5.375 1.00 0.00 N ATOM 800 CA VAL A 80 -1.739 12.490 4.189 1.00 0.00 C ATOM 801 C VAL A 80 -2.566 11.248 4.339 1.00 0.00 C ATOM 802 O VAL A 80 -2.116 10.244 4.890 1.00 0.00 O ATOM 803 CB VAL A 80 -0.903 12.528 2.898 1.00 0.00 C ATOM 804 CG1 VAL A 80 0.238 11.527 2.809 1.00 0.00 C ATOM 805 CG2 VAL A 80 -1.794 12.369 1.667 1.00 0.00 C ATOM 0 H VAL A 80 -0.592 11.637 5.692 1.00 0.00 H new ATOM 0 HA VAL A 80 -2.382 13.365 4.094 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.433 13.511 2.929 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.755 11.648 1.857 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.938 11.700 3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.160 10.515 2.880 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.180 12.399 0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.317 11.414 1.717 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.521 13.180 1.637 1.00 0.00 H new ATOM 815 N THR A 81 -3.807 11.277 3.906 1.00 0.00 N ATOM 816 CA THR A 81 -4.689 10.152 4.071 1.00 0.00 C ATOM 817 C THR A 81 -5.488 10.093 2.768 1.00 0.00 C ATOM 818 O THR A 81 -5.811 11.143 2.225 1.00 0.00 O ATOM 819 CB THR A 81 -5.379 10.390 5.421 1.00 0.00 C ATOM 820 OG1 THR A 81 -4.423 10.281 6.473 1.00 0.00 O ATOM 821 CG2 THR A 81 -6.502 9.434 5.690 1.00 0.00 C ATOM 0 H THR A 81 -4.227 12.077 3.433 1.00 0.00 H new ATOM 0 HA THR A 81 -4.286 9.144 4.168 1.00 0.00 H new ATOM 0 HB THR A 81 -5.807 11.392 5.378 1.00 0.00 H new ATOM 0 HG1 THR A 81 -4.036 11.163 6.656 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.946 9.658 6.660 1.00 0.00 H new ATOM 0 HG22 THR A 81 -7.259 9.534 4.913 1.00 0.00 H new ATOM 0 HG23 THR A 81 -6.118 8.414 5.693 1.00 0.00 H new ATOM 829 N PHE A 82 -5.649 8.926 2.143 1.00 0.00 N ATOM 830 CA PHE A 82 -6.315 8.827 0.845 1.00 0.00 C ATOM 831 C PHE A 82 -7.143 7.562 0.754 1.00 0.00 C ATOM 832 O PHE A 82 -7.072 6.715 1.641 1.00 0.00 O ATOM 833 CB PHE A 82 -5.322 9.010 -0.323 1.00 0.00 C ATOM 834 CG PHE A 82 -4.209 8.008 -0.593 1.00 0.00 C ATOM 835 CD1 PHE A 82 -2.978 8.141 0.080 1.00 0.00 C ATOM 836 CD2 PHE A 82 -4.328 7.019 -1.592 1.00 0.00 C ATOM 837 CE1 PHE A 82 -1.872 7.349 -0.258 1.00 0.00 C ATOM 838 CE2 PHE A 82 -3.243 6.178 -1.879 1.00 0.00 C ATOM 839 CZ PHE A 82 -2.002 6.355 -1.240 1.00 0.00 C ATOM 0 H PHE A 82 -5.326 8.034 2.517 1.00 0.00 H new ATOM 0 HA PHE A 82 -7.019 9.654 0.754 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -5.916 9.075 -1.235 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.846 9.980 -0.183 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -2.885 8.868 0.873 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.255 6.910 -2.136 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -0.924 7.503 0.235 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -3.362 5.383 -2.601 1.00 0.00 H new ATOM 0 HZ PHE A 82 -1.159 5.733 -1.502 1.00 0.00 H new ATOM 849 N THR A 83 -7.903 7.417 -0.326 1.00 0.00 N ATOM 850 CA THR A 83 -8.705 6.215 -0.546 1.00 0.00 C ATOM 851 C THR A 83 -8.384 5.699 -1.942 1.00 0.00 C ATOM 852 O THR A 83 -8.253 6.485 -2.891 1.00 0.00 O ATOM 853 CB THR A 83 -10.199 6.498 -0.304 1.00 0.00 C ATOM 854 OG1 THR A 83 -10.371 7.045 0.996 1.00 0.00 O ATOM 855 CG2 THR A 83 -11.090 5.260 -0.466 1.00 0.00 C ATOM 0 H THR A 83 -7.982 8.116 -1.064 1.00 0.00 H new ATOM 0 HA THR A 83 -8.457 5.431 0.170 1.00 0.00 H new ATOM 0 HB THR A 83 -10.514 7.208 -1.069 1.00 0.00 H new ATOM 0 HG1 THR A 83 -10.370 6.322 1.658 1.00 0.00 H new ATOM 0 HG21 THR A 83 -12.129 5.533 -0.281 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.992 4.871 -1.480 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.783 4.495 0.247 1.00 0.00 H new ATOM 863 N ILE A 84 -8.222 4.383 -2.038 1.00 0.00 N ATOM 864 CA ILE A 84 -7.851 3.636 -3.224 1.00 0.00 C ATOM 865 C ILE A 84 -8.948 2.586 -3.423 1.00 0.00 C ATOM 866 O ILE A 84 -9.510 2.092 -2.446 1.00 0.00 O ATOM 867 CB ILE A 84 -6.435 3.018 -3.089 1.00 0.00 C ATOM 868 CG1 ILE A 84 -5.942 2.861 -1.654 1.00 0.00 C ATOM 869 CG2 ILE A 84 -5.398 3.865 -3.836 1.00 0.00 C ATOM 870 CD1 ILE A 84 -4.683 1.988 -1.577 1.00 0.00 C ATOM 0 H ILE A 84 -8.357 3.773 -1.231 1.00 0.00 H new ATOM 0 HA ILE A 84 -7.784 4.280 -4.101 1.00 0.00 H new ATOM 0 HB ILE A 84 -6.537 2.022 -3.520 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.729 3.844 -1.233 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -6.730 2.417 -1.045 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -4.412 3.413 -3.727 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.661 3.913 -4.893 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -5.383 4.872 -3.420 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.364 1.901 -0.538 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -4.903 0.997 -1.974 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -3.887 2.445 -2.164 1.00 0.00 H new ATOM 882 N TYR A 85 -9.267 2.252 -4.668 1.00 0.00 N ATOM 883 CA TYR A 85 -10.327 1.325 -5.034 1.00 0.00 C ATOM 884 C TYR A 85 -9.812 0.355 -6.103 1.00 0.00 C ATOM 885 O TYR A 85 -8.671 0.470 -6.553 1.00 0.00 O ATOM 886 CB TYR A 85 -11.573 2.102 -5.491 1.00 0.00 C ATOM 887 CG TYR A 85 -11.415 2.781 -6.834 1.00 0.00 C ATOM 888 CD1 TYR A 85 -10.739 4.010 -6.931 1.00 0.00 C ATOM 889 CD2 TYR A 85 -11.876 2.146 -7.999 1.00 0.00 C ATOM 890 CE1 TYR A 85 -10.478 4.587 -8.183 1.00 0.00 C ATOM 891 CE2 TYR A 85 -11.623 2.717 -9.255 1.00 0.00 C ATOM 892 CZ TYR A 85 -10.921 3.939 -9.358 1.00 0.00 C ATOM 893 OH TYR A 85 -10.654 4.471 -10.581 1.00 0.00 O ATOM 0 H TYR A 85 -8.777 2.633 -5.477 1.00 0.00 H new ATOM 0 HA TYR A 85 -10.623 0.732 -4.169 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.419 1.416 -5.539 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -11.815 2.855 -4.741 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -10.417 4.515 -6.032 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -12.425 1.219 -7.928 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.941 5.522 -8.248 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.967 2.219 -10.150 1.00 0.00 H new ATOM 0 HH TYR A 85 -9.800 4.121 -10.911 1.00 0.00 H new ATOM 903 N ASP A 86 -10.639 -0.601 -6.505 1.00 0.00 N ATOM 904 CA ASP A 86 -10.375 -1.532 -7.606 1.00 0.00 C ATOM 905 C ASP A 86 -11.732 -1.953 -8.193 1.00 0.00 C ATOM 906 O ASP A 86 -12.769 -1.384 -7.840 1.00 0.00 O ATOM 907 CB ASP A 86 -9.527 -2.727 -7.099 1.00 0.00 C ATOM 908 CG ASP A 86 -8.885 -3.591 -8.202 1.00 0.00 C ATOM 909 OD1 ASP A 86 -9.060 -3.303 -9.411 1.00 0.00 O ATOM 910 OD2 ASP A 86 -8.180 -4.571 -7.870 1.00 0.00 O ATOM 0 H ASP A 86 -11.544 -0.759 -6.062 1.00 0.00 H new ATOM 0 HA ASP A 86 -9.788 -1.066 -8.398 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.736 -2.343 -6.454 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -10.160 -3.365 -6.482 1.00 0.00 H new ATOM 915 N ALA A 87 -11.756 -2.969 -9.054 1.00 0.00 N ATOM 916 CA ALA A 87 -12.928 -3.617 -9.632 1.00 0.00 C ATOM 917 C ALA A 87 -13.870 -4.238 -8.587 1.00 0.00 C ATOM 918 O ALA A 87 -14.848 -4.891 -8.957 1.00 0.00 O ATOM 919 CB ALA A 87 -12.435 -4.717 -10.584 1.00 0.00 C ATOM 0 H ALA A 87 -10.890 -3.391 -9.390 1.00 0.00 H new ATOM 0 HA ALA A 87 -13.508 -2.852 -10.148 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.291 -5.221 -11.033 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -11.824 -4.272 -11.369 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -11.840 -5.440 -10.027 1.00 0.00 H new ATOM 925 N GLU A 88 -13.587 -4.094 -7.295 1.00 0.00 N ATOM 926 CA GLU A 88 -14.182 -4.863 -6.220 1.00 0.00 C ATOM 927 C GLU A 88 -14.747 -3.874 -5.195 1.00 0.00 C ATOM 928 O GLU A 88 -15.965 -3.705 -5.121 1.00 0.00 O ATOM 929 CB GLU A 88 -13.178 -5.862 -5.605 1.00 0.00 C ATOM 930 CG GLU A 88 -11.907 -6.194 -6.404 1.00 0.00 C ATOM 931 CD GLU A 88 -12.048 -7.189 -7.551 1.00 0.00 C ATOM 932 OE1 GLU A 88 -13.139 -7.769 -7.762 1.00 0.00 O ATOM 933 OE2 GLU A 88 -11.020 -7.427 -8.226 1.00 0.00 O ATOM 0 H GLU A 88 -12.909 -3.409 -6.961 1.00 0.00 H new ATOM 0 HA GLU A 88 -14.993 -5.483 -6.602 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -12.870 -5.471 -4.635 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -13.708 -6.796 -5.418 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -11.510 -5.264 -6.810 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -11.162 -6.582 -5.709 1.00 0.00 H new ATOM 940 N GLY A 89 -13.895 -3.219 -4.402 1.00 0.00 N ATOM 941 CA GLY A 89 -14.320 -2.305 -3.343 1.00 0.00 C ATOM 942 C GLY A 89 -13.339 -1.143 -3.183 1.00 0.00 C ATOM 943 O GLY A 89 -12.619 -0.822 -4.133 1.00 0.00 O ATOM 0 H GLY A 89 -12.882 -3.310 -4.479 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -15.312 -1.917 -3.572 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -14.400 -2.848 -2.401 1.00 0.00 H new ATOM 947 N SER A 90 -13.311 -0.495 -2.011 1.00 0.00 N ATOM 948 CA SER A 90 -12.338 0.551 -1.717 1.00 0.00 C ATOM 949 C SER A 90 -11.792 0.439 -0.289 1.00 0.00 C ATOM 950 O SER A 90 -12.390 -0.234 0.557 1.00 0.00 O ATOM 951 CB SER A 90 -12.947 1.921 -2.036 1.00 0.00 C ATOM 952 OG SER A 90 -13.730 2.414 -0.964 1.00 0.00 O ATOM 0 H SER A 90 -13.961 -0.684 -1.248 1.00 0.00 H new ATOM 0 HA SER A 90 -11.467 0.424 -2.359 1.00 0.00 H new ATOM 0 HB2 SER A 90 -12.149 2.630 -2.259 1.00 0.00 H new ATOM 0 HB3 SER A 90 -13.564 1.844 -2.931 1.00 0.00 H new ATOM 0 HG SER A 90 -14.100 3.289 -1.204 1.00 0.00 H new ATOM 958 N VAL A 91 -10.643 1.074 -0.033 1.00 0.00 N ATOM 959 CA VAL A 91 -9.902 1.023 1.224 1.00 0.00 C ATOM 960 C VAL A 91 -9.230 2.365 1.467 1.00 0.00 C ATOM 961 O VAL A 91 -8.850 3.057 0.517 1.00 0.00 O ATOM 962 CB VAL A 91 -8.853 -0.108 1.197 1.00 0.00 C ATOM 963 CG1 VAL A 91 -9.521 -1.462 0.966 1.00 0.00 C ATOM 964 CG2 VAL A 91 -7.746 0.094 0.158 1.00 0.00 C ATOM 0 H VAL A 91 -10.187 1.663 -0.730 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.597 0.814 2.037 1.00 0.00 H new ATOM 0 HB VAL A 91 -8.377 -0.082 2.177 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.762 -2.244 0.951 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -10.230 -1.660 1.770 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -10.048 -1.450 0.012 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -7.049 -0.743 0.202 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -8.187 0.147 -0.837 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -7.213 1.021 0.369 1.00 0.00 H new ATOM 974 N ASP A 92 -9.070 2.713 2.739 1.00 0.00 N ATOM 975 CA ASP A 92 -8.435 3.956 3.152 1.00 0.00 C ATOM 976 C ASP A 92 -6.978 3.676 3.453 1.00 0.00 C ATOM 977 O ASP A 92 -6.621 2.569 3.871 1.00 0.00 O ATOM 978 CB ASP A 92 -9.121 4.528 4.401 1.00 0.00 C ATOM 979 CG ASP A 92 -10.468 5.188 4.078 1.00 0.00 C ATOM 980 OD1 ASP A 92 -10.902 5.215 2.899 1.00 0.00 O ATOM 981 OD2 ASP A 92 -11.148 5.572 5.053 1.00 0.00 O ATOM 0 H ASP A 92 -9.381 2.134 3.519 1.00 0.00 H new ATOM 0 HA ASP A 92 -8.522 4.689 2.350 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -9.276 3.728 5.126 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -8.464 5.260 4.870 1.00 0.00 H new ATOM 986 N VAL A 93 -6.136 4.692 3.303 1.00 0.00 N ATOM 987 CA VAL A 93 -4.735 4.635 3.642 1.00 0.00 C ATOM 988 C VAL A 93 -4.383 5.896 4.448 1.00 0.00 C ATOM 989 O VAL A 93 -4.711 7.010 4.042 1.00 0.00 O ATOM 990 CB VAL A 93 -3.910 4.439 2.356 1.00 0.00 C ATOM 991 CG1 VAL A 93 -4.461 3.385 1.364 1.00 0.00 C ATOM 992 CG2 VAL A 93 -3.683 5.714 1.629 1.00 0.00 C ATOM 0 H VAL A 93 -6.425 5.597 2.932 1.00 0.00 H new ATOM 0 HA VAL A 93 -4.494 3.782 4.277 1.00 0.00 H new ATOM 0 HB VAL A 93 -2.965 4.049 2.734 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -3.806 3.326 0.495 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -4.503 2.412 1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -5.462 3.674 1.045 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -3.097 5.521 0.730 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -4.642 6.149 1.350 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -3.143 6.409 2.272 1.00 0.00 H new ATOM 1002 N SER A 94 -3.659 5.747 5.545 1.00 0.00 N ATOM 1003 CA SER A 94 -3.166 6.805 6.419 1.00 0.00 C ATOM 1004 C SER A 94 -1.653 6.740 6.398 1.00 0.00 C ATOM 1005 O SER A 94 -1.049 5.782 6.880 1.00 0.00 O ATOM 1006 CB SER A 94 -3.708 6.670 7.841 1.00 0.00 C ATOM 1007 OG SER A 94 -5.010 7.212 7.892 1.00 0.00 O ATOM 0 H SER A 94 -3.380 4.822 5.873 1.00 0.00 H new ATOM 0 HA SER A 94 -3.512 7.774 6.060 1.00 0.00 H new ATOM 0 HB2 SER A 94 -3.725 5.622 8.139 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.056 7.190 8.543 1.00 0.00 H new ATOM 0 HG SER A 94 -5.638 6.597 7.459 1.00 0.00 H new ATOM 1013 N TYR A 95 -1.057 7.739 5.769 1.00 0.00 N ATOM 1014 CA TYR A 95 0.372 7.926 5.631 1.00 0.00 C ATOM 1015 C TYR A 95 0.751 9.199 6.374 1.00 0.00 C ATOM 1016 O TYR A 95 -0.076 10.035 6.750 1.00 0.00 O ATOM 1017 CB TYR A 95 0.727 8.067 4.147 1.00 0.00 C ATOM 1018 CG TYR A 95 2.191 8.185 3.752 1.00 0.00 C ATOM 1019 CD1 TYR A 95 3.217 7.497 4.430 1.00 0.00 C ATOM 1020 CD2 TYR A 95 2.512 8.958 2.626 1.00 0.00 C ATOM 1021 CE1 TYR A 95 4.543 7.551 3.968 1.00 0.00 C ATOM 1022 CE2 TYR A 95 3.846 9.062 2.186 1.00 0.00 C ATOM 1023 CZ TYR A 95 4.876 8.377 2.869 1.00 0.00 C ATOM 1024 OH TYR A 95 6.161 8.537 2.448 1.00 0.00 O ATOM 0 H TYR A 95 -1.590 8.481 5.317 1.00 0.00 H new ATOM 0 HA TYR A 95 0.912 7.073 6.042 1.00 0.00 H new ATOM 0 HB2 TYR A 95 0.313 7.204 3.625 1.00 0.00 H new ATOM 0 HB3 TYR A 95 0.210 8.948 3.766 1.00 0.00 H new ATOM 0 HD1 TYR A 95 2.982 6.922 5.314 1.00 0.00 H new ATOM 0 HD2 TYR A 95 1.730 9.478 2.092 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.308 6.962 4.452 1.00 0.00 H new ATOM 0 HE2 TYR A 95 4.082 9.667 1.324 1.00 0.00 H new ATOM 0 HH TYR A 95 6.389 7.824 1.816 1.00 0.00 H new ATOM 1034 N GLU A 96 2.047 9.392 6.484 1.00 0.00 N ATOM 1035 CA GLU A 96 2.663 10.544 7.065 1.00 0.00 C ATOM 1036 C GLU A 96 4.042 10.528 6.441 1.00 0.00 C ATOM 1037 O GLU A 96 4.894 9.733 6.846 1.00 0.00 O ATOM 1038 CB GLU A 96 2.645 10.451 8.598 1.00 0.00 C ATOM 1039 CG GLU A 96 3.166 11.767 9.171 1.00 0.00 C ATOM 1040 CD GLU A 96 3.284 11.732 10.689 1.00 0.00 C ATOM 1041 OE1 GLU A 96 2.258 11.627 11.394 1.00 0.00 O ATOM 1042 OE2 GLU A 96 4.413 11.892 11.201 1.00 0.00 O ATOM 0 H GLU A 96 2.727 8.709 6.150 1.00 0.00 H new ATOM 0 HA GLU A 96 2.158 11.490 6.871 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.633 10.258 8.954 1.00 0.00 H new ATOM 0 HB3 GLU A 96 3.265 9.620 8.934 1.00 0.00 H new ATOM 0 HG2 GLU A 96 4.142 11.988 8.738 1.00 0.00 H new ATOM 0 HG3 GLU A 96 2.497 12.577 8.880 1.00 0.00 H new ATOM 1049 N GLY A 97 4.211 11.303 5.372 1.00 0.00 N ATOM 1050 CA GLY A 97 5.465 11.353 4.655 1.00 0.00 C ATOM 1051 C GLY A 97 5.311 12.153 3.380 1.00 0.00 C ATOM 1052 O GLY A 97 4.237 12.690 3.090 1.00 0.00 O ATOM 0 H GLY A 97 3.484 11.906 4.988 1.00 0.00 H new ATOM 0 HA2 GLY A 97 6.233 11.803 5.284 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.797 10.342 4.420 1.00 0.00 H new ATOM 1056 N ILE A 98 6.418 12.280 2.658 1.00 0.00 N ATOM 1057 CA ILE A 98 6.461 12.966 1.383 1.00 0.00 C ATOM 1058 C ILE A 98 5.915 11.973 0.366 1.00 0.00 C ATOM 1059 O ILE A 98 6.351 10.819 0.331 1.00 0.00 O ATOM 1060 CB ILE A 98 7.895 13.477 1.099 1.00 0.00 C ATOM 1061 CG1 ILE A 98 7.917 14.562 0.005 1.00 0.00 C ATOM 1062 CG2 ILE A 98 8.901 12.369 0.746 1.00 0.00 C ATOM 1063 CD1 ILE A 98 7.401 15.914 0.518 1.00 0.00 C ATOM 0 H ILE A 98 7.320 11.903 2.950 1.00 0.00 H new ATOM 0 HA ILE A 98 5.851 13.869 1.350 1.00 0.00 H new ATOM 0 HB ILE A 98 8.217 13.911 2.046 1.00 0.00 H new ATOM 0 HG12 ILE A 98 8.935 14.681 -0.366 1.00 0.00 H new ATOM 0 HG13 ILE A 98 7.306 14.238 -0.838 1.00 0.00 H new ATOM 0 HG21 ILE A 98 9.880 12.812 0.562 1.00 0.00 H new ATOM 0 HG22 ILE A 98 8.971 11.664 1.574 1.00 0.00 H new ATOM 0 HG23 ILE A 98 8.566 11.845 -0.149 1.00 0.00 H new ATOM 0 HD11 ILE A 98 7.436 16.646 -0.289 1.00 0.00 H new ATOM 0 HD12 ILE A 98 6.373 15.804 0.864 1.00 0.00 H new ATOM 0 HD13 ILE A 98 8.027 16.253 1.343 1.00 0.00 H new ATOM 1075 N LEU A 99 4.897 12.364 -0.394 1.00 0.00 N ATOM 1076 CA LEU A 99 4.418 11.507 -1.467 1.00 0.00 C ATOM 1077 C LEU A 99 5.381 11.562 -2.661 1.00 0.00 C ATOM 1078 O LEU A 99 6.032 12.588 -2.890 1.00 0.00 O ATOM 1079 CB LEU A 99 2.970 11.845 -1.854 1.00 0.00 C ATOM 1080 CG LEU A 99 1.968 11.229 -0.859 1.00 0.00 C ATOM 1081 CD1 LEU A 99 0.564 11.768 -1.141 1.00 0.00 C ATOM 1082 CD2 LEU A 99 1.901 9.703 -0.898 1.00 0.00 C ATOM 0 H LEU A 99 4.399 13.248 -0.290 1.00 0.00 H new ATOM 0 HA LEU A 99 4.401 10.477 -1.111 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.841 12.927 -1.881 1.00 0.00 H new ATOM 0 HB3 LEU A 99 2.763 11.475 -2.858 1.00 0.00 H new ATOM 0 HG LEU A 99 2.327 11.514 0.130 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -0.142 11.330 -0.436 1.00 0.00 H new ATOM 0 HD12 LEU A 99 0.562 12.852 -1.031 1.00 0.00 H new ATOM 0 HD13 LEU A 99 0.271 11.506 -2.158 1.00 0.00 H new ATOM 0 HD21 LEU A 99 1.172 9.352 -0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.602 9.377 -1.894 1.00 0.00 H new ATOM 0 HD23 LEU A 99 2.881 9.290 -0.660 1.00 0.00 H new ATOM 1094 N PRO A 100 5.483 10.464 -3.433 1.00 0.00 N ATOM 1095 CA PRO A 100 6.312 10.420 -4.626 1.00 0.00 C ATOM 1096 C PRO A 100 5.751 11.407 -5.647 1.00 0.00 C ATOM 1097 O PRO A 100 4.533 11.517 -5.786 1.00 0.00 O ATOM 1098 CB PRO A 100 6.239 8.981 -5.160 1.00 0.00 C ATOM 1099 CG PRO A 100 5.264 8.225 -4.252 1.00 0.00 C ATOM 1100 CD PRO A 100 4.692 9.254 -3.287 1.00 0.00 C ATOM 0 HA PRO A 100 7.347 10.693 -4.421 1.00 0.00 H new ATOM 0 HB2 PRO A 100 5.894 8.969 -6.194 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.223 8.513 -5.147 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.471 7.758 -4.836 1.00 0.00 H new ATOM 0 HG3 PRO A 100 5.775 7.428 -3.712 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.643 9.450 -3.511 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.736 8.887 -2.262 1.00 0.00 H new ATOM 1108 N ASP A 101 6.599 12.048 -6.457 1.00 0.00 N ATOM 1109 CA ASP A 101 6.107 12.954 -7.505 1.00 0.00 C ATOM 1110 C ASP A 101 5.247 12.215 -8.529 1.00 0.00 C ATOM 1111 O ASP A 101 4.432 12.814 -9.236 1.00 0.00 O ATOM 1112 CB ASP A 101 7.259 13.598 -8.285 1.00 0.00 C ATOM 1113 CG ASP A 101 7.922 14.773 -7.583 1.00 0.00 C ATOM 1114 OD1 ASP A 101 7.426 15.229 -6.533 1.00 0.00 O ATOM 1115 OD2 ASP A 101 8.876 15.327 -8.177 1.00 0.00 O ATOM 0 H ASP A 101 7.614 11.960 -6.411 1.00 0.00 H new ATOM 0 HA ASP A 101 5.523 13.713 -6.985 1.00 0.00 H new ATOM 0 HB2 ASP A 101 8.014 12.838 -8.485 1.00 0.00 H new ATOM 0 HB3 ASP A 101 6.883 13.935 -9.251 1.00 0.00 H new ATOM 1120 N LEU A 102 5.477 10.912 -8.632 1.00 0.00 N ATOM 1121 CA LEU A 102 4.827 9.968 -9.504 1.00 0.00 C ATOM 1122 C LEU A 102 3.398 9.645 -9.039 1.00 0.00 C ATOM 1123 O LEU A 102 2.600 9.170 -9.851 1.00 0.00 O ATOM 1124 CB LEU A 102 5.737 8.722 -9.510 1.00 0.00 C ATOM 1125 CG LEU A 102 6.110 8.173 -10.890 1.00 0.00 C ATOM 1126 CD1 LEU A 102 4.888 7.612 -11.614 1.00 0.00 C ATOM 1127 CD2 LEU A 102 6.860 9.179 -11.763 1.00 0.00 C ATOM 0 H LEU A 102 6.185 10.460 -8.054 1.00 0.00 H new ATOM 0 HA LEU A 102 4.703 10.371 -10.509 1.00 0.00 H new ATOM 0 HB2 LEU A 102 6.656 8.965 -8.976 1.00 0.00 H new ATOM 0 HB3 LEU A 102 5.241 7.931 -8.948 1.00 0.00 H new ATOM 0 HG LEU A 102 6.807 7.355 -10.709 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.187 7.230 -12.590 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.456 6.803 -11.025 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.148 8.402 -11.744 1.00 0.00 H new ATOM 0 HD21 LEU A 102 7.093 8.723 -12.725 1.00 0.00 H new ATOM 0 HD22 LEU A 102 6.238 10.060 -11.920 1.00 0.00 H new ATOM 0 HD23 LEU A 102 7.785 9.472 -11.267 1.00 0.00 H new ATOM 1139 N PHE A 103 3.057 9.901 -7.769 1.00 0.00 N ATOM 1140 CA PHE A 103 1.730 9.690 -7.219 1.00 0.00 C ATOM 1141 C PHE A 103 0.737 10.674 -7.823 1.00 0.00 C ATOM 1142 O PHE A 103 0.964 11.888 -7.760 1.00 0.00 O ATOM 1143 CB PHE A 103 1.793 9.833 -5.696 1.00 0.00 C ATOM 1144 CG PHE A 103 0.495 9.524 -4.986 1.00 0.00 C ATOM 1145 CD1 PHE A 103 -0.490 10.519 -4.833 1.00 0.00 C ATOM 1146 CD2 PHE A 103 0.256 8.223 -4.515 1.00 0.00 C ATOM 1147 CE1 PHE A 103 -1.708 10.224 -4.200 1.00 0.00 C ATOM 1148 CE2 PHE A 103 -0.964 7.929 -3.890 1.00 0.00 C ATOM 1149 CZ PHE A 103 -1.938 8.927 -3.715 1.00 0.00 C ATOM 0 H PHE A 103 3.719 10.269 -7.086 1.00 0.00 H new ATOM 0 HA PHE A 103 1.386 8.686 -7.468 1.00 0.00 H new ATOM 0 HB2 PHE A 103 2.569 9.171 -5.313 1.00 0.00 H new ATOM 0 HB3 PHE A 103 2.094 10.852 -5.451 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.307 11.516 -5.205 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.006 7.455 -4.633 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -2.462 10.989 -4.087 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.157 6.926 -3.540 1.00 0.00 H new ATOM 0 HZ PHE A 103 -2.863 8.696 -3.208 1.00 0.00 H new ATOM 1159 N ARG A 104 -0.351 10.177 -8.427 1.00 0.00 N ATOM 1160 CA ARG A 104 -1.389 10.994 -9.033 1.00 0.00 C ATOM 1161 C ARG A 104 -2.722 10.421 -8.645 1.00 0.00 C ATOM 1162 O ARG A 104 -2.899 9.208 -8.630 1.00 0.00 O ATOM 1163 CB ARG A 104 -1.264 10.968 -10.559 1.00 0.00 C ATOM 1164 CG ARG A 104 0.105 11.471 -11.004 1.00 0.00 C ATOM 1165 CD ARG A 104 0.358 12.973 -10.803 1.00 0.00 C ATOM 1166 NE ARG A 104 1.800 13.288 -10.849 1.00 0.00 N ATOM 1167 CZ ARG A 104 2.421 14.240 -11.558 1.00 0.00 C ATOM 1168 NH1 ARG A 104 1.741 15.106 -12.306 1.00 0.00 N ATOM 1169 NH2 ARG A 104 3.748 14.300 -11.527 1.00 0.00 N ATOM 0 H ARG A 104 -0.529 9.176 -8.505 1.00 0.00 H new ATOM 0 HA ARG A 104 -1.291 12.024 -8.689 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -1.418 9.952 -10.923 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -2.044 11.587 -11.002 1.00 0.00 H new ATOM 0 HG2 ARG A 104 0.870 10.916 -10.461 1.00 0.00 H new ATOM 0 HG3 ARG A 104 0.232 11.238 -12.061 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -0.164 13.538 -11.575 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -0.054 13.288 -9.844 1.00 0.00 H new ATOM 0 HE ARG A 104 2.401 12.706 -10.266 1.00 0.00 H new ATOM 0 HH11 ARG A 104 0.723 15.054 -12.349 1.00 0.00 H new ATOM 0 HH12 ARG A 104 2.238 15.822 -12.837 1.00 0.00 H new ATOM 0 HH21 ARG A 104 4.276 13.628 -10.970 1.00 0.00 H new ATOM 0 HH22 ARG A 104 4.239 15.018 -12.060 1.00 0.00 H new ATOM 1183 N GLU A 105 -3.658 11.304 -8.370 1.00 0.00 N ATOM 1184 CA GLU A 105 -5.032 10.940 -8.030 1.00 0.00 C ATOM 1185 C GLU A 105 -5.671 10.318 -9.270 1.00 0.00 C ATOM 1186 O GLU A 105 -5.851 11.021 -10.270 1.00 0.00 O ATOM 1187 CB GLU A 105 -5.857 12.151 -7.580 1.00 0.00 C ATOM 1188 CG GLU A 105 -5.219 12.888 -6.400 1.00 0.00 C ATOM 1189 CD GLU A 105 -4.434 14.127 -6.830 1.00 0.00 C ATOM 1190 OE1 GLU A 105 -3.558 14.048 -7.720 1.00 0.00 O ATOM 1191 OE2 GLU A 105 -4.775 15.230 -6.370 1.00 0.00 O ATOM 0 H GLU A 105 -3.492 12.310 -8.374 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.014 10.238 -7.196 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.971 12.841 -8.417 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.858 11.821 -7.300 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -5.998 13.183 -5.698 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -4.553 12.207 -5.870 1.00 0.00 H new ATOM 1198 N GLY A 106 -6.002 9.025 -9.218 1.00 0.00 N ATOM 1199 CA GLY A 106 -6.542 8.295 -10.354 1.00 0.00 C ATOM 1200 C GLY A 106 -5.575 7.275 -10.932 1.00 0.00 C ATOM 1201 O GLY A 106 -5.757 6.940 -12.109 1.00 0.00 O ATOM 0 H GLY A 106 -5.900 8.457 -8.377 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -7.456 7.785 -10.048 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -6.819 9.004 -11.134 1.00 0.00 H new ATOM 1205 N GLN A 107 -4.566 6.794 -10.177 1.00 0.00 N ATOM 1206 CA GLN A 107 -3.636 5.790 -10.725 1.00 0.00 C ATOM 1207 C GLN A 107 -3.408 4.645 -9.736 1.00 0.00 C ATOM 1208 O GLN A 107 -3.792 4.762 -8.575 1.00 0.00 O ATOM 1209 CB GLN A 107 -2.333 6.461 -11.196 1.00 0.00 C ATOM 1210 CG GLN A 107 -1.482 6.945 -10.032 1.00 0.00 C ATOM 1211 CD GLN A 107 -0.238 6.105 -9.806 1.00 0.00 C ATOM 1212 OE1 GLN A 107 -0.175 5.316 -8.868 1.00 0.00 O ATOM 1213 NE2 GLN A 107 0.779 6.316 -10.617 1.00 0.00 N ATOM 0 H GLN A 107 -4.378 7.075 -9.215 1.00 0.00 H new ATOM 0 HA GLN A 107 -4.087 5.334 -11.606 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -1.758 5.754 -11.795 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -2.574 7.305 -11.843 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -1.186 7.978 -10.213 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -2.085 6.940 -9.124 1.00 0.00 H new ATOM 0 HE21 GLN A 107 0.689 6.980 -11.386 1.00 0.00 H new ATOM 0 HE22 GLN A 107 1.656 5.815 -10.476 1.00 0.00 H new ATOM 1222 N GLY A 108 -2.844 3.535 -10.205 1.00 0.00 N ATOM 1223 CA GLY A 108 -2.737 2.269 -9.486 1.00 0.00 C ATOM 1224 C GLY A 108 -1.518 2.268 -8.575 1.00 0.00 C ATOM 1225 O GLY A 108 -0.452 1.808 -8.982 1.00 0.00 O ATOM 0 H GLY A 108 -2.431 3.492 -11.137 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -3.638 2.103 -8.896 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.666 1.446 -10.197 1.00 0.00 H new ATOM 1229 N VAL A 109 -1.676 2.797 -7.367 1.00 0.00 N ATOM 1230 CA VAL A 109 -0.624 2.988 -6.373 1.00 0.00 C ATOM 1231 C VAL A 109 -0.358 1.653 -5.670 1.00 0.00 C ATOM 1232 O VAL A 109 -1.174 0.731 -5.732 1.00 0.00 O ATOM 1233 CB VAL A 109 -0.982 4.141 -5.389 1.00 0.00 C ATOM 1234 CG1 VAL A 109 -2.148 5.023 -5.860 1.00 0.00 C ATOM 1235 CG2 VAL A 109 -1.311 3.719 -3.949 1.00 0.00 C ATOM 0 H VAL A 109 -2.585 3.120 -7.037 1.00 0.00 H new ATOM 0 HA VAL A 109 0.300 3.300 -6.860 1.00 0.00 H new ATOM 0 HB VAL A 109 -0.044 4.697 -5.388 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.336 5.802 -5.121 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -1.894 5.482 -6.815 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -3.042 4.411 -5.978 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -1.544 4.603 -3.355 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -2.170 3.048 -3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.452 3.207 -3.515 1.00 0.00 H new ATOM 1245 N VAL A 110 0.741 1.573 -4.920 1.00 0.00 N ATOM 1246 CA VAL A 110 0.998 0.525 -3.955 1.00 0.00 C ATOM 1247 C VAL A 110 1.268 1.186 -2.601 1.00 0.00 C ATOM 1248 O VAL A 110 1.934 2.219 -2.502 1.00 0.00 O ATOM 1249 CB VAL A 110 2.133 -0.375 -4.480 1.00 0.00 C ATOM 1250 CG1 VAL A 110 2.792 -1.200 -3.374 1.00 0.00 C ATOM 1251 CG2 VAL A 110 1.572 -1.331 -5.536 1.00 0.00 C ATOM 0 H VAL A 110 1.494 2.259 -4.975 1.00 0.00 H new ATOM 0 HA VAL A 110 0.145 -0.138 -3.813 1.00 0.00 H new ATOM 0 HB VAL A 110 2.893 0.281 -4.903 1.00 0.00 H new ATOM 0 HG11 VAL A 110 3.584 -1.815 -3.802 1.00 0.00 H new ATOM 0 HG12 VAL A 110 3.216 -0.531 -2.625 1.00 0.00 H new ATOM 0 HG13 VAL A 110 2.046 -1.843 -2.906 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.372 -1.970 -5.910 1.00 0.00 H new ATOM 0 HG22 VAL A 110 0.793 -1.949 -5.090 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.151 -0.756 -6.361 1.00 0.00 H new ATOM 1261 N VAL A 111 0.730 0.591 -1.547 1.00 0.00 N ATOM 1262 CA VAL A 111 0.963 0.912 -0.157 1.00 0.00 C ATOM 1263 C VAL A 111 1.535 -0.341 0.516 1.00 0.00 C ATOM 1264 O VAL A 111 1.320 -1.459 0.051 1.00 0.00 O ATOM 1265 CB VAL A 111 -0.397 1.379 0.393 1.00 0.00 C ATOM 1266 CG1 VAL A 111 -0.594 1.166 1.883 1.00 0.00 C ATOM 1267 CG2 VAL A 111 -0.588 2.860 0.083 1.00 0.00 C ATOM 0 H VAL A 111 0.074 -0.183 -1.654 1.00 0.00 H new ATOM 0 HA VAL A 111 1.688 1.706 0.021 1.00 0.00 H new ATOM 0 HB VAL A 111 -1.140 0.756 -0.105 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.581 1.526 2.175 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -0.513 0.104 2.112 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.170 1.715 2.433 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.551 3.192 0.472 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.210 3.436 0.551 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -0.561 3.012 -0.996 1.00 0.00 H new ATOM 1277 N GLN A 112 2.235 -0.147 1.629 1.00 0.00 N ATOM 1278 CA GLN A 112 2.803 -1.158 2.521 1.00 0.00 C ATOM 1279 C GLN A 112 2.870 -0.552 3.906 1.00 0.00 C ATOM 1280 O GLN A 112 3.086 0.651 3.990 1.00 0.00 O ATOM 1281 CB GLN A 112 4.221 -1.531 2.047 1.00 0.00 C ATOM 1282 CG GLN A 112 4.987 -2.426 3.022 1.00 0.00 C ATOM 1283 CD GLN A 112 6.055 -3.250 2.314 1.00 0.00 C ATOM 1284 OE1 GLN A 112 6.691 -2.829 1.349 1.00 0.00 O ATOM 1285 NE2 GLN A 112 6.206 -4.484 2.739 1.00 0.00 N ATOM 0 H GLN A 112 2.437 0.797 1.959 1.00 0.00 H new ATOM 0 HA GLN A 112 2.191 -2.060 2.523 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.150 -2.037 1.084 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.791 -0.616 1.885 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.453 -1.810 3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 112 4.289 -3.093 3.528 1.00 0.00 H new ATOM 0 HE21 GLN A 112 5.670 -4.816 3.541 1.00 0.00 H new ATOM 0 HE22 GLN A 112 6.859 -5.110 2.267 1.00 0.00 H new ATOM 1294 N GLY A 113 2.688 -1.352 4.955 1.00 0.00 N ATOM 1295 CA GLY A 113 2.538 -0.916 6.324 1.00 0.00 C ATOM 1296 C GLY A 113 1.556 -1.902 6.930 1.00 0.00 C ATOM 1297 O GLY A 113 1.741 -3.100 6.738 1.00 0.00 O ATOM 0 H GLY A 113 2.640 -2.366 4.859 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.492 -0.930 6.852 1.00 0.00 H new ATOM 0 HA3 GLY A 113 2.159 0.105 6.377 1.00 0.00 H new ATOM 1301 N GLU A 114 0.516 -1.462 7.628 1.00 0.00 N ATOM 1302 CA GLU A 114 -0.165 -2.287 8.616 1.00 0.00 C ATOM 1303 C GLU A 114 -1.668 -2.069 8.559 1.00 0.00 C ATOM 1304 O GLU A 114 -2.144 -1.067 8.029 1.00 0.00 O ATOM 1305 CB GLU A 114 0.442 -1.966 9.993 1.00 0.00 C ATOM 1306 CG GLU A 114 1.703 -2.818 10.230 1.00 0.00 C ATOM 1307 CD GLU A 114 2.768 -2.213 11.146 1.00 0.00 C ATOM 1308 OE1 GLU A 114 2.751 -2.470 12.369 1.00 0.00 O ATOM 1309 OE2 GLU A 114 3.720 -1.596 10.611 1.00 0.00 O ATOM 0 H GLU A 114 0.123 -0.527 7.525 1.00 0.00 H new ATOM 0 HA GLU A 114 -0.019 -3.347 8.409 1.00 0.00 H new ATOM 0 HB2 GLU A 114 0.694 -0.907 10.050 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -0.291 -2.162 10.776 1.00 0.00 H new ATOM 0 HG2 GLU A 114 1.395 -3.776 10.650 1.00 0.00 H new ATOM 0 HG3 GLU A 114 2.162 -3.026 9.263 1.00 0.00 H new ATOM 1316 N LEU A 115 -2.422 -3.044 9.063 1.00 0.00 N ATOM 1317 CA LEU A 115 -3.880 -3.005 9.100 1.00 0.00 C ATOM 1318 C LEU A 115 -4.359 -2.381 10.408 1.00 0.00 C ATOM 1319 O LEU A 115 -3.900 -2.766 11.483 1.00 0.00 O ATOM 1320 CB LEU A 115 -4.407 -4.424 8.892 1.00 0.00 C ATOM 1321 CG LEU A 115 -5.893 -4.538 8.511 1.00 0.00 C ATOM 1322 CD1 LEU A 115 -6.311 -3.739 7.266 1.00 0.00 C ATOM 1323 CD2 LEU A 115 -6.286 -5.992 8.233 1.00 0.00 C ATOM 0 H LEU A 115 -2.029 -3.896 9.463 1.00 0.00 H new ATOM 0 HA LEU A 115 -4.272 -2.376 8.300 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -3.814 -4.901 8.112 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -4.242 -4.990 9.809 1.00 0.00 H new ATOM 0 HG LEU A 115 -6.404 -4.123 9.380 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -7.375 -3.885 7.081 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -6.113 -2.680 7.430 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -5.742 -4.085 6.403 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -7.342 -6.039 7.967 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -5.686 -6.380 7.410 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -6.110 -6.593 9.125 1.00 0.00 H new ATOM 1335 N GLU A 116 -5.242 -1.389 10.305 1.00 0.00 N ATOM 1336 CA GLU A 116 -5.667 -0.564 11.431 1.00 0.00 C ATOM 1337 C GLU A 116 -6.896 -1.187 12.097 1.00 0.00 C ATOM 1338 O GLU A 116 -6.828 -1.646 13.237 1.00 0.00 O ATOM 1339 CB GLU A 116 -5.928 0.862 10.917 1.00 0.00 C ATOM 1340 CG GLU A 116 -5.820 1.949 11.987 1.00 0.00 C ATOM 1341 CD GLU A 116 -7.176 2.418 12.490 1.00 0.00 C ATOM 1342 OE1 GLU A 116 -7.689 1.801 13.442 1.00 0.00 O ATOM 1343 OE2 GLU A 116 -7.644 3.481 12.025 1.00 0.00 O ATOM 0 H GLU A 116 -5.688 -1.133 9.424 1.00 0.00 H new ATOM 0 HA GLU A 116 -4.891 -0.512 12.195 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -5.219 1.083 10.119 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -6.925 0.900 10.477 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -5.238 1.569 12.827 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -5.274 2.800 11.580 1.00 0.00 H new ATOM 1350 N LYS A 117 -8.019 -1.207 11.375 1.00 0.00 N ATOM 1351 CA LYS A 117 -9.280 -1.878 11.664 1.00 0.00 C ATOM 1352 C LYS A 117 -10.069 -1.885 10.368 1.00 0.00 C ATOM 1353 O LYS A 117 -9.834 -1.033 9.503 1.00 0.00 O ATOM 1354 CB LYS A 117 -10.062 -1.134 12.764 1.00 0.00 C ATOM 1355 CG LYS A 117 -9.933 -1.874 14.109 1.00 0.00 C ATOM 1356 CD LYS A 117 -10.070 -0.984 15.347 1.00 0.00 C ATOM 1357 CE LYS A 117 -8.965 0.075 15.319 1.00 0.00 C ATOM 1358 NZ LYS A 117 -8.090 0.082 16.502 1.00 0.00 N ATOM 0 H LYS A 117 -8.068 -0.704 10.489 1.00 0.00 H new ATOM 0 HA LYS A 117 -9.105 -2.890 12.029 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -9.683 -0.117 12.864 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.112 -1.057 12.483 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.694 -2.653 14.153 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -8.964 -2.372 14.142 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -11.050 -0.507 15.362 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.994 -1.584 16.254 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -8.352 -0.082 14.432 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -9.425 1.058 15.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -7.373 0.828 16.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.659 0.264 17.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -7.619 -0.841 16.591 1.00 0.00 H new ATOM 1372 N GLY A 118 -11.037 -2.791 10.256 1.00 0.00 N ATOM 1373 CA GLY A 118 -11.824 -3.003 9.057 1.00 0.00 C ATOM 1374 C GLY A 118 -10.932 -3.181 7.841 1.00 0.00 C ATOM 1375 O GLY A 118 -10.401 -4.268 7.608 1.00 0.00 O ATOM 0 H GLY A 118 -11.298 -3.412 11.022 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -12.453 -3.884 9.182 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -12.491 -2.155 8.901 1.00 0.00 H new ATOM 1379 N ASN A 119 -10.763 -2.111 7.067 1.00 0.00 N ATOM 1380 CA ASN A 119 -10.035 -2.107 5.808 1.00 0.00 C ATOM 1381 C ASN A 119 -9.132 -0.882 5.708 1.00 0.00 C ATOM 1382 O ASN A 119 -8.798 -0.448 4.606 1.00 0.00 O ATOM 1383 CB ASN A 119 -10.992 -2.188 4.604 1.00 0.00 C ATOM 1384 CG ASN A 119 -12.212 -3.077 4.765 1.00 0.00 C ATOM 1385 OD1 ASN A 119 -13.327 -2.652 4.479 1.00 0.00 O ATOM 1386 ND2 ASN A 119 -12.037 -4.325 5.160 1.00 0.00 N ATOM 0 H ASN A 119 -11.142 -1.196 7.310 1.00 0.00 H new ATOM 0 HA ASN A 119 -9.405 -2.996 5.786 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -11.334 -1.179 4.372 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -10.426 -2.539 3.741 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -12.837 -4.954 5.232 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -11.102 -4.660 5.393 1.00 0.00 H new ATOM 1393 N HIS A 120 -8.757 -0.292 6.836 1.00 0.00 N ATOM 1394 CA HIS A 120 -7.912 0.882 6.856 1.00 0.00 C ATOM 1395 C HIS A 120 -6.461 0.457 6.965 1.00 0.00 C ATOM 1396 O HIS A 120 -6.097 -0.321 7.842 1.00 0.00 O ATOM 1397 CB HIS A 120 -8.321 1.749 8.031 1.00 0.00 C ATOM 1398 CG HIS A 120 -7.561 3.052 8.136 1.00 0.00 C ATOM 1399 ND1 HIS A 120 -7.451 3.844 9.259 1.00 0.00 N ATOM 1400 CD2 HIS A 120 -6.777 3.622 7.165 1.00 0.00 C ATOM 1401 CE1 HIS A 120 -6.638 4.862 8.944 1.00 0.00 C ATOM 1402 NE2 HIS A 120 -6.220 4.780 7.675 1.00 0.00 N ATOM 0 H HIS A 120 -9.034 -0.619 7.761 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.026 1.456 5.937 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -9.386 1.968 7.953 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.179 1.183 8.952 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -7.903 3.685 10.160 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.621 3.232 6.170 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -6.356 5.649 9.628 1.00 0.00 H new ATOM 1410 N ILE A 121 -5.635 0.967 6.066 1.00 0.00 N ATOM 1411 CA ILE A 121 -4.219 0.712 5.996 1.00 0.00 C ATOM 1412 C ILE A 121 -3.453 1.893 6.587 1.00 0.00 C ATOM 1413 O ILE A 121 -3.606 3.027 6.147 1.00 0.00 O ATOM 1414 CB ILE A 121 -3.864 0.513 4.512 1.00 0.00 C ATOM 1415 CG1 ILE A 121 -4.765 -0.480 3.745 1.00 0.00 C ATOM 1416 CG2 ILE A 121 -2.420 0.034 4.452 1.00 0.00 C ATOM 1417 CD1 ILE A 121 -4.831 -1.860 4.402 1.00 0.00 C ATOM 0 H ILE A 121 -5.957 1.600 5.333 1.00 0.00 H new ATOM 0 HA ILE A 121 -3.948 -0.176 6.567 1.00 0.00 H new ATOM 0 HB ILE A 121 -4.020 1.471 4.016 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -5.772 -0.069 3.675 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -4.393 -0.587 2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -2.130 -0.119 3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -1.769 0.783 4.904 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -2.325 -0.905 4.997 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -5.479 -2.511 3.816 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -3.830 -2.290 4.447 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -5.231 -1.764 5.412 1.00 0.00 H new ATOM 1429 N LEU A 122 -2.514 1.624 7.479 1.00 0.00 N ATOM 1430 CA LEU A 122 -1.398 2.515 7.721 1.00 0.00 C ATOM 1431 C LEU A 122 -0.405 2.268 6.594 1.00 0.00 C ATOM 1432 O LEU A 122 0.053 1.142 6.378 1.00 0.00 O ATOM 1433 CB LEU A 122 -0.730 2.237 9.069 1.00 0.00 C ATOM 1434 CG LEU A 122 -1.466 2.793 10.297 1.00 0.00 C ATOM 1435 CD1 LEU A 122 -1.726 4.310 10.266 1.00 0.00 C ATOM 1436 CD2 LEU A 122 -2.811 2.116 10.511 1.00 0.00 C ATOM 0 H LEU A 122 -2.506 0.782 8.054 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.741 3.549 7.749 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -0.625 1.159 9.187 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.276 2.655 9.050 1.00 0.00 H new ATOM 0 HG LEU A 122 -0.776 2.579 11.113 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -2.250 4.608 11.174 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -0.776 4.841 10.204 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -2.337 4.557 9.397 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -3.296 2.540 11.390 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -3.442 2.275 9.636 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -2.660 1.047 10.660 1.00 0.00 H new ATOM 1448 N ALA A 123 -0.123 3.312 5.829 1.00 0.00 N ATOM 1449 CA ALA A 123 0.916 3.345 4.822 1.00 0.00 C ATOM 1450 C ALA A 123 2.226 3.768 5.481 1.00 0.00 C ATOM 1451 O ALA A 123 2.261 4.753 6.218 1.00 0.00 O ATOM 1452 CB ALA A 123 0.487 4.340 3.751 1.00 0.00 C ATOM 0 H ALA A 123 -0.634 4.192 5.899 1.00 0.00 H new ATOM 0 HA ALA A 123 1.068 2.367 4.365 1.00 0.00 H new ATOM 0 HB1 ALA A 123 1.250 4.390 2.974 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.457 4.018 3.312 1.00 0.00 H new ATOM 0 HB3 ALA A 123 0.361 5.325 4.199 1.00 0.00 H new ATOM 1458 N LYS A 124 3.303 3.044 5.193 1.00 0.00 N ATOM 1459 CA LYS A 124 4.636 3.235 5.755 1.00 0.00 C ATOM 1460 C LYS A 124 5.570 3.927 4.768 1.00 0.00 C ATOM 1461 O LYS A 124 6.506 4.579 5.224 1.00 0.00 O ATOM 1462 CB LYS A 124 5.174 1.890 6.303 1.00 0.00 C ATOM 1463 CG LYS A 124 6.076 1.037 5.381 1.00 0.00 C ATOM 1464 CD LYS A 124 7.557 1.370 5.626 1.00 0.00 C ATOM 1465 CE LYS A 124 8.508 0.487 4.821 1.00 0.00 C ATOM 1466 NZ LYS A 124 9.904 0.978 4.847 1.00 0.00 N ATOM 0 H LYS A 124 3.268 2.270 4.529 1.00 0.00 H new ATOM 0 HA LYS A 124 4.578 3.917 6.603 1.00 0.00 H new ATOM 0 HB2 LYS A 124 5.733 2.101 7.214 1.00 0.00 H new ATOM 0 HB3 LYS A 124 4.317 1.280 6.589 1.00 0.00 H new ATOM 0 HG2 LYS A 124 5.899 -0.022 5.567 1.00 0.00 H new ATOM 0 HG3 LYS A 124 5.822 1.225 4.338 1.00 0.00 H new ATOM 0 HD2 LYS A 124 7.736 2.414 5.371 1.00 0.00 H new ATOM 0 HD3 LYS A 124 7.778 1.259 6.688 1.00 0.00 H new ATOM 0 HE2 LYS A 124 8.477 -0.528 5.217 1.00 0.00 H new ATOM 0 HE3 LYS A 124 8.164 0.437 3.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 10.172 1.313 3.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 9.984 1.761 5.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.538 0.205 5.133 1.00 0.00 H new ATOM 1480 N GLU A 125 5.328 3.819 3.455 1.00 0.00 N ATOM 1481 CA GLU A 125 6.168 4.448 2.445 1.00 0.00 C ATOM 1482 C GLU A 125 5.441 5.018 1.217 1.00 0.00 C ATOM 1483 O GLU A 125 5.743 6.134 0.816 1.00 0.00 O ATOM 1484 CB GLU A 125 7.248 3.438 2.035 1.00 0.00 C ATOM 1485 CG GLU A 125 6.728 2.211 1.247 1.00 0.00 C ATOM 1486 CD GLU A 125 7.772 1.145 0.890 1.00 0.00 C ATOM 1487 OE1 GLU A 125 8.753 0.924 1.635 1.00 0.00 O ATOM 1488 OE2 GLU A 125 7.511 0.400 -0.082 1.00 0.00 O ATOM 0 H GLU A 125 4.544 3.292 3.070 1.00 0.00 H new ATOM 0 HA GLU A 125 6.596 5.338 2.906 1.00 0.00 H new ATOM 0 HB2 GLU A 125 7.994 3.952 1.428 1.00 0.00 H new ATOM 0 HB3 GLU A 125 7.755 3.086 2.933 1.00 0.00 H new ATOM 0 HG2 GLU A 125 5.940 1.737 1.832 1.00 0.00 H new ATOM 0 HG3 GLU A 125 6.270 2.565 0.323 1.00 0.00 H new ATOM 1495 N VAL A 126 4.444 4.320 0.659 1.00 0.00 N ATOM 1496 CA VAL A 126 3.749 4.626 -0.593 1.00 0.00 C ATOM 1497 C VAL A 126 4.683 4.576 -1.808 1.00 0.00 C ATOM 1498 O VAL A 126 5.830 5.029 -1.830 1.00 0.00 O ATOM 1499 CB VAL A 126 2.903 5.923 -0.500 1.00 0.00 C ATOM 1500 CG1 VAL A 126 2.502 6.512 -1.858 1.00 0.00 C ATOM 1501 CG2 VAL A 126 1.578 5.662 0.224 1.00 0.00 C ATOM 0 H VAL A 126 4.080 3.475 1.099 1.00 0.00 H new ATOM 0 HA VAL A 126 3.026 3.827 -0.758 1.00 0.00 H new ATOM 0 HB VAL A 126 3.553 6.620 0.029 1.00 0.00 H new ATOM 0 HG11 VAL A 126 1.913 7.416 -1.703 1.00 0.00 H new ATOM 0 HG12 VAL A 126 3.399 6.756 -2.428 1.00 0.00 H new ATOM 0 HG13 VAL A 126 1.909 5.783 -2.410 1.00 0.00 H new ATOM 0 HG21 VAL A 126 1.004 6.587 0.276 1.00 0.00 H new ATOM 0 HG22 VAL A 126 1.007 4.910 -0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 126 1.779 5.303 1.233 1.00 0.00 H new ATOM 1511 N LEU A 127 4.125 4.010 -2.871 1.00 0.00 N ATOM 1512 CA LEU A 127 4.681 3.934 -4.198 1.00 0.00 C ATOM 1513 C LEU A 127 3.523 4.168 -5.157 1.00 0.00 C ATOM 1514 O LEU A 127 2.365 3.897 -4.842 1.00 0.00 O ATOM 1515 CB LEU A 127 5.268 2.529 -4.410 1.00 0.00 C ATOM 1516 CG LEU A 127 6.469 2.214 -3.499 1.00 0.00 C ATOM 1517 CD1 LEU A 127 6.715 0.709 -3.434 1.00 0.00 C ATOM 1518 CD2 LEU A 127 7.716 2.942 -4.001 1.00 0.00 C ATOM 0 H LEU A 127 3.209 3.564 -2.815 1.00 0.00 H new ATOM 0 HA LEU A 127 5.473 4.666 -4.356 1.00 0.00 H new ATOM 0 HB2 LEU A 127 4.487 1.789 -4.235 1.00 0.00 H new ATOM 0 HB3 LEU A 127 5.576 2.427 -5.450 1.00 0.00 H new ATOM 0 HG LEU A 127 6.243 2.564 -2.492 1.00 0.00 H new ATOM 0 HD11 LEU A 127 7.568 0.507 -2.785 1.00 0.00 H new ATOM 0 HD12 LEU A 127 5.830 0.213 -3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 127 6.923 0.331 -4.435 1.00 0.00 H new ATOM 0 HD21 LEU A 127 8.559 2.712 -3.349 1.00 0.00 H new ATOM 0 HD22 LEU A 127 7.943 2.617 -5.016 1.00 0.00 H new ATOM 0 HD23 LEU A 127 7.536 4.017 -3.996 1.00 0.00 H new ATOM 1530 N ALA A 128 3.832 4.595 -6.371 1.00 0.00 N ATOM 1531 CA ALA A 128 2.860 4.865 -7.419 1.00 0.00 C ATOM 1532 C ALA A 128 3.171 3.987 -8.639 1.00 0.00 C ATOM 1533 O ALA A 128 3.162 4.449 -9.780 1.00 0.00 O ATOM 1534 CB ALA A 128 2.824 6.377 -7.643 1.00 0.00 C ATOM 0 H ALA A 128 4.794 4.768 -6.663 1.00 0.00 H new ATOM 0 HA ALA A 128 1.840 4.587 -7.153 1.00 0.00 H new ATOM 0 HB1 ALA A 128 2.102 6.612 -8.425 1.00 0.00 H new ATOM 0 HB2 ALA A 128 2.532 6.875 -6.718 1.00 0.00 H new ATOM 0 HB3 ALA A 128 3.812 6.724 -7.945 1.00 0.00 H new ATOM 1540 N LYS A 129 3.508 2.715 -8.364 1.00 0.00 N ATOM 1541 CA LYS A 129 3.859 1.652 -9.315 1.00 0.00 C ATOM 1542 C LYS A 129 4.942 2.036 -10.326 1.00 0.00 C ATOM 1543 O LYS A 129 4.937 1.513 -11.447 1.00 0.00 O ATOM 1544 CB LYS A 129 2.572 1.058 -9.932 1.00 0.00 C ATOM 1545 CG LYS A 129 2.090 -0.158 -9.122 1.00 0.00 C ATOM 1546 CD LYS A 129 2.894 -1.456 -9.331 1.00 0.00 C ATOM 1547 CE LYS A 129 2.690 -2.089 -10.717 1.00 0.00 C ATOM 1548 NZ LYS A 129 3.632 -1.596 -11.745 1.00 0.00 N ATOM 0 H LYS A 129 3.544 2.381 -7.401 1.00 0.00 H new ATOM 0 HA LYS A 129 4.351 0.854 -8.758 1.00 0.00 H new ATOM 0 HB2 LYS A 129 1.791 1.818 -9.956 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.761 0.762 -10.964 1.00 0.00 H new ATOM 0 HG2 LYS A 129 2.117 0.099 -8.063 1.00 0.00 H new ATOM 0 HG3 LYS A 129 1.048 -0.352 -9.376 1.00 0.00 H new ATOM 0 HD2 LYS A 129 3.954 -1.244 -9.190 1.00 0.00 H new ATOM 0 HD3 LYS A 129 2.609 -2.178 -8.566 1.00 0.00 H new ATOM 0 HE2 LYS A 129 2.795 -3.171 -10.631 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.670 -1.893 -11.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 3.099 -1.262 -12.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 4.192 -0.811 -11.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 4.268 -2.367 -12.031 1.00 0.00 H new ATOM 1562 N HIS A 130 5.914 2.869 -9.949 1.00 0.00 N ATOM 1563 CA HIS A 130 7.028 3.267 -10.798 1.00 0.00 C ATOM 1564 C HIS A 130 8.113 2.208 -10.705 1.00 0.00 C ATOM 1565 O HIS A 130 9.207 2.455 -10.206 1.00 0.00 O ATOM 1566 CB HIS A 130 7.525 4.684 -10.480 1.00 0.00 C ATOM 1567 CG HIS A 130 7.359 5.115 -9.044 1.00 0.00 C ATOM 1568 ND1 HIS A 130 8.319 5.219 -8.063 1.00 0.00 N ATOM 1569 CD2 HIS A 130 6.176 5.512 -8.500 1.00 0.00 C ATOM 1570 CE1 HIS A 130 7.709 5.671 -6.951 1.00 0.00 C ATOM 1571 NE2 HIS A 130 6.393 5.839 -7.163 1.00 0.00 N ATOM 0 H HIS A 130 5.945 3.293 -9.022 1.00 0.00 H new ATOM 0 HA HIS A 130 6.696 3.325 -11.834 1.00 0.00 H new ATOM 0 HB2 HIS A 130 8.581 4.749 -10.742 1.00 0.00 H new ATOM 0 HB3 HIS A 130 6.994 5.390 -11.118 1.00 0.00 H new ATOM 0 HD1 HIS A 130 9.309 4.995 -8.160 1.00 0.00 H new ATOM 0 HD2 HIS A 130 5.229 5.565 -9.017 1.00 0.00 H new ATOM 0 HE1 HIS A 130 8.210 5.871 -6.015 1.00 0.00 H new ATOM 1579 N ASP A 131 7.763 1.019 -11.193 1.00 0.00 N ATOM 1580 CA ASP A 131 8.660 -0.057 -11.582 1.00 0.00 C ATOM 1581 C ASP A 131 9.731 -0.358 -10.533 1.00 0.00 C ATOM 1582 O ASP A 131 10.900 -0.580 -10.848 1.00 0.00 O ATOM 1583 CB ASP A 131 9.212 0.253 -12.976 1.00 0.00 C ATOM 1584 CG ASP A 131 9.901 -0.942 -13.636 1.00 0.00 C ATOM 1585 OD1 ASP A 131 9.642 -2.110 -13.252 1.00 0.00 O ATOM 1586 OD2 ASP A 131 10.622 -0.715 -14.635 1.00 0.00 O ATOM 0 H ASP A 131 6.784 0.771 -11.334 1.00 0.00 H new ATOM 0 HA ASP A 131 8.103 -0.992 -11.636 1.00 0.00 H new ATOM 0 HB2 ASP A 131 8.396 0.591 -13.615 1.00 0.00 H new ATOM 0 HB3 ASP A 131 9.922 1.077 -12.903 1.00 0.00 H new ATOM 1591 N GLU A 132 9.341 -0.303 -9.257 1.00 0.00 N ATOM 1592 CA GLU A 132 10.257 -0.575 -8.167 1.00 0.00 C ATOM 1593 C GLU A 132 10.629 -2.053 -8.190 1.00 0.00 C ATOM 1594 O GLU A 132 9.757 -2.928 -8.168 1.00 0.00 O ATOM 1595 CB GLU A 132 9.650 -0.223 -6.796 1.00 0.00 C ATOM 1596 CG GLU A 132 10.306 0.981 -6.096 1.00 0.00 C ATOM 1597 CD GLU A 132 10.351 0.878 -4.554 1.00 0.00 C ATOM 1598 OE1 GLU A 132 9.824 -0.107 -3.982 1.00 0.00 O ATOM 1599 OE2 GLU A 132 10.965 1.780 -3.930 1.00 0.00 O ATOM 0 H GLU A 132 8.393 -0.071 -8.962 1.00 0.00 H new ATOM 0 HA GLU A 132 11.139 0.050 -8.306 1.00 0.00 H new ATOM 0 HB2 GLU A 132 8.588 -0.017 -6.926 1.00 0.00 H new ATOM 0 HB3 GLU A 132 9.729 -1.093 -6.144 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.324 1.093 -6.470 1.00 0.00 H new ATOM 0 HG3 GLU A 132 9.764 1.886 -6.372 1.00 0.00 H new ATOM 1606 N ASN A 133 11.931 -2.304 -8.126 1.00 0.00 N ATOM 1607 CA ASN A 133 12.496 -3.516 -7.563 1.00 0.00 C ATOM 1608 C ASN A 133 13.594 -3.070 -6.602 1.00 0.00 C ATOM 1609 O ASN A 133 14.376 -2.185 -6.950 1.00 0.00 O ATOM 1610 CB ASN A 133 13.017 -4.457 -8.664 1.00 0.00 C ATOM 1611 CG ASN A 133 14.480 -4.228 -9.018 1.00 0.00 C ATOM 1612 OD1 ASN A 133 15.358 -4.900 -8.489 1.00 0.00 O ATOM 1613 ND2 ASN A 133 14.767 -3.300 -9.912 1.00 0.00 N ATOM 0 H ASN A 133 12.636 -1.654 -8.473 1.00 0.00 H new ATOM 0 HA ASN A 133 11.743 -4.097 -7.030 1.00 0.00 H new ATOM 0 HB2 ASN A 133 12.887 -5.489 -8.339 1.00 0.00 H new ATOM 0 HB3 ASN A 133 12.410 -4.326 -9.560 1.00 0.00 H new ATOM 0 HD21 ASN A 133 15.737 -3.129 -10.176 1.00 0.00 H new ATOM 0 HD22 ASN A 133 14.019 -2.754 -10.338 1.00 0.00 H new ATOM 1620 N TYR A 134 13.661 -3.685 -5.425 1.00 0.00 N ATOM 1621 CA TYR A 134 14.641 -3.416 -4.381 1.00 0.00 C ATOM 1622 C TYR A 134 14.721 -1.942 -3.933 1.00 0.00 C ATOM 1623 O TYR A 134 15.402 -1.111 -4.539 1.00 0.00 O ATOM 1624 CB TYR A 134 16.013 -3.990 -4.777 1.00 0.00 C ATOM 1625 CG TYR A 134 17.083 -3.897 -3.706 1.00 0.00 C ATOM 1626 CD1 TYR A 134 16.740 -3.892 -2.339 1.00 0.00 C ATOM 1627 CD2 TYR A 134 18.439 -3.805 -4.081 1.00 0.00 C ATOM 1628 CE1 TYR A 134 17.736 -3.800 -1.365 1.00 0.00 C ATOM 1629 CE2 TYR A 134 19.446 -3.732 -3.101 1.00 0.00 C ATOM 1630 CZ TYR A 134 19.093 -3.751 -1.733 1.00 0.00 C ATOM 1631 OH TYR A 134 20.053 -3.753 -0.769 1.00 0.00 O ATOM 0 H TYR A 134 13.002 -4.418 -5.162 1.00 0.00 H new ATOM 0 HA TYR A 134 14.288 -3.935 -3.490 1.00 0.00 H new ATOM 0 HB2 TYR A 134 15.886 -5.037 -5.052 1.00 0.00 H new ATOM 0 HB3 TYR A 134 16.365 -3.468 -5.667 1.00 0.00 H new ATOM 0 HD1 TYR A 134 15.703 -3.960 -2.044 1.00 0.00 H new ATOM 0 HD2 TYR A 134 18.707 -3.790 -5.127 1.00 0.00 H new ATOM 0 HE1 TYR A 134 17.463 -3.766 -0.321 1.00 0.00 H new ATOM 0 HE2 TYR A 134 20.483 -3.662 -3.393 1.00 0.00 H new ATOM 0 HH TYR A 134 20.938 -3.717 -1.189 1.00 0.00 H new ATOM 1641 N THR A 135 14.054 -1.638 -2.824 1.00 0.00 N ATOM 1642 CA THR A 135 14.265 -0.455 -1.996 1.00 0.00 C ATOM 1643 C THR A 135 15.402 -0.815 -1.020 1.00 0.00 C ATOM 1644 O THR A 135 15.242 -1.787 -0.276 1.00 0.00 O ATOM 1645 CB THR A 135 12.971 -0.117 -1.218 1.00 0.00 C ATOM 1646 OG1 THR A 135 11.824 -0.415 -1.997 1.00 0.00 O ATOM 1647 CG2 THR A 135 12.893 1.337 -0.733 1.00 0.00 C ATOM 0 H THR A 135 13.315 -2.240 -2.460 1.00 0.00 H new ATOM 0 HA THR A 135 14.522 0.417 -2.597 1.00 0.00 H new ATOM 0 HB THR A 135 12.999 -0.745 -0.327 1.00 0.00 H new ATOM 0 HG1 THR A 135 11.016 -0.196 -1.487 1.00 0.00 H new ATOM 0 HG21 THR A 135 11.956 1.492 -0.197 1.00 0.00 H new ATOM 0 HG22 THR A 135 13.731 1.544 -0.067 1.00 0.00 H new ATOM 0 HG23 THR A 135 12.936 2.009 -1.590 1.00 0.00 H new ATOM 1655 N PRO A 136 16.554 -0.126 -1.039 1.00 0.00 N ATOM 1656 CA PRO A 136 17.589 -0.270 -0.013 1.00 0.00 C ATOM 1657 C PRO A 136 17.171 0.476 1.279 1.00 0.00 C ATOM 1658 O PRO A 136 16.066 1.029 1.338 1.00 0.00 O ATOM 1659 CB PRO A 136 18.837 0.303 -0.701 1.00 0.00 C ATOM 1660 CG PRO A 136 18.290 1.412 -1.592 1.00 0.00 C ATOM 1661 CD PRO A 136 16.940 0.861 -2.038 1.00 0.00 C ATOM 0 HA PRO A 136 17.765 -1.291 0.324 1.00 0.00 H new ATOM 0 HB2 PRO A 136 19.551 0.690 0.026 1.00 0.00 H new ATOM 0 HB3 PRO A 136 19.356 -0.458 -1.284 1.00 0.00 H new ATOM 0 HG2 PRO A 136 18.183 2.350 -1.048 1.00 0.00 H new ATOM 0 HG3 PRO A 136 18.946 1.608 -2.440 1.00 0.00 H new ATOM 0 HD2 PRO A 136 16.198 1.657 -2.106 1.00 0.00 H new ATOM 0 HD3 PRO A 136 17.012 0.407 -3.026 1.00 0.00 H new ATOM 1669 N PRO A 137 18.003 0.538 2.337 1.00 0.00 N ATOM 1670 CA PRO A 137 17.942 1.621 3.306 1.00 0.00 C ATOM 1671 C PRO A 137 18.622 2.872 2.713 1.00 0.00 C ATOM 1672 O PRO A 137 19.173 2.839 1.611 1.00 0.00 O ATOM 1673 CB PRO A 137 18.676 1.074 4.534 1.00 0.00 C ATOM 1674 CG PRO A 137 19.792 0.251 3.905 1.00 0.00 C ATOM 1675 CD PRO A 137 19.156 -0.299 2.627 1.00 0.00 C ATOM 0 HA PRO A 137 16.929 1.927 3.568 1.00 0.00 H new ATOM 0 HB2 PRO A 137 19.066 1.873 5.164 1.00 0.00 H new ATOM 0 HB3 PRO A 137 18.024 0.464 5.159 1.00 0.00 H new ATOM 0 HG2 PRO A 137 20.667 0.863 3.686 1.00 0.00 H new ATOM 0 HG3 PRO A 137 20.121 -0.551 4.566 1.00 0.00 H new ATOM 0 HD2 PRO A 137 19.867 -0.277 1.801 1.00 0.00 H new ATOM 0 HD3 PRO A 137 18.855 -1.338 2.761 1.00 0.00 H new ATOM 1683 N GLU A 138 18.653 3.953 3.494 1.00 0.00 N ATOM 1684 CA GLU A 138 19.137 5.294 3.134 1.00 0.00 C ATOM 1685 C GLU A 138 18.252 5.931 2.048 1.00 0.00 C ATOM 1686 O GLU A 138 18.764 6.599 1.151 1.00 0.00 O ATOM 1687 CB GLU A 138 20.626 5.296 2.728 1.00 0.00 C ATOM 1688 CG GLU A 138 21.613 4.689 3.729 1.00 0.00 C ATOM 1689 CD GLU A 138 22.960 4.504 3.027 1.00 0.00 C ATOM 1690 OE1 GLU A 138 23.674 5.508 2.787 1.00 0.00 O ATOM 1691 OE2 GLU A 138 23.265 3.359 2.624 1.00 0.00 O ATOM 0 H GLU A 138 18.320 3.917 4.457 1.00 0.00 H new ATOM 0 HA GLU A 138 19.062 5.909 4.031 1.00 0.00 H new ATOM 0 HB2 GLU A 138 20.722 4.757 1.786 1.00 0.00 H new ATOM 0 HB3 GLU A 138 20.925 6.327 2.538 1.00 0.00 H new ATOM 0 HG2 GLU A 138 21.723 5.341 4.596 1.00 0.00 H new ATOM 0 HG3 GLU A 138 21.241 3.732 4.095 1.00 0.00 H new ATOM 1698 N VAL A 139 16.933 5.702 2.084 1.00 0.00 N ATOM 1699 CA VAL A 139 15.987 6.216 1.090 1.00 0.00 C ATOM 1700 C VAL A 139 14.663 6.647 1.733 1.00 0.00 C ATOM 1701 O VAL A 139 14.116 7.680 1.344 1.00 0.00 O ATOM 1702 CB VAL A 139 15.764 5.186 -0.042 1.00 0.00 C ATOM 1703 CG1 VAL A 139 17.057 4.900 -0.815 1.00 0.00 C ATOM 1704 CG2 VAL A 139 15.193 3.855 0.453 1.00 0.00 C ATOM 0 H VAL A 139 16.489 5.147 2.815 1.00 0.00 H new ATOM 0 HA VAL A 139 16.426 7.109 0.646 1.00 0.00 H new ATOM 0 HB VAL A 139 15.030 5.652 -0.700 1.00 0.00 H new ATOM 0 HG11 VAL A 139 16.857 4.172 -1.601 1.00 0.00 H new ATOM 0 HG12 VAL A 139 17.426 5.824 -1.261 1.00 0.00 H new ATOM 0 HG13 VAL A 139 17.808 4.501 -0.133 1.00 0.00 H new ATOM 0 HG21 VAL A 139 15.061 3.179 -0.392 1.00 0.00 H new ATOM 0 HG22 VAL A 139 15.881 3.409 1.171 1.00 0.00 H new ATOM 0 HG23 VAL A 139 14.230 4.028 0.933 1.00 0.00 H new ATOM 1714 N GLU A 140 14.154 5.874 2.700 1.00 0.00 N ATOM 1715 CA GLU A 140 12.798 5.966 3.229 1.00 0.00 C ATOM 1716 C GLU A 140 12.557 7.353 3.860 1.00 0.00 C ATOM 1717 O GLU A 140 11.803 8.178 3.337 1.00 0.00 O ATOM 1718 CB GLU A 140 12.592 4.830 4.252 1.00 0.00 C ATOM 1719 CG GLU A 140 11.181 4.817 4.866 1.00 0.00 C ATOM 1720 CD GLU A 140 11.181 4.234 6.281 1.00 0.00 C ATOM 1721 OE1 GLU A 140 11.678 4.900 7.218 1.00 0.00 O ATOM 1722 OE2 GLU A 140 10.727 3.082 6.481 1.00 0.00 O ATOM 0 H GLU A 140 14.701 5.140 3.150 1.00 0.00 H new ATOM 0 HA GLU A 140 12.072 5.853 2.424 1.00 0.00 H new ATOM 0 HB2 GLU A 140 12.778 3.873 3.765 1.00 0.00 H new ATOM 0 HB3 GLU A 140 13.328 4.930 5.050 1.00 0.00 H new ATOM 0 HG2 GLU A 140 10.787 5.833 4.892 1.00 0.00 H new ATOM 0 HG3 GLU A 140 10.514 4.232 4.232 1.00 0.00 H new ATOM 1729 N LYS A 141 13.190 7.606 5.011 1.00 0.00 N ATOM 1730 CA LYS A 141 13.058 8.823 5.817 1.00 0.00 C ATOM 1731 C LYS A 141 14.418 9.242 6.381 1.00 0.00 C ATOM 1732 O LYS A 141 14.480 10.185 7.164 1.00 0.00 O ATOM 1733 CB LYS A 141 12.015 8.600 6.937 1.00 0.00 C ATOM 1734 CG LYS A 141 10.971 9.720 7.095 1.00 0.00 C ATOM 1735 CD LYS A 141 11.410 11.023 7.794 1.00 0.00 C ATOM 1736 CE LYS A 141 12.182 11.985 6.877 1.00 0.00 C ATOM 1737 NZ LYS A 141 11.833 13.406 7.066 1.00 0.00 N ATOM 0 H LYS A 141 13.838 6.936 5.424 1.00 0.00 H new ATOM 0 HA LYS A 141 12.704 9.638 5.186 1.00 0.00 H new ATOM 0 HB2 LYS A 141 11.492 7.663 6.743 1.00 0.00 H new ATOM 0 HB3 LYS A 141 12.542 8.481 7.884 1.00 0.00 H new ATOM 0 HG2 LYS A 141 10.607 9.980 6.101 1.00 0.00 H new ATOM 0 HG3 LYS A 141 10.125 9.313 7.648 1.00 0.00 H new ATOM 0 HD2 LYS A 141 10.528 11.533 8.180 1.00 0.00 H new ATOM 0 HD3 LYS A 141 12.035 10.772 8.652 1.00 0.00 H new ATOM 0 HE2 LYS A 141 13.250 11.858 7.052 1.00 0.00 H new ATOM 0 HE3 LYS A 141 11.994 11.710 5.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 12.394 13.991 6.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 10.821 13.544 6.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 12.038 13.687 8.046 1.00 0.00 H new ATOM 1751 N ALA A 142 15.514 8.597 5.992 1.00 0.00 N ATOM 1752 CA ALA A 142 16.866 9.064 6.238 1.00 0.00 C ATOM 1753 C ALA A 142 17.493 9.244 4.859 1.00 0.00 C ATOM 1754 O ALA A 142 18.052 8.298 4.299 1.00 0.00 O ATOM 1755 CB ALA A 142 17.613 8.099 7.167 1.00 0.00 C ATOM 0 H ALA A 142 15.481 7.713 5.484 1.00 0.00 H new ATOM 0 HA ALA A 142 16.904 10.014 6.771 1.00 0.00 H new ATOM 0 HB1 ALA A 142 18.624 8.468 7.338 1.00 0.00 H new ATOM 0 HB2 ALA A 142 17.086 8.029 8.119 1.00 0.00 H new ATOM 0 HB3 ALA A 142 17.660 7.113 6.705 1.00 0.00 H new ATOM 1761 N MET A 143 17.247 10.423 4.289 1.00 0.00 N ATOM 1762 CA MET A 143 17.730 11.015 3.063 1.00 0.00 C ATOM 1763 C MET A 143 17.760 12.516 3.283 1.00 0.00 C ATOM 1764 O MET A 143 17.044 13.006 4.192 1.00 0.00 O ATOM 1765 CB MET A 143 16.730 10.704 1.950 1.00 0.00 C ATOM 1766 CG MET A 143 17.281 9.642 1.026 1.00 0.00 C ATOM 1767 SD MET A 143 18.491 10.279 -0.172 1.00 0.00 S ATOM 1768 CE MET A 143 18.492 8.939 -1.392 1.00 0.00 C ATOM 0 H MET A 143 16.610 11.070 4.754 1.00 0.00 H new ATOM 0 HA MET A 143 18.715 10.633 2.793 1.00 0.00 H new ATOM 0 HB2 MET A 143 15.789 10.365 2.383 1.00 0.00 H new ATOM 0 HB3 MET A 143 16.513 11.610 1.384 1.00 0.00 H new ATOM 0 HG2 MET A 143 17.750 8.860 1.623 1.00 0.00 H new ATOM 0 HG3 MET A 143 16.456 9.178 0.485 1.00 0.00 H new ATOM 0 HE1 MET A 143 19.492 8.830 -1.812 1.00 0.00 H new ATOM 0 HE2 MET A 143 18.198 8.007 -0.909 1.00 0.00 H new ATOM 0 HE3 MET A 143 17.787 9.172 -2.189 1.00 0.00 H new TER 1778 MET A 143