USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1063 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 101 SER OG : rot 180:sc=-0.00124 USER MOD Set 1.2: A 135 MET CE :methyl -146:sc= -1.4 (180deg=-2.45!) USER MOD Set 2.1: A 59 ASN :FLIP amide:sc= -1.3 F(o=-9.3,f=-6) USER MOD Set 2.2: A 60 ASN : amide:sc= -4.75! C(o=-6!,f=-8.9!) USER MOD Set 3.1: A 41 GLN : amide:sc= -1.8 K(o=-9.3,f=-12) USER MOD Set 3.2: A 72 MET CE :methyl -126:sc= -4.11! (180deg=-3.81!) USER MOD Set 3.3: A 76 MET CE :methyl 148:sc= -3.34 (180deg=-3.63!) USER MOD Set 4.1: A 36 MET CE :methyl -172:sc= -3.95 (180deg=-4.16) USER MOD Set 4.2: A 75 GLN : amide:sc= -7.35! C(o=-11!,f=-12!) USER MOD Set 5.1: A 24 THR OG1 : rot -41:sc= 0.792 USER MOD Set 5.2: A 26 LYS NZ :NH3+ 164:sc= -0.511 (180deg=-1.17) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.00952 X(o=0.0095,f=-0.36) USER MOD Single : A 13 LYS NZ :NH3+ -173:sc=-0.00331 (180deg=-0.0927) USER MOD Single : A 18 GLN :FLIP amide:sc= 0 F(o=-0.53,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -22:sc= 0.236 USER MOD Single : A 42 ASN : amide:sc= -0.0679 K(o=-0.068,f=-0.73) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.33 X(o=-0.33,f=-0.075) USER MOD Single : A 57 ASN :FLIP amide:sc= -0.618 F(o=-2.3,f=-0.62) USER MOD Single : A 58 ASN : amide:sc= -0.315 X(o=-0.32,f=-0.65) USER MOD Single : A 62 GLN : amide:sc= -8.49! C(o=-8.5!,f=-9.1!) USER MOD Single : A 64 ASN : amide:sc= -3.78! C(o=-3.8!,f=-11!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0.0483 USER MOD Single : A 69 CYS SG : rot 97:sc= -1.97! USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 140:sc= -3.57! (180deg=-4.59!) USER MOD Single : A 90 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.045) USER MOD Single : A 109 MET CE :methyl 165:sc= -2.01! (180deg=-2.24) USER MOD Single : A 111 ASN : amide:sc= -0.31 K(o=-0.31,f=-3.4!) USER MOD Single : A 115 LYS NZ :NH3+ 160:sc= -0.109 (180deg=-0.469) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.0935 USER MOD Single : A 124 MET CE :methyl 135:sc= -0.108 (180deg=-1.27) USER MOD Single : A 137 ASN : amide:sc= -0.0419 K(o=-0.042,f=-2.1!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 MET CE :methyl 157:sc= -2.96! (180deg=-3.06!) USER MOD Single : A 146 SER OG : rot 82:sc= 1.16 USER MOD Single : A 147 GLN : amide:sc= -0.346 K(o=-0.35,f=-4.9!) USER MOD Single : A 148 LYS NZ :NH3+ -107:sc= -1.31 (180deg=-3.72!) USER MOD ----------------------------------------------------------------- ATOM 12 N GLU A 3 10.986 -13.836 2.032 1.00 0.87 N ATOM 13 CA GLU A 3 11.342 -13.771 3.448 1.00 0.57 C ATOM 14 C GLU A 3 12.741 -13.191 3.638 1.00 0.48 C ATOM 15 O GLU A 3 13.399 -12.800 2.674 1.00 0.55 O ATOM 16 CB GLU A 3 11.265 -15.163 4.080 1.00 0.70 C ATOM 17 CG GLU A 3 9.921 -15.846 3.890 1.00 1.23 C ATOM 18 CD GLU A 3 9.910 -17.266 4.421 1.00 1.78 C ATOM 19 OE1 GLU A 3 10.254 -18.189 3.655 1.00 2.20 O ATOM 20 OE2 GLU A 3 9.558 -17.454 5.605 1.00 2.49 O ATOM 0 HA GLU A 3 10.628 -13.113 3.943 1.00 0.57 H new ATOM 0 HB2 GLU A 3 12.046 -15.791 3.651 1.00 0.70 H new ATOM 0 HB3 GLU A 3 11.473 -15.080 5.147 1.00 0.70 H new ATOM 0 HG2 GLU A 3 9.148 -15.267 4.395 1.00 1.23 H new ATOM 0 HG3 GLU A 3 9.669 -15.856 2.830 1.00 1.23 H new ATOM 27 N LEU A 4 13.185 -13.135 4.891 1.00 0.44 N ATOM 28 CA LEU A 4 14.505 -12.601 5.215 1.00 0.39 C ATOM 29 C LEU A 4 15.487 -13.722 5.543 1.00 0.37 C ATOM 30 O LEU A 4 15.930 -13.858 6.684 1.00 0.45 O ATOM 31 CB LEU A 4 14.412 -11.628 6.395 1.00 0.47 C ATOM 32 CG LEU A 4 14.103 -10.181 6.029 1.00 0.43 C ATOM 33 CD1 LEU A 4 12.769 -10.097 5.328 1.00 1.12 C ATOM 34 CD2 LEU A 4 14.113 -9.302 7.270 1.00 1.25 C ATOM 0 H LEU A 4 12.650 -13.453 5.699 1.00 0.44 H new ATOM 0 HA LEU A 4 14.873 -12.067 4.339 1.00 0.39 H new ATOM 0 HB2 LEU A 4 13.641 -11.985 7.078 1.00 0.47 H new ATOM 0 HB3 LEU A 4 15.356 -11.653 6.940 1.00 0.47 H new ATOM 0 HG LEU A 4 14.876 -9.819 5.351 1.00 0.43 H new ATOM 0 HD11 LEU A 4 12.558 -9.059 5.071 1.00 1.12 H new ATOM 0 HD12 LEU A 4 12.797 -10.698 4.419 1.00 1.12 H new ATOM 0 HD13 LEU A 4 11.987 -10.474 5.987 1.00 1.12 H new ATOM 0 HD21 LEU A 4 13.890 -8.273 6.989 1.00 1.25 H new ATOM 0 HD22 LEU A 4 13.360 -9.657 7.973 1.00 1.25 H new ATOM 0 HD23 LEU A 4 15.096 -9.345 7.739 1.00 1.25 H new ATOM 46 N THR A 5 15.823 -14.522 4.536 1.00 0.35 N ATOM 47 CA THR A 5 16.762 -15.622 4.717 1.00 0.37 C ATOM 48 C THR A 5 18.192 -15.137 4.497 1.00 0.35 C ATOM 49 O THR A 5 18.405 -14.081 3.912 1.00 0.39 O ATOM 50 CB THR A 5 16.462 -16.785 3.749 1.00 0.40 C ATOM 51 OG1 THR A 5 15.071 -17.120 3.804 1.00 0.46 O ATOM 52 CG2 THR A 5 17.293 -18.012 4.098 1.00 0.47 C ATOM 0 H THR A 5 15.459 -14.429 3.588 1.00 0.35 H new ATOM 0 HA THR A 5 16.650 -15.985 5.739 1.00 0.37 H new ATOM 0 HB THR A 5 16.722 -16.463 2.741 1.00 0.40 H new ATOM 0 HG1 THR A 5 14.888 -17.858 3.186 1.00 0.46 H new ATOM 0 HG21 THR A 5 17.063 -18.818 3.401 1.00 0.47 H new ATOM 0 HG22 THR A 5 18.353 -17.765 4.030 1.00 0.47 H new ATOM 0 HG23 THR A 5 17.059 -18.333 5.113 1.00 0.47 H new ATOM 60 N GLU A 6 19.164 -15.908 4.973 1.00 0.36 N ATOM 61 CA GLU A 6 20.576 -15.552 4.831 1.00 0.37 C ATOM 62 C GLU A 6 20.883 -14.972 3.448 1.00 0.33 C ATOM 63 O GLU A 6 21.563 -13.952 3.330 1.00 0.34 O ATOM 64 CB GLU A 6 21.450 -16.781 5.082 1.00 0.45 C ATOM 65 CG GLU A 6 21.068 -17.984 4.235 1.00 0.87 C ATOM 66 CD GLU A 6 21.925 -19.200 4.527 1.00 0.98 C ATOM 67 OE1 GLU A 6 22.996 -19.338 3.898 1.00 1.20 O ATOM 68 OE2 GLU A 6 21.526 -20.014 5.385 1.00 1.17 O ATOM 0 H GLU A 6 19.001 -16.788 5.463 1.00 0.36 H new ATOM 0 HA GLU A 6 20.798 -14.783 5.570 1.00 0.37 H new ATOM 0 HB2 GLU A 6 22.490 -16.523 4.883 1.00 0.45 H new ATOM 0 HB3 GLU A 6 21.385 -17.054 6.135 1.00 0.45 H new ATOM 0 HG2 GLU A 6 20.021 -18.231 4.413 1.00 0.87 H new ATOM 0 HG3 GLU A 6 21.160 -17.725 3.180 1.00 0.87 H new ATOM 75 N GLU A 7 20.370 -15.624 2.410 1.00 0.34 N ATOM 76 CA GLU A 7 20.596 -15.189 1.036 1.00 0.35 C ATOM 77 C GLU A 7 19.821 -13.913 0.719 1.00 0.30 C ATOM 78 O GLU A 7 20.383 -12.953 0.195 1.00 0.30 O ATOM 79 CB GLU A 7 20.203 -16.300 0.060 1.00 0.44 C ATOM 80 CG GLU A 7 18.783 -16.809 0.252 1.00 0.47 C ATOM 81 CD GLU A 7 18.417 -17.902 -0.732 1.00 0.57 C ATOM 82 OE1 GLU A 7 17.990 -17.568 -1.857 1.00 0.64 O ATOM 83 OE2 GLU A 7 18.557 -19.091 -0.379 1.00 0.61 O ATOM 0 H GLU A 7 19.792 -16.460 2.495 1.00 0.34 H new ATOM 0 HA GLU A 7 21.658 -14.972 0.925 1.00 0.35 H new ATOM 0 HB2 GLU A 7 20.312 -15.931 -0.960 1.00 0.44 H new ATOM 0 HB3 GLU A 7 20.897 -17.133 0.174 1.00 0.44 H new ATOM 0 HG2 GLU A 7 18.671 -17.188 1.268 1.00 0.47 H new ATOM 0 HG3 GLU A 7 18.086 -15.979 0.143 1.00 0.47 H new ATOM 90 N GLN A 8 18.529 -13.911 1.033 1.00 0.30 N ATOM 91 CA GLN A 8 17.678 -12.752 0.781 1.00 0.30 C ATOM 92 C GLN A 8 18.243 -11.505 1.450 1.00 0.25 C ATOM 93 O GLN A 8 18.360 -10.453 0.823 1.00 0.24 O ATOM 94 CB GLN A 8 16.262 -13.017 1.292 1.00 0.35 C ATOM 95 CG GLN A 8 15.438 -13.911 0.380 1.00 0.45 C ATOM 96 CD GLN A 8 15.127 -13.258 -0.952 1.00 0.72 C ATOM 97 OE1 GLN A 8 15.875 -13.406 -1.920 1.00 1.32 O ATOM 98 NE2 GLN A 8 14.019 -12.528 -1.008 1.00 1.02 N ATOM 0 H GLN A 8 18.047 -14.701 1.463 1.00 0.30 H new ATOM 0 HA GLN A 8 17.647 -12.583 -0.295 1.00 0.30 H new ATOM 0 HB2 GLN A 8 16.322 -13.477 2.278 1.00 0.35 H new ATOM 0 HB3 GLN A 8 15.746 -12.065 1.415 1.00 0.35 H new ATOM 0 HG2 GLN A 8 15.977 -14.842 0.207 1.00 0.45 H new ATOM 0 HG3 GLN A 8 14.505 -14.171 0.879 1.00 0.45 H new ATOM 0 HE21 GLN A 8 13.429 -12.433 -0.182 1.00 1.02 H new ATOM 0 HE22 GLN A 8 13.758 -12.063 -1.877 1.00 1.02 H new ATOM 107 N ILE A 9 18.589 -11.632 2.724 1.00 0.25 N ATOM 108 CA ILE A 9 19.145 -10.522 3.481 1.00 0.26 C ATOM 109 C ILE A 9 20.371 -9.951 2.783 1.00 0.25 C ATOM 110 O ILE A 9 20.459 -8.748 2.552 1.00 0.27 O ATOM 111 CB ILE A 9 19.520 -10.945 4.915 1.00 0.32 C ATOM 112 CG1 ILE A 9 18.273 -11.432 5.661 1.00 0.37 C ATOM 113 CG2 ILE A 9 20.173 -9.787 5.657 1.00 0.34 C ATOM 114 CD1 ILE A 9 18.561 -11.968 7.046 1.00 0.45 C ATOM 0 H ILE A 9 18.493 -12.497 3.256 1.00 0.25 H new ATOM 0 HA ILE A 9 18.373 -9.755 3.538 1.00 0.26 H new ATOM 0 HB ILE A 9 20.237 -11.764 4.865 1.00 0.32 H new ATOM 0 HG12 ILE A 9 17.564 -10.608 5.741 1.00 0.37 H new ATOM 0 HG13 ILE A 9 17.791 -12.212 5.073 1.00 0.37 H new ATOM 0 HG21 ILE A 9 20.432 -10.102 6.668 1.00 0.34 H new ATOM 0 HG22 ILE A 9 21.077 -9.481 5.130 1.00 0.34 H new ATOM 0 HG23 ILE A 9 19.479 -8.948 5.705 1.00 0.34 H new ATOM 0 HD11 ILE A 9 17.630 -12.293 7.511 1.00 0.45 H new ATOM 0 HD12 ILE A 9 19.245 -12.813 6.974 1.00 0.45 H new ATOM 0 HD13 ILE A 9 19.015 -11.184 7.652 1.00 0.45 H new ATOM 126 N ALA A 10 21.306 -10.826 2.440 1.00 0.26 N ATOM 127 CA ALA A 10 22.528 -10.416 1.763 1.00 0.28 C ATOM 128 C ALA A 10 22.242 -9.936 0.341 1.00 0.24 C ATOM 129 O ALA A 10 23.059 -9.242 -0.265 1.00 0.25 O ATOM 130 CB ALA A 10 23.517 -11.571 1.742 1.00 0.36 C ATOM 0 H ALA A 10 21.241 -11.828 2.620 1.00 0.26 H new ATOM 0 HA ALA A 10 22.960 -9.581 2.314 1.00 0.28 H new ATOM 0 HB1 ALA A 10 24.430 -11.259 1.234 1.00 0.36 H new ATOM 0 HB2 ALA A 10 23.753 -11.866 2.764 1.00 0.36 H new ATOM 0 HB3 ALA A 10 23.078 -12.416 1.212 1.00 0.36 H new ATOM 136 N GLU A 11 21.072 -10.298 -0.181 1.00 0.24 N ATOM 137 CA GLU A 11 20.693 -9.920 -1.539 1.00 0.25 C ATOM 138 C GLU A 11 20.368 -8.431 -1.640 1.00 0.22 C ATOM 139 O GLU A 11 20.983 -7.707 -2.428 1.00 0.22 O ATOM 140 CB GLU A 11 19.488 -10.749 -1.997 1.00 0.31 C ATOM 141 CG GLU A 11 19.115 -10.528 -3.454 1.00 0.40 C ATOM 142 CD GLU A 11 20.217 -10.945 -4.408 1.00 1.06 C ATOM 143 OE1 GLU A 11 20.289 -12.146 -4.742 1.00 1.02 O ATOM 144 OE2 GLU A 11 21.008 -10.070 -4.820 1.00 1.93 O ATOM 0 H GLU A 11 20.373 -10.851 0.315 1.00 0.24 H new ATOM 0 HA GLU A 11 21.544 -10.121 -2.190 1.00 0.25 H new ATOM 0 HB2 GLU A 11 19.705 -11.806 -1.843 1.00 0.31 H new ATOM 0 HB3 GLU A 11 18.630 -10.505 -1.370 1.00 0.31 H new ATOM 0 HG2 GLU A 11 18.210 -11.090 -3.683 1.00 0.40 H new ATOM 0 HG3 GLU A 11 18.884 -9.474 -3.610 1.00 0.40 H new ATOM 151 N PHE A 12 19.417 -7.965 -0.835 1.00 0.21 N ATOM 152 CA PHE A 12 19.039 -6.558 -0.861 1.00 0.23 C ATOM 153 C PHE A 12 20.044 -5.715 -0.094 1.00 0.20 C ATOM 154 O PHE A 12 20.201 -4.526 -0.366 1.00 0.22 O ATOM 155 CB PHE A 12 17.625 -6.348 -0.312 1.00 0.29 C ATOM 156 CG PHE A 12 17.417 -6.837 1.090 1.00 0.27 C ATOM 157 CD1 PHE A 12 17.907 -6.118 2.166 1.00 0.32 C ATOM 158 CD2 PHE A 12 16.752 -8.028 1.331 1.00 0.27 C ATOM 159 CE1 PHE A 12 17.733 -6.573 3.455 1.00 0.36 C ATOM 160 CE2 PHE A 12 16.575 -8.487 2.618 1.00 0.28 C ATOM 161 CZ PHE A 12 16.996 -7.726 3.683 1.00 0.33 C ATOM 0 H PHE A 12 18.900 -8.534 -0.165 1.00 0.21 H new ATOM 0 HA PHE A 12 19.042 -6.235 -1.902 1.00 0.23 H new ATOM 0 HB2 PHE A 12 17.390 -5.284 -0.350 1.00 0.29 H new ATOM 0 HB3 PHE A 12 16.917 -6.855 -0.968 1.00 0.29 H new ATOM 0 HD1 PHE A 12 18.432 -5.190 1.994 1.00 0.32 H new ATOM 0 HD2 PHE A 12 16.368 -8.603 0.501 1.00 0.27 H new ATOM 0 HE1 PHE A 12 18.168 -6.035 4.284 1.00 0.36 H new ATOM 0 HE2 PHE A 12 16.106 -9.444 2.790 1.00 0.28 H new ATOM 0 HZ PHE A 12 16.754 -8.024 4.692 1.00 0.33 H new ATOM 171 N LYS A 13 20.723 -6.331 0.870 1.00 0.18 N ATOM 172 CA LYS A 13 21.731 -5.626 1.648 1.00 0.21 C ATOM 173 C LYS A 13 22.873 -5.205 0.733 1.00 0.19 C ATOM 174 O LYS A 13 23.445 -4.126 0.886 1.00 0.24 O ATOM 175 CB LYS A 13 22.254 -6.505 2.788 1.00 0.26 C ATOM 176 CG LYS A 13 23.541 -5.992 3.414 1.00 0.31 C ATOM 177 CD LYS A 13 23.316 -4.691 4.171 1.00 0.40 C ATOM 178 CE LYS A 13 24.630 -4.076 4.621 1.00 0.68 C ATOM 179 NZ LYS A 13 25.396 -4.989 5.513 1.00 1.53 N ATOM 0 H LYS A 13 20.593 -7.309 1.128 1.00 0.18 H new ATOM 0 HA LYS A 13 21.279 -4.739 2.092 1.00 0.21 H new ATOM 0 HB2 LYS A 13 21.488 -6.577 3.560 1.00 0.26 H new ATOM 0 HB3 LYS A 13 22.421 -7.514 2.410 1.00 0.26 H new ATOM 0 HG2 LYS A 13 23.941 -6.745 4.094 1.00 0.31 H new ATOM 0 HG3 LYS A 13 24.288 -5.836 2.636 1.00 0.31 H new ATOM 0 HD2 LYS A 13 22.782 -3.986 3.534 1.00 0.40 H new ATOM 0 HD3 LYS A 13 22.684 -4.878 5.039 1.00 0.40 H new ATOM 0 HE2 LYS A 13 25.234 -3.832 3.747 1.00 0.68 H new ATOM 0 HE3 LYS A 13 24.432 -3.140 5.144 1.00 0.68 H new ATOM 0 HZ1 LYS A 13 26.226 -4.489 5.892 1.00 1.53 H new ATOM 0 HZ2 LYS A 13 24.789 -5.297 6.299 1.00 1.53 H new ATOM 0 HZ3 LYS A 13 25.710 -5.820 4.972 1.00 1.53 H new ATOM 193 N ASP A 14 23.201 -6.074 -0.222 1.00 0.16 N ATOM 194 CA ASP A 14 24.253 -5.786 -1.185 1.00 0.19 C ATOM 195 C ASP A 14 23.801 -4.660 -2.106 1.00 0.18 C ATOM 196 O ASP A 14 24.505 -3.667 -2.292 1.00 0.20 O ATOM 197 CB ASP A 14 24.585 -7.035 -2.002 1.00 0.23 C ATOM 198 CG ASP A 14 25.753 -6.817 -2.942 1.00 0.30 C ATOM 199 OD1 ASP A 14 26.910 -6.993 -2.503 1.00 0.38 O ATOM 200 OD2 ASP A 14 25.513 -6.470 -4.117 1.00 0.39 O ATOM 0 H ASP A 14 22.752 -6.981 -0.346 1.00 0.16 H new ATOM 0 HA ASP A 14 25.152 -5.477 -0.651 1.00 0.19 H new ATOM 0 HB2 ASP A 14 24.816 -7.858 -1.325 1.00 0.23 H new ATOM 0 HB3 ASP A 14 23.709 -7.332 -2.578 1.00 0.23 H new ATOM 205 N ALA A 15 22.612 -4.824 -2.677 1.00 0.17 N ATOM 206 CA ALA A 15 22.048 -3.819 -3.567 1.00 0.19 C ATOM 207 C ALA A 15 21.802 -2.513 -2.814 1.00 0.20 C ATOM 208 O ALA A 15 21.580 -1.467 -3.420 1.00 0.24 O ATOM 209 CB ALA A 15 20.751 -4.328 -4.185 1.00 0.22 C ATOM 0 H ALA A 15 22.021 -5.644 -2.538 1.00 0.17 H new ATOM 0 HA ALA A 15 22.763 -3.625 -4.367 1.00 0.19 H new ATOM 0 HB1 ALA A 15 20.340 -3.566 -4.848 1.00 0.22 H new ATOM 0 HB2 ALA A 15 20.951 -5.236 -4.755 1.00 0.22 H new ATOM 0 HB3 ALA A 15 20.033 -4.547 -3.395 1.00 0.22 H new ATOM 215 N PHE A 16 21.845 -2.590 -1.487 1.00 0.21 N ATOM 216 CA PHE A 16 21.620 -1.427 -0.636 1.00 0.25 C ATOM 217 C PHE A 16 22.873 -0.568 -0.531 1.00 0.23 C ATOM 218 O PHE A 16 22.813 0.652 -0.669 1.00 0.24 O ATOM 219 CB PHE A 16 21.170 -1.875 0.758 1.00 0.31 C ATOM 220 CG PHE A 16 21.093 -0.760 1.761 1.00 0.35 C ATOM 221 CD1 PHE A 16 20.125 0.223 1.644 1.00 0.43 C ATOM 222 CD2 PHE A 16 21.988 -0.694 2.816 1.00 0.41 C ATOM 223 CE1 PHE A 16 20.051 1.253 2.562 1.00 0.52 C ATOM 224 CE2 PHE A 16 21.919 0.334 3.736 1.00 0.50 C ATOM 225 CZ PHE A 16 20.950 1.297 3.620 1.00 0.54 C ATOM 0 H PHE A 16 22.035 -3.452 -0.976 1.00 0.21 H new ATOM 0 HA PHE A 16 20.835 -0.823 -1.091 1.00 0.25 H new ATOM 0 HB2 PHE A 16 20.191 -2.347 0.679 1.00 0.31 H new ATOM 0 HB3 PHE A 16 21.861 -2.634 1.125 1.00 0.31 H new ATOM 0 HD1 PHE A 16 19.420 0.184 0.827 1.00 0.43 H new ATOM 0 HD2 PHE A 16 22.748 -1.454 2.920 1.00 0.41 H new ATOM 0 HE1 PHE A 16 19.298 2.020 2.457 1.00 0.52 H new ATOM 0 HE2 PHE A 16 22.630 0.379 4.548 1.00 0.50 H new ATOM 0 HZ PHE A 16 20.886 2.089 4.351 1.00 0.54 H new ATOM 235 N VAL A 17 24.008 -1.212 -0.285 1.00 0.23 N ATOM 236 CA VAL A 17 25.269 -0.501 -0.156 1.00 0.24 C ATOM 237 C VAL A 17 25.725 0.046 -1.502 1.00 0.23 C ATOM 238 O VAL A 17 26.510 0.993 -1.564 1.00 0.28 O ATOM 239 CB VAL A 17 26.372 -1.404 0.428 1.00 0.28 C ATOM 240 CG1 VAL A 17 26.047 -1.780 1.865 1.00 0.90 C ATOM 241 CG2 VAL A 17 26.559 -2.647 -0.426 1.00 0.76 C ATOM 0 H VAL A 17 24.078 -2.223 -0.171 1.00 0.23 H new ATOM 0 HA VAL A 17 25.098 0.328 0.531 1.00 0.24 H new ATOM 0 HB VAL A 17 27.309 -0.847 0.423 1.00 0.28 H new ATOM 0 HG11 VAL A 17 26.837 -2.418 2.262 1.00 0.90 H new ATOM 0 HG12 VAL A 17 25.973 -0.876 2.470 1.00 0.90 H new ATOM 0 HG13 VAL A 17 25.098 -2.316 1.895 1.00 0.90 H new ATOM 0 HG21 VAL A 17 27.343 -3.270 0.005 1.00 0.76 H new ATOM 0 HG22 VAL A 17 25.626 -3.209 -0.460 1.00 0.76 H new ATOM 0 HG23 VAL A 17 26.843 -2.355 -1.437 1.00 0.76 H new ATOM 251 N GLN A 18 25.228 -0.557 -2.577 1.00 0.20 N ATOM 252 CA GLN A 18 25.580 -0.122 -3.923 1.00 0.21 C ATOM 253 C GLN A 18 25.085 1.297 -4.195 1.00 0.21 C ATOM 254 O GLN A 18 25.639 2.001 -5.040 1.00 0.26 O ATOM 255 CB GLN A 18 25.000 -1.081 -4.965 1.00 0.24 C ATOM 256 CG GLN A 18 25.697 -2.431 -5.011 1.00 0.29 C ATOM 257 CD GLN A 18 25.316 -3.247 -6.234 1.00 1.04 C ATOM 258 OE1 GLN A 18 24.099 -3.047 -6.730 1.00 1.86 O flip ATOM 259 NE2 GLN A 18 26.110 -4.048 -6.730 1.00 1.60 N flip ATOM 0 H GLN A 18 24.582 -1.346 -2.542 1.00 0.20 H new ATOM 0 HA GLN A 18 26.667 -0.127 -3.997 1.00 0.21 H new ATOM 0 HB2 GLN A 18 23.942 -1.236 -4.754 1.00 0.24 H new ATOM 0 HB3 GLN A 18 25.064 -0.616 -5.949 1.00 0.24 H new ATOM 0 HG2 GLN A 18 26.776 -2.278 -5.003 1.00 0.29 H new ATOM 0 HG3 GLN A 18 25.448 -2.994 -4.112 1.00 0.29 H new ATOM 0 HE21 GLN A 18 27.035 -4.171 -6.318 1.00 1.60 H new ATOM 0 HE22 GLN A 18 25.843 -4.588 -7.553 1.00 1.60 H new ATOM 268 N PHE A 19 24.043 1.716 -3.478 1.00 0.22 N ATOM 269 CA PHE A 19 23.485 3.055 -3.661 1.00 0.25 C ATOM 270 C PHE A 19 23.935 4.008 -2.558 1.00 0.23 C ATOM 271 O PHE A 19 23.471 5.145 -2.484 1.00 0.32 O ATOM 272 CB PHE A 19 21.956 2.999 -3.718 1.00 0.29 C ATOM 273 CG PHE A 19 21.430 2.338 -4.962 1.00 0.30 C ATOM 274 CD1 PHE A 19 21.610 0.980 -5.168 1.00 0.44 C ATOM 275 CD2 PHE A 19 20.751 3.073 -5.920 1.00 0.64 C ATOM 276 CE1 PHE A 19 21.124 0.368 -6.308 1.00 0.46 C ATOM 277 CE2 PHE A 19 20.262 2.466 -7.061 1.00 0.69 C ATOM 278 CZ PHE A 19 20.468 1.119 -7.268 1.00 0.42 C ATOM 0 H PHE A 19 23.571 1.153 -2.770 1.00 0.22 H new ATOM 0 HA PHE A 19 23.862 3.438 -4.609 1.00 0.25 H new ATOM 0 HB2 PHE A 19 21.586 2.461 -2.845 1.00 0.29 H new ATOM 0 HB3 PHE A 19 21.560 4.013 -3.659 1.00 0.29 H new ATOM 0 HD1 PHE A 19 22.136 0.393 -4.430 1.00 0.44 H new ATOM 0 HD2 PHE A 19 20.602 4.133 -5.773 1.00 0.64 H new ATOM 0 HE1 PHE A 19 21.256 -0.695 -6.450 1.00 0.46 H new ATOM 0 HE2 PHE A 19 19.718 3.047 -7.791 1.00 0.69 H new ATOM 0 HZ PHE A 19 20.119 0.651 -8.176 1.00 0.42 H new ATOM 288 N ASP A 20 24.840 3.540 -1.704 1.00 0.25 N ATOM 289 CA ASP A 20 25.355 4.361 -0.614 1.00 0.24 C ATOM 290 C ASP A 20 26.135 5.552 -1.167 1.00 0.24 C ATOM 291 O ASP A 20 27.310 5.429 -1.511 1.00 0.29 O ATOM 292 CB ASP A 20 26.250 3.522 0.300 1.00 0.28 C ATOM 293 CG ASP A 20 26.953 4.359 1.350 1.00 0.32 C ATOM 294 OD1 ASP A 20 26.349 4.606 2.415 1.00 0.37 O ATOM 295 OD2 ASP A 20 28.108 4.765 1.108 1.00 0.37 O ATOM 0 H ASP A 20 25.231 2.599 -1.746 1.00 0.25 H new ATOM 0 HA ASP A 20 24.513 4.737 -0.033 1.00 0.24 H new ATOM 0 HB2 ASP A 20 25.648 2.758 0.792 1.00 0.28 H new ATOM 0 HB3 ASP A 20 26.994 3.001 -0.303 1.00 0.28 H new ATOM 300 N LYS A 21 25.473 6.705 -1.253 1.00 0.24 N ATOM 301 CA LYS A 21 26.110 7.910 -1.779 1.00 0.30 C ATOM 302 C LYS A 21 26.742 8.750 -0.671 1.00 0.29 C ATOM 303 O LYS A 21 27.964 8.876 -0.598 1.00 0.33 O ATOM 304 CB LYS A 21 25.092 8.748 -2.553 1.00 0.36 C ATOM 305 CG LYS A 21 24.637 8.099 -3.850 1.00 0.90 C ATOM 306 CD LYS A 21 25.745 8.098 -4.893 1.00 1.04 C ATOM 307 CE LYS A 21 25.297 7.422 -6.180 1.00 1.70 C ATOM 308 NZ LYS A 21 26.379 7.401 -7.203 1.00 2.47 N ATOM 0 H LYS A 21 24.502 6.829 -0.967 1.00 0.24 H new ATOM 0 HA LYS A 21 26.908 7.593 -2.451 1.00 0.30 H new ATOM 0 HB2 LYS A 21 24.223 8.926 -1.920 1.00 0.36 H new ATOM 0 HB3 LYS A 21 25.528 9.722 -2.776 1.00 0.36 H new ATOM 0 HG2 LYS A 21 24.320 7.075 -3.654 1.00 0.90 H new ATOM 0 HG3 LYS A 21 23.770 8.632 -4.240 1.00 0.90 H new ATOM 0 HD2 LYS A 21 26.047 9.123 -5.105 1.00 1.04 H new ATOM 0 HD3 LYS A 21 26.620 7.583 -4.496 1.00 1.04 H new ATOM 0 HE2 LYS A 21 24.983 6.401 -5.963 1.00 1.70 H new ATOM 0 HE3 LYS A 21 24.429 7.945 -6.581 1.00 1.70 H new ATOM 0 HZ1 LYS A 21 26.033 6.932 -8.064 1.00 2.47 H new ATOM 0 HZ2 LYS A 21 26.662 8.376 -7.429 1.00 2.47 H new ATOM 0 HZ3 LYS A 21 27.199 6.880 -6.831 1.00 2.47 H new ATOM 322 N GLU A 22 25.902 9.324 0.187 1.00 0.27 N ATOM 323 CA GLU A 22 26.375 10.166 1.283 1.00 0.29 C ATOM 324 C GLU A 22 27.364 9.422 2.179 1.00 0.31 C ATOM 325 O GLU A 22 28.216 10.037 2.819 1.00 0.41 O ATOM 326 CB GLU A 22 25.193 10.667 2.113 1.00 0.31 C ATOM 327 CG GLU A 22 24.201 11.499 1.316 1.00 0.35 C ATOM 328 CD GLU A 22 24.847 12.706 0.663 1.00 0.51 C ATOM 329 OE1 GLU A 22 24.913 13.769 1.317 1.00 0.93 O ATOM 330 OE2 GLU A 22 25.284 12.590 -0.501 1.00 0.44 O ATOM 0 H GLU A 22 24.888 9.221 0.144 1.00 0.27 H new ATOM 0 HA GLU A 22 26.895 11.017 0.844 1.00 0.29 H new ATOM 0 HB2 GLU A 22 24.673 9.811 2.544 1.00 0.31 H new ATOM 0 HB3 GLU A 22 25.570 11.263 2.944 1.00 0.31 H new ATOM 0 HG2 GLU A 22 23.744 10.876 0.548 1.00 0.35 H new ATOM 0 HG3 GLU A 22 23.399 11.832 1.975 1.00 0.35 H new ATOM 337 N GLY A 23 27.243 8.100 2.222 1.00 0.31 N ATOM 338 CA GLY A 23 28.135 7.300 3.041 1.00 0.34 C ATOM 339 C GLY A 23 27.773 7.343 4.513 1.00 0.34 C ATOM 340 O GLY A 23 28.503 6.816 5.354 1.00 0.39 O ATOM 0 H GLY A 23 26.543 7.568 1.705 1.00 0.31 H new ATOM 0 HA2 GLY A 23 28.111 6.267 2.695 1.00 0.34 H new ATOM 0 HA3 GLY A 23 29.157 7.655 2.912 1.00 0.34 H new ATOM 344 N THR A 24 26.643 7.969 4.824 1.00 0.34 N ATOM 345 CA THR A 24 26.181 8.079 6.204 1.00 0.38 C ATOM 346 C THR A 24 25.500 6.790 6.653 1.00 0.36 C ATOM 347 O THR A 24 24.620 6.809 7.514 1.00 0.40 O ATOM 348 CB THR A 24 25.189 9.250 6.366 1.00 0.41 C ATOM 349 OG1 THR A 24 24.883 9.447 7.751 1.00 1.23 O ATOM 350 CG2 THR A 24 23.906 8.984 5.595 1.00 1.39 C ATOM 0 H THR A 24 26.029 8.409 4.138 1.00 0.34 H new ATOM 0 HA THR A 24 27.058 8.262 6.824 1.00 0.38 H new ATOM 0 HB THR A 24 25.657 10.149 5.965 1.00 0.41 H new ATOM 0 HG1 THR A 24 24.772 8.577 8.188 1.00 1.23 H new ATOM 0 HG21 THR A 24 23.223 9.823 5.725 1.00 1.39 H new ATOM 0 HG22 THR A 24 24.136 8.864 4.536 1.00 1.39 H new ATOM 0 HG23 THR A 24 23.438 8.074 5.970 1.00 1.39 H new ATOM 358 N GLY A 25 25.917 5.669 6.074 1.00 0.34 N ATOM 359 CA GLY A 25 25.309 4.398 6.413 1.00 0.37 C ATOM 360 C GLY A 25 23.889 4.326 5.900 1.00 0.31 C ATOM 361 O GLY A 25 23.142 3.401 6.222 1.00 0.36 O ATOM 0 H GLY A 25 26.662 5.619 5.379 1.00 0.34 H new ATOM 0 HA2 GLY A 25 25.896 3.584 5.987 1.00 0.37 H new ATOM 0 HA3 GLY A 25 25.317 4.264 7.495 1.00 0.37 H new ATOM 365 N LYS A 26 23.526 5.318 5.093 1.00 0.27 N ATOM 366 CA LYS A 26 22.192 5.414 4.524 1.00 0.23 C ATOM 367 C LYS A 26 22.258 5.807 3.050 1.00 0.21 C ATOM 368 O LYS A 26 23.236 6.407 2.604 1.00 0.24 O ATOM 369 CB LYS A 26 21.378 6.448 5.297 1.00 0.25 C ATOM 370 CG LYS A 26 21.361 6.214 6.799 1.00 0.29 C ATOM 371 CD LYS A 26 20.419 7.174 7.511 1.00 0.51 C ATOM 372 CE LYS A 26 20.744 8.628 7.221 1.00 0.89 C ATOM 373 NZ LYS A 26 21.947 9.093 7.965 1.00 1.58 N ATOM 0 H LYS A 26 24.150 6.076 4.817 1.00 0.27 H new ATOM 0 HA LYS A 26 21.712 4.438 4.600 1.00 0.23 H new ATOM 0 HB2 LYS A 26 21.784 7.440 5.097 1.00 0.25 H new ATOM 0 HB3 LYS A 26 20.353 6.442 4.926 1.00 0.25 H new ATOM 0 HG2 LYS A 26 21.056 5.188 7.003 1.00 0.29 H new ATOM 0 HG3 LYS A 26 22.369 6.332 7.197 1.00 0.29 H new ATOM 0 HD2 LYS A 26 19.394 6.966 7.205 1.00 0.51 H new ATOM 0 HD3 LYS A 26 20.472 7.000 8.586 1.00 0.51 H new ATOM 0 HE2 LYS A 26 20.908 8.756 6.151 1.00 0.89 H new ATOM 0 HE3 LYS A 26 19.890 9.250 7.489 1.00 0.89 H new ATOM 0 HZ1 LYS A 26 22.293 9.980 7.546 1.00 1.58 H new ATOM 0 HZ2 LYS A 26 21.698 9.255 8.962 1.00 1.58 H new ATOM 0 HZ3 LYS A 26 22.692 8.370 7.907 1.00 1.58 H new ATOM 387 N ILE A 27 21.215 5.466 2.295 1.00 0.19 N ATOM 388 CA ILE A 27 21.170 5.790 0.871 1.00 0.20 C ATOM 389 C ILE A 27 20.045 6.770 0.563 1.00 0.19 C ATOM 390 O ILE A 27 19.052 6.837 1.285 1.00 0.23 O ATOM 391 CB ILE A 27 21.004 4.530 0.000 1.00 0.23 C ATOM 392 CG1 ILE A 27 19.559 4.027 0.034 1.00 0.26 C ATOM 393 CG2 ILE A 27 21.958 3.445 0.468 1.00 0.25 C ATOM 394 CD1 ILE A 27 18.998 3.739 -1.339 1.00 0.54 C ATOM 0 H ILE A 27 20.395 4.969 2.643 1.00 0.19 H new ATOM 0 HA ILE A 27 22.126 6.254 0.628 1.00 0.20 H new ATOM 0 HB ILE A 27 21.244 4.789 -1.031 1.00 0.23 H new ATOM 0 HG12 ILE A 27 19.511 3.120 0.637 1.00 0.26 H new ATOM 0 HG13 ILE A 27 18.933 4.771 0.527 1.00 0.26 H new ATOM 0 HG21 ILE A 27 21.834 2.558 -0.153 1.00 0.25 H new ATOM 0 HG22 ILE A 27 22.984 3.803 0.388 1.00 0.25 H new ATOM 0 HG23 ILE A 27 21.742 3.194 1.506 1.00 0.25 H new ATOM 0 HD11 ILE A 27 17.971 3.386 -1.246 1.00 0.54 H new ATOM 0 HD12 ILE A 27 19.016 4.650 -1.938 1.00 0.54 H new ATOM 0 HD13 ILE A 27 19.602 2.973 -1.826 1.00 0.54 H new ATOM 406 N ALA A 28 20.203 7.518 -0.523 1.00 0.23 N ATOM 407 CA ALA A 28 19.216 8.513 -0.916 1.00 0.25 C ATOM 408 C ALA A 28 17.893 7.874 -1.349 1.00 0.25 C ATOM 409 O ALA A 28 17.878 6.864 -2.053 1.00 0.28 O ATOM 410 CB ALA A 28 19.771 9.384 -2.032 1.00 0.31 C ATOM 0 H ALA A 28 21.007 7.453 -1.147 1.00 0.23 H new ATOM 0 HA ALA A 28 19.006 9.131 -0.043 1.00 0.25 H new ATOM 0 HB1 ALA A 28 19.026 10.126 -2.320 1.00 0.31 H new ATOM 0 HB2 ALA A 28 20.672 9.890 -1.685 1.00 0.31 H new ATOM 0 HB3 ALA A 28 20.014 8.761 -2.893 1.00 0.31 H new ATOM 416 N THR A 29 16.785 8.481 -0.915 1.00 0.28 N ATOM 417 CA THR A 29 15.444 8.001 -1.250 1.00 0.31 C ATOM 418 C THR A 29 15.174 8.109 -2.742 1.00 0.32 C ATOM 419 O THR A 29 14.460 7.286 -3.314 1.00 0.34 O ATOM 420 CB THR A 29 14.360 8.799 -0.502 1.00 0.39 C ATOM 421 OG1 THR A 29 14.461 10.189 -0.830 1.00 0.40 O ATOM 422 CG2 THR A 29 14.495 8.617 1.001 1.00 0.43 C ATOM 0 H THR A 29 16.793 9.313 -0.326 1.00 0.28 H new ATOM 0 HA THR A 29 15.404 6.955 -0.946 1.00 0.31 H new ATOM 0 HB THR A 29 13.385 8.423 -0.811 1.00 0.39 H new ATOM 0 HG1 THR A 29 13.767 10.689 -0.352 1.00 0.40 H new ATOM 0 HG21 THR A 29 13.719 9.190 1.508 1.00 0.43 H new ATOM 0 HG22 THR A 29 14.388 7.561 1.251 1.00 0.43 H new ATOM 0 HG23 THR A 29 15.475 8.969 1.324 1.00 0.43 H new ATOM 430 N ARG A 30 15.739 9.135 -3.368 1.00 0.35 N ATOM 431 CA ARG A 30 15.562 9.346 -4.798 1.00 0.40 C ATOM 432 C ARG A 30 16.121 8.163 -5.582 1.00 0.40 C ATOM 433 O ARG A 30 15.914 8.050 -6.791 1.00 0.52 O ATOM 434 CB ARG A 30 16.244 10.643 -5.232 1.00 0.46 C ATOM 435 CG ARG A 30 15.611 11.891 -4.637 1.00 0.50 C ATOM 436 CD ARG A 30 16.342 13.149 -5.077 1.00 0.73 C ATOM 437 NE ARG A 30 16.404 13.265 -6.531 1.00 1.71 N ATOM 438 CZ ARG A 30 16.271 14.415 -7.188 1.00 2.26 C ATOM 439 NH1 ARG A 30 16.060 15.542 -6.523 1.00 2.04 N ATOM 440 NH2 ARG A 30 16.348 14.436 -8.512 1.00 3.39 N ATOM 0 H ARG A 30 16.323 9.833 -2.907 1.00 0.35 H new ATOM 0 HA ARG A 30 14.496 9.428 -5.008 1.00 0.40 H new ATOM 0 HB2 ARG A 30 17.295 10.606 -4.944 1.00 0.46 H new ATOM 0 HB3 ARG A 30 16.214 10.713 -6.319 1.00 0.46 H new ATOM 0 HG2 ARG A 30 14.566 11.951 -4.941 1.00 0.50 H new ATOM 0 HG3 ARG A 30 15.623 11.823 -3.549 1.00 0.50 H new ATOM 0 HD2 ARG A 30 15.839 14.024 -4.665 1.00 0.73 H new ATOM 0 HD3 ARG A 30 17.353 13.142 -4.670 1.00 0.73 H new ATOM 0 HE ARG A 30 16.558 12.416 -7.075 1.00 1.71 H new ATOM 0 HH11 ARG A 30 15.999 15.530 -5.505 1.00 2.04 H new ATOM 0 HH12 ARG A 30 15.959 16.422 -7.029 1.00 2.04 H new ATOM 0 HH21 ARG A 30 16.509 13.571 -9.027 1.00 3.39 H new ATOM 0 HH22 ARG A 30 16.246 15.318 -9.015 1.00 3.39 H new ATOM 454 N GLU A 31 16.830 7.284 -4.879 1.00 0.33 N ATOM 455 CA GLU A 31 17.417 6.100 -5.492 1.00 0.36 C ATOM 456 C GLU A 31 16.769 4.836 -4.939 1.00 0.31 C ATOM 457 O GLU A 31 16.866 3.763 -5.534 1.00 0.33 O ATOM 458 CB GLU A 31 18.924 6.057 -5.234 1.00 0.42 C ATOM 459 CG GLU A 31 19.548 7.427 -5.038 1.00 0.52 C ATOM 460 CD GLU A 31 21.062 7.376 -4.989 1.00 1.10 C ATOM 461 OE1 GLU A 31 21.614 7.182 -3.886 1.00 2.01 O ATOM 462 OE2 GLU A 31 21.696 7.530 -6.055 1.00 1.12 O ATOM 0 H GLU A 31 17.012 7.372 -3.879 1.00 0.33 H new ATOM 0 HA GLU A 31 17.240 6.150 -6.566 1.00 0.36 H new ATOM 0 HB2 GLU A 31 19.115 5.450 -4.349 1.00 0.42 H new ATOM 0 HB3 GLU A 31 19.413 5.561 -6.072 1.00 0.42 H new ATOM 0 HG2 GLU A 31 19.236 8.084 -5.850 1.00 0.52 H new ATOM 0 HG3 GLU A 31 19.173 7.864 -4.113 1.00 0.52 H new ATOM 469 N LEU A 32 16.112 4.978 -3.789 1.00 0.31 N ATOM 470 CA LEU A 32 15.446 3.856 -3.136 1.00 0.33 C ATOM 471 C LEU A 32 14.509 3.143 -4.106 1.00 0.29 C ATOM 472 O LEU A 32 14.536 1.919 -4.217 1.00 0.29 O ATOM 473 CB LEU A 32 14.669 4.351 -1.906 1.00 0.40 C ATOM 474 CG LEU A 32 14.390 3.308 -0.813 1.00 0.57 C ATOM 475 CD1 LEU A 32 13.330 2.323 -1.270 1.00 1.39 C ATOM 476 CD2 LEU A 32 15.663 2.573 -0.416 1.00 1.39 C ATOM 0 H LEU A 32 16.027 5.863 -3.290 1.00 0.31 H new ATOM 0 HA LEU A 32 16.204 3.143 -2.812 1.00 0.33 H new ATOM 0 HB2 LEU A 32 15.225 5.175 -1.459 1.00 0.40 H new ATOM 0 HB3 LEU A 32 13.715 4.756 -2.244 1.00 0.40 H new ATOM 0 HG LEU A 32 14.018 3.837 0.064 1.00 0.57 H new ATOM 0 HD11 LEU A 32 13.147 1.593 -0.481 1.00 1.39 H new ATOM 0 HD12 LEU A 32 12.406 2.858 -1.490 1.00 1.39 H new ATOM 0 HD13 LEU A 32 13.674 1.809 -2.168 1.00 1.39 H new ATOM 0 HD21 LEU A 32 15.434 1.842 0.359 1.00 1.39 H new ATOM 0 HD22 LEU A 32 16.075 2.063 -1.287 1.00 1.39 H new ATOM 0 HD23 LEU A 32 16.393 3.288 -0.036 1.00 1.39 H new ATOM 488 N GLY A 33 13.685 3.917 -4.810 1.00 0.33 N ATOM 489 CA GLY A 33 12.760 3.335 -5.766 1.00 0.35 C ATOM 490 C GLY A 33 13.467 2.470 -6.790 1.00 0.33 C ATOM 491 O GLY A 33 13.039 1.350 -7.068 1.00 0.41 O ATOM 0 H GLY A 33 13.642 4.933 -4.735 1.00 0.33 H new ATOM 0 HA2 GLY A 33 12.020 2.736 -5.235 1.00 0.35 H new ATOM 0 HA3 GLY A 33 12.219 4.131 -6.277 1.00 0.35 H new ATOM 495 N THR A 34 14.554 2.992 -7.353 1.00 0.30 N ATOM 496 CA THR A 34 15.335 2.251 -8.337 1.00 0.31 C ATOM 497 C THR A 34 15.865 0.965 -7.718 1.00 0.27 C ATOM 498 O THR A 34 16.087 -0.035 -8.403 1.00 0.30 O ATOM 499 CB THR A 34 16.520 3.086 -8.858 1.00 0.37 C ATOM 500 OG1 THR A 34 16.045 4.317 -9.415 1.00 0.42 O ATOM 501 CG2 THR A 34 17.308 2.320 -9.912 1.00 0.41 C ATOM 0 H THR A 34 14.913 3.924 -7.144 1.00 0.30 H new ATOM 0 HA THR A 34 14.678 2.019 -9.176 1.00 0.31 H new ATOM 0 HB THR A 34 17.181 3.296 -8.017 1.00 0.37 H new ATOM 0 HG1 THR A 34 16.805 4.843 -9.742 1.00 0.42 H new ATOM 0 HG21 THR A 34 18.138 2.933 -10.262 1.00 0.41 H new ATOM 0 HG22 THR A 34 17.695 1.398 -9.478 1.00 0.41 H new ATOM 0 HG23 THR A 34 16.655 2.080 -10.751 1.00 0.41 H new ATOM 509 N LEU A 35 16.064 1.005 -6.406 1.00 0.27 N ATOM 510 CA LEU A 35 16.560 -0.146 -5.670 1.00 0.30 C ATOM 511 C LEU A 35 15.455 -1.175 -5.487 1.00 0.31 C ATOM 512 O LEU A 35 15.713 -2.374 -5.403 1.00 0.37 O ATOM 513 CB LEU A 35 17.085 0.296 -4.304 1.00 0.35 C ATOM 514 CG LEU A 35 18.475 -0.222 -3.941 1.00 0.50 C ATOM 515 CD1 LEU A 35 18.947 0.396 -2.635 1.00 1.23 C ATOM 516 CD2 LEU A 35 18.470 -1.740 -3.843 1.00 1.25 C ATOM 0 H LEU A 35 15.888 1.828 -5.830 1.00 0.27 H new ATOM 0 HA LEU A 35 17.372 -0.599 -6.239 1.00 0.30 H new ATOM 0 HB2 LEU A 35 17.102 1.385 -4.275 1.00 0.35 H new ATOM 0 HB3 LEU A 35 16.382 -0.032 -3.539 1.00 0.35 H new ATOM 0 HG LEU A 35 19.169 0.068 -4.730 1.00 0.50 H new ATOM 0 HD11 LEU A 35 19.939 0.016 -2.390 1.00 1.23 H new ATOM 0 HD12 LEU A 35 18.989 1.480 -2.740 1.00 1.23 H new ATOM 0 HD13 LEU A 35 18.252 0.135 -1.837 1.00 1.23 H new ATOM 0 HD21 LEU A 35 19.469 -2.091 -3.584 1.00 1.25 H new ATOM 0 HD22 LEU A 35 17.764 -2.053 -3.073 1.00 1.25 H new ATOM 0 HD23 LEU A 35 18.173 -2.166 -4.802 1.00 1.25 H new ATOM 528 N MET A 36 14.219 -0.692 -5.420 1.00 0.35 N ATOM 529 CA MET A 36 13.067 -1.567 -5.238 1.00 0.43 C ATOM 530 C MET A 36 12.646 -2.218 -6.551 1.00 0.43 C ATOM 531 O MET A 36 12.036 -3.288 -6.548 1.00 0.54 O ATOM 532 CB MET A 36 11.900 -0.786 -4.634 1.00 0.56 C ATOM 533 CG MET A 36 12.280 -0.027 -3.376 1.00 0.59 C ATOM 534 SD MET A 36 10.871 0.317 -2.307 1.00 1.21 S ATOM 535 CE MET A 36 10.509 -1.322 -1.687 1.00 0.72 C ATOM 0 H MET A 36 13.990 0.299 -5.489 1.00 0.35 H new ATOM 0 HA MET A 36 13.357 -2.362 -4.551 1.00 0.43 H new ATOM 0 HB2 MET A 36 11.519 -0.083 -5.375 1.00 0.56 H new ATOM 0 HB3 MET A 36 11.089 -1.477 -4.404 1.00 0.56 H new ATOM 0 HG2 MET A 36 13.019 -0.604 -2.820 1.00 0.59 H new ATOM 0 HG3 MET A 36 12.755 0.913 -3.655 1.00 0.59 H new ATOM 0 HE1 MET A 36 9.576 -1.300 -1.124 1.00 0.72 H new ATOM 0 HE2 MET A 36 10.412 -2.014 -2.523 1.00 0.72 H new ATOM 0 HE3 MET A 36 11.318 -1.651 -1.035 1.00 0.72 H new ATOM 545 N ARG A 37 12.963 -1.575 -7.673 1.00 0.42 N ATOM 546 CA ARG A 37 12.610 -2.126 -8.977 1.00 0.47 C ATOM 547 C ARG A 37 13.606 -3.212 -9.376 1.00 0.43 C ATOM 548 O ARG A 37 13.232 -4.217 -9.980 1.00 0.47 O ATOM 549 CB ARG A 37 12.551 -1.028 -10.046 1.00 0.55 C ATOM 550 CG ARG A 37 13.901 -0.433 -10.405 1.00 0.95 C ATOM 551 CD ARG A 37 13.784 0.543 -11.564 1.00 1.20 C ATOM 552 NE ARG A 37 15.089 1.018 -12.018 1.00 1.99 N ATOM 553 CZ ARG A 37 15.257 2.072 -12.810 1.00 2.52 C ATOM 554 NH1 ARG A 37 14.205 2.767 -13.227 1.00 2.46 N ATOM 555 NH2 ARG A 37 16.476 2.435 -13.185 1.00 3.51 N ATOM 0 H ARG A 37 13.457 -0.683 -7.705 1.00 0.42 H new ATOM 0 HA ARG A 37 11.617 -2.569 -8.902 1.00 0.47 H new ATOM 0 HB2 ARG A 37 12.097 -1.439 -10.948 1.00 0.55 H new ATOM 0 HB3 ARG A 37 11.897 -0.230 -9.695 1.00 0.55 H new ATOM 0 HG2 ARG A 37 14.318 0.078 -9.537 1.00 0.95 H new ATOM 0 HG3 ARG A 37 14.594 -1.232 -10.668 1.00 0.95 H new ATOM 0 HD2 ARG A 37 13.266 0.060 -12.393 1.00 1.20 H new ATOM 0 HD3 ARG A 37 13.175 1.394 -11.260 1.00 1.20 H new ATOM 0 HE ARG A 37 15.919 0.512 -11.709 1.00 1.99 H new ATOM 0 HH11 ARG A 37 13.266 2.492 -12.939 1.00 2.46 H new ATOM 0 HH12 ARG A 37 14.336 3.576 -13.835 1.00 2.46 H new ATOM 0 HH21 ARG A 37 17.287 1.905 -12.866 1.00 3.51 H new ATOM 0 HH22 ARG A 37 16.603 3.244 -13.793 1.00 3.51 H new ATOM 569 N THR A 38 14.875 -3.000 -9.034 1.00 0.39 N ATOM 570 CA THR A 38 15.920 -3.974 -9.333 1.00 0.39 C ATOM 571 C THR A 38 15.765 -5.201 -8.439 1.00 0.36 C ATOM 572 O THR A 38 16.371 -6.245 -8.679 1.00 0.39 O ATOM 573 CB THR A 38 17.330 -3.379 -9.147 1.00 0.40 C ATOM 574 OG1 THR A 38 18.321 -4.351 -9.501 1.00 0.46 O ATOM 575 CG2 THR A 38 17.549 -2.928 -7.711 1.00 0.32 C ATOM 0 H THR A 38 15.203 -2.164 -8.551 1.00 0.39 H new ATOM 0 HA THR A 38 15.809 -4.260 -10.379 1.00 0.39 H new ATOM 0 HB THR A 38 17.419 -2.510 -9.799 1.00 0.40 H new ATOM 0 HG1 THR A 38 17.934 -5.249 -9.440 1.00 0.46 H new ATOM 0 HG21 THR A 38 18.552 -2.513 -7.609 1.00 0.32 H new ATOM 0 HG22 THR A 38 16.813 -2.167 -7.452 1.00 0.32 H new ATOM 0 HG23 THR A 38 17.440 -3.781 -7.041 1.00 0.32 H new ATOM 583 N LEU A 39 14.940 -5.053 -7.407 1.00 0.33 N ATOM 584 CA LEU A 39 14.675 -6.124 -6.456 1.00 0.34 C ATOM 585 C LEU A 39 13.224 -6.587 -6.570 1.00 0.40 C ATOM 586 O LEU A 39 12.375 -5.861 -7.087 1.00 0.43 O ATOM 587 CB LEU A 39 14.972 -5.654 -5.033 1.00 0.32 C ATOM 588 CG LEU A 39 16.418 -5.221 -4.785 1.00 0.44 C ATOM 589 CD1 LEU A 39 16.552 -4.554 -3.430 1.00 1.05 C ATOM 590 CD2 LEU A 39 17.362 -6.405 -4.880 1.00 1.15 C ATOM 0 H LEU A 39 14.438 -4.188 -7.208 1.00 0.33 H new ATOM 0 HA LEU A 39 15.328 -6.966 -6.688 1.00 0.34 H new ATOM 0 HB2 LEU A 39 14.313 -4.819 -4.797 1.00 0.32 H new ATOM 0 HB3 LEU A 39 14.726 -6.460 -4.341 1.00 0.32 H new ATOM 0 HG LEU A 39 16.689 -4.501 -5.557 1.00 0.44 H new ATOM 0 HD11 LEU A 39 17.588 -4.254 -3.273 1.00 1.05 H new ATOM 0 HD12 LEU A 39 15.909 -3.674 -3.392 1.00 1.05 H new ATOM 0 HD13 LEU A 39 16.255 -5.254 -2.649 1.00 1.05 H new ATOM 0 HD21 LEU A 39 18.384 -6.071 -4.700 1.00 1.15 H new ATOM 0 HD22 LEU A 39 17.087 -7.150 -4.134 1.00 1.15 H new ATOM 0 HD23 LEU A 39 17.294 -6.845 -5.875 1.00 1.15 H new ATOM 602 N GLY A 40 12.957 -7.810 -6.120 1.00 0.45 N ATOM 603 CA GLY A 40 11.615 -8.367 -6.195 1.00 0.52 C ATOM 604 C GLY A 40 10.626 -7.727 -5.234 1.00 0.49 C ATOM 605 O GLY A 40 9.819 -8.421 -4.617 1.00 0.64 O ATOM 0 H GLY A 40 13.651 -8.430 -5.702 1.00 0.45 H new ATOM 0 HA2 GLY A 40 11.242 -8.254 -7.213 1.00 0.52 H new ATOM 0 HA3 GLY A 40 11.665 -9.437 -5.991 1.00 0.52 H new ATOM 609 N GLN A 41 10.688 -6.405 -5.102 1.00 0.46 N ATOM 610 CA GLN A 41 9.775 -5.677 -4.225 1.00 0.44 C ATOM 611 C GLN A 41 8.684 -4.985 -5.037 1.00 0.48 C ATOM 612 O GLN A 41 7.538 -5.436 -5.066 1.00 1.01 O ATOM 613 CB GLN A 41 10.542 -4.645 -3.393 1.00 0.48 C ATOM 614 CG GLN A 41 11.124 -5.192 -2.097 1.00 0.54 C ATOM 615 CD GLN A 41 11.006 -6.702 -1.977 1.00 1.55 C ATOM 616 OE1 GLN A 41 10.027 -7.216 -1.436 1.00 2.37 O ATOM 617 NE2 GLN A 41 12.001 -7.418 -2.487 1.00 2.20 N ATOM 0 H GLN A 41 11.361 -5.815 -5.591 1.00 0.46 H new ATOM 0 HA GLN A 41 9.306 -6.395 -3.552 1.00 0.44 H new ATOM 0 HB2 GLN A 41 11.352 -4.238 -3.998 1.00 0.48 H new ATOM 0 HB3 GLN A 41 9.874 -3.817 -3.156 1.00 0.48 H new ATOM 0 HG2 GLN A 41 12.175 -4.910 -2.031 1.00 0.54 H new ATOM 0 HG3 GLN A 41 10.615 -4.726 -1.253 1.00 0.54 H new ATOM 0 HE21 GLN A 41 12.793 -6.950 -2.927 1.00 2.20 H new ATOM 0 HE22 GLN A 41 11.973 -8.437 -2.439 1.00 2.20 H new ATOM 626 N ASN A 42 9.052 -3.887 -5.691 1.00 0.52 N ATOM 627 CA ASN A 42 8.114 -3.129 -6.513 1.00 0.53 C ATOM 628 C ASN A 42 6.886 -2.700 -5.706 1.00 0.51 C ATOM 629 O ASN A 42 5.799 -3.251 -5.879 1.00 0.59 O ATOM 630 CB ASN A 42 7.682 -3.958 -7.723 1.00 0.66 C ATOM 631 CG ASN A 42 6.783 -3.183 -8.665 1.00 1.27 C ATOM 632 OD1 ASN A 42 6.895 -1.963 -8.786 1.00 2.15 O ATOM 633 ND2 ASN A 42 5.881 -3.889 -9.337 1.00 1.71 N ATOM 0 H ASN A 42 9.996 -3.501 -5.667 1.00 0.52 H new ATOM 0 HA ASN A 42 8.623 -2.229 -6.858 1.00 0.53 H new ATOM 0 HB2 ASN A 42 8.567 -4.294 -8.264 1.00 0.66 H new ATOM 0 HB3 ASN A 42 7.160 -4.851 -7.380 1.00 0.66 H new ATOM 0 HD21 ASN A 42 5.246 -3.421 -9.984 1.00 1.71 H new ATOM 0 HD22 ASN A 42 5.823 -4.899 -9.206 1.00 1.71 H new ATOM 640 N PRO A 43 7.047 -1.709 -4.810 1.00 0.47 N ATOM 641 CA PRO A 43 5.944 -1.198 -3.982 1.00 0.54 C ATOM 642 C PRO A 43 4.924 -0.417 -4.798 1.00 0.54 C ATOM 643 O PRO A 43 4.911 -0.482 -6.029 1.00 0.64 O ATOM 644 CB PRO A 43 6.652 -0.251 -3.011 1.00 0.53 C ATOM 645 CG PRO A 43 7.847 0.205 -3.766 1.00 0.46 C ATOM 646 CD PRO A 43 8.312 -1.006 -4.520 1.00 0.45 C ATOM 0 HA PRO A 43 5.387 -2.004 -3.505 1.00 0.54 H new ATOM 0 HB2 PRO A 43 6.012 0.586 -2.731 1.00 0.53 H new ATOM 0 HB3 PRO A 43 6.932 -0.760 -2.089 1.00 0.53 H new ATOM 0 HG2 PRO A 43 7.598 1.021 -4.444 1.00 0.46 H new ATOM 0 HG3 PRO A 43 8.622 0.574 -3.094 1.00 0.46 H new ATOM 0 HD2 PRO A 43 8.844 -0.736 -5.432 1.00 0.45 H new ATOM 0 HD3 PRO A 43 8.989 -1.619 -3.925 1.00 0.45 H new ATOM 654 N THR A 44 4.071 0.323 -4.100 1.00 0.59 N ATOM 655 CA THR A 44 3.060 1.142 -4.749 1.00 0.65 C ATOM 656 C THR A 44 3.556 2.579 -4.865 1.00 0.57 C ATOM 657 O THR A 44 4.229 3.076 -3.963 1.00 0.51 O ATOM 658 CB THR A 44 1.729 1.123 -3.973 1.00 0.78 C ATOM 659 OG1 THR A 44 1.308 -0.228 -3.755 1.00 1.05 O ATOM 660 CG2 THR A 44 0.646 1.876 -4.734 1.00 1.02 C ATOM 0 H THR A 44 4.061 0.371 -3.081 1.00 0.59 H new ATOM 0 HA THR A 44 2.882 0.726 -5.741 1.00 0.65 H new ATOM 0 HB THR A 44 1.888 1.615 -3.014 1.00 0.78 H new ATOM 0 HG1 THR A 44 0.462 -0.231 -3.260 1.00 1.05 H new ATOM 0 HG21 THR A 44 -0.284 1.848 -4.166 1.00 1.02 H new ATOM 0 HG22 THR A 44 0.954 2.912 -4.876 1.00 1.02 H new ATOM 0 HG23 THR A 44 0.491 1.407 -5.706 1.00 1.02 H new ATOM 668 N GLU A 45 3.237 3.235 -5.977 1.00 0.61 N ATOM 669 CA GLU A 45 3.670 4.613 -6.205 1.00 0.61 C ATOM 670 C GLU A 45 3.511 5.459 -4.946 1.00 0.60 C ATOM 671 O GLU A 45 4.435 6.167 -4.545 1.00 0.56 O ATOM 672 CB GLU A 45 2.874 5.238 -7.352 1.00 0.75 C ATOM 673 CG GLU A 45 3.337 6.638 -7.722 1.00 1.33 C ATOM 674 CD GLU A 45 2.527 7.241 -8.852 1.00 2.16 C ATOM 675 OE1 GLU A 45 2.768 6.870 -10.020 1.00 2.64 O ATOM 676 OE2 GLU A 45 1.649 8.084 -8.569 1.00 2.69 O ATOM 0 H GLU A 45 2.681 2.837 -6.734 1.00 0.61 H new ATOM 0 HA GLU A 45 4.727 4.589 -6.471 1.00 0.61 H new ATOM 0 HB2 GLU A 45 2.951 4.595 -8.229 1.00 0.75 H new ATOM 0 HB3 GLU A 45 1.820 5.274 -7.075 1.00 0.75 H new ATOM 0 HG2 GLU A 45 3.267 7.283 -6.846 1.00 1.33 H new ATOM 0 HG3 GLU A 45 4.388 6.605 -8.011 1.00 1.33 H new ATOM 683 N ALA A 46 2.340 5.374 -4.322 1.00 0.66 N ATOM 684 CA ALA A 46 2.064 6.136 -3.110 1.00 0.70 C ATOM 685 C ALA A 46 3.092 5.849 -2.022 1.00 0.64 C ATOM 686 O ALA A 46 3.624 6.770 -1.409 1.00 0.66 O ATOM 687 CB ALA A 46 0.667 5.833 -2.598 1.00 0.83 C ATOM 0 H ALA A 46 1.568 4.786 -4.636 1.00 0.66 H new ATOM 0 HA ALA A 46 2.129 7.194 -3.365 1.00 0.70 H new ATOM 0 HB1 ALA A 46 0.478 6.410 -1.693 1.00 0.83 H new ATOM 0 HB2 ALA A 46 -0.066 6.101 -3.359 1.00 0.83 H new ATOM 0 HB3 ALA A 46 0.584 4.770 -2.374 1.00 0.83 H new ATOM 693 N GLU A 47 3.365 4.567 -1.788 1.00 0.62 N ATOM 694 CA GLU A 47 4.327 4.167 -0.766 1.00 0.62 C ATOM 695 C GLU A 47 5.684 4.817 -1.013 1.00 0.50 C ATOM 696 O GLU A 47 6.233 5.482 -0.134 1.00 0.48 O ATOM 697 CB GLU A 47 4.476 2.644 -0.734 1.00 0.69 C ATOM 698 CG GLU A 47 5.297 2.141 0.443 1.00 0.75 C ATOM 699 CD GLU A 47 5.426 0.632 0.464 1.00 1.31 C ATOM 700 OE1 GLU A 47 4.499 -0.037 0.965 1.00 1.34 O ATOM 701 OE2 GLU A 47 6.455 0.117 -0.023 1.00 2.23 O ATOM 0 H GLU A 47 2.935 3.791 -2.291 1.00 0.62 H new ATOM 0 HA GLU A 47 3.950 4.505 0.199 1.00 0.62 H new ATOM 0 HB2 GLU A 47 3.486 2.190 -0.697 1.00 0.69 H new ATOM 0 HB3 GLU A 47 4.943 2.313 -1.661 1.00 0.69 H new ATOM 0 HG2 GLU A 47 6.291 2.586 0.404 1.00 0.75 H new ATOM 0 HG3 GLU A 47 4.835 2.475 1.372 1.00 0.75 H new ATOM 708 N LEU A 48 6.216 4.620 -2.215 1.00 0.45 N ATOM 709 CA LEU A 48 7.507 5.188 -2.589 1.00 0.39 C ATOM 710 C LEU A 48 7.518 6.697 -2.345 1.00 0.35 C ATOM 711 O LEU A 48 8.534 7.272 -1.949 1.00 0.34 O ATOM 712 CB LEU A 48 7.800 4.879 -4.059 1.00 0.40 C ATOM 713 CG LEU A 48 9.270 4.621 -4.405 1.00 0.66 C ATOM 714 CD1 LEU A 48 10.128 5.826 -4.056 1.00 1.42 C ATOM 715 CD2 LEU A 48 9.773 3.378 -3.689 1.00 1.39 C ATOM 0 H LEU A 48 5.771 4.069 -2.949 1.00 0.45 H new ATOM 0 HA LEU A 48 8.285 4.739 -1.972 1.00 0.39 H new ATOM 0 HB2 LEU A 48 7.219 4.004 -4.350 1.00 0.40 H new ATOM 0 HB3 LEU A 48 7.445 5.713 -4.664 1.00 0.40 H new ATOM 0 HG LEU A 48 9.344 4.455 -5.480 1.00 0.66 H new ATOM 0 HD11 LEU A 48 11.167 5.619 -4.311 1.00 1.42 H new ATOM 0 HD12 LEU A 48 9.783 6.694 -4.618 1.00 1.42 H new ATOM 0 HD13 LEU A 48 10.050 6.031 -2.988 1.00 1.42 H new ATOM 0 HD21 LEU A 48 10.819 3.209 -3.945 1.00 1.39 H new ATOM 0 HD22 LEU A 48 9.681 3.516 -2.612 1.00 1.39 H new ATOM 0 HD23 LEU A 48 9.180 2.516 -3.996 1.00 1.39 H new ATOM 727 N GLN A 49 6.375 7.327 -2.576 1.00 0.45 N ATOM 728 CA GLN A 49 6.236 8.765 -2.382 1.00 0.52 C ATOM 729 C GLN A 49 6.150 9.110 -0.899 1.00 0.54 C ATOM 730 O GLN A 49 6.554 10.194 -0.479 1.00 0.58 O ATOM 731 CB GLN A 49 4.983 9.267 -3.094 1.00 0.67 C ATOM 732 CG GLN A 49 5.068 9.187 -4.611 1.00 0.70 C ATOM 733 CD GLN A 49 6.117 10.120 -5.187 1.00 0.77 C ATOM 734 OE1 GLN A 49 5.828 11.272 -5.508 1.00 1.21 O ATOM 735 NE2 GLN A 49 7.341 9.624 -5.321 1.00 1.02 N ATOM 0 H GLN A 49 5.526 6.863 -2.900 1.00 0.45 H new ATOM 0 HA GLN A 49 7.117 9.251 -2.802 1.00 0.52 H new ATOM 0 HB2 GLN A 49 4.126 8.685 -2.756 1.00 0.67 H new ATOM 0 HB3 GLN A 49 4.800 10.302 -2.803 1.00 0.67 H new ATOM 0 HG2 GLN A 49 5.298 8.163 -4.905 1.00 0.70 H new ATOM 0 HG3 GLN A 49 4.096 9.431 -5.039 1.00 0.70 H new ATOM 0 HE21 GLN A 49 7.535 8.662 -5.041 1.00 1.02 H new ATOM 0 HE22 GLN A 49 8.087 10.204 -5.704 1.00 1.02 H new ATOM 744 N ASP A 50 5.621 8.178 -0.113 1.00 0.59 N ATOM 745 CA ASP A 50 5.469 8.381 1.323 1.00 0.68 C ATOM 746 C ASP A 50 6.826 8.535 1.992 1.00 0.59 C ATOM 747 O ASP A 50 7.041 9.463 2.771 1.00 0.57 O ATOM 748 CB ASP A 50 4.703 7.219 1.958 1.00 0.88 C ATOM 749 CG ASP A 50 3.235 7.213 1.579 1.00 1.05 C ATOM 750 OD1 ASP A 50 2.540 8.206 1.879 1.00 1.09 O ATOM 751 OD2 ASP A 50 2.782 6.217 0.977 1.00 1.19 O ATOM 0 H ASP A 50 5.290 7.273 -0.447 1.00 0.59 H new ATOM 0 HA ASP A 50 4.899 9.298 1.472 1.00 0.68 H new ATOM 0 HB2 ASP A 50 5.158 6.277 1.650 1.00 0.88 H new ATOM 0 HB3 ASP A 50 4.794 7.278 3.043 1.00 0.88 H new ATOM 756 N LEU A 51 7.741 7.620 1.687 1.00 0.60 N ATOM 757 CA LEU A 51 9.076 7.672 2.261 1.00 0.64 C ATOM 758 C LEU A 51 9.818 8.912 1.790 1.00 0.54 C ATOM 759 O LEU A 51 10.411 9.629 2.592 1.00 0.64 O ATOM 760 CB LEU A 51 9.883 6.431 1.901 1.00 0.76 C ATOM 761 CG LEU A 51 9.621 5.877 0.513 1.00 0.40 C ATOM 762 CD1 LEU A 51 10.917 5.768 -0.275 1.00 0.86 C ATOM 763 CD2 LEU A 51 8.944 4.528 0.626 1.00 0.84 C ATOM 0 H LEU A 51 7.582 6.840 1.050 1.00 0.60 H new ATOM 0 HA LEU A 51 8.961 7.712 3.344 1.00 0.64 H new ATOM 0 HB2 LEU A 51 10.943 6.668 1.987 1.00 0.76 H new ATOM 0 HB3 LEU A 51 9.670 5.652 2.633 1.00 0.76 H new ATOM 0 HG LEU A 51 8.962 6.559 -0.025 1.00 0.40 H new ATOM 0 HD11 LEU A 51 10.707 5.369 -1.267 1.00 0.86 H new ATOM 0 HD12 LEU A 51 11.370 6.755 -0.369 1.00 0.86 H new ATOM 0 HD13 LEU A 51 11.605 5.102 0.246 1.00 0.86 H new ATOM 0 HD21 LEU A 51 8.756 4.131 -0.371 1.00 0.84 H new ATOM 0 HD22 LEU A 51 9.589 3.842 1.174 1.00 0.84 H new ATOM 0 HD23 LEU A 51 7.998 4.639 1.157 1.00 0.84 H new ATOM 775 N ILE A 52 9.790 9.159 0.481 1.00 0.44 N ATOM 776 CA ILE A 52 10.468 10.322 -0.076 1.00 0.48 C ATOM 777 C ILE A 52 9.945 11.606 0.546 1.00 0.53 C ATOM 778 O ILE A 52 10.684 12.570 0.687 1.00 0.68 O ATOM 779 CB ILE A 52 10.307 10.417 -1.605 1.00 0.48 C ATOM 780 CG1 ILE A 52 10.938 9.198 -2.283 1.00 0.48 C ATOM 781 CG2 ILE A 52 10.931 11.709 -2.121 1.00 0.67 C ATOM 782 CD1 ILE A 52 10.750 9.172 -3.785 1.00 0.54 C ATOM 0 H ILE A 52 9.310 8.575 -0.204 1.00 0.44 H new ATOM 0 HA ILE A 52 11.526 10.197 0.156 1.00 0.48 H new ATOM 0 HB ILE A 52 9.244 10.429 -1.848 1.00 0.48 H new ATOM 0 HG12 ILE A 52 12.005 9.180 -2.059 1.00 0.48 H new ATOM 0 HG13 ILE A 52 10.507 8.292 -1.856 1.00 0.48 H new ATOM 0 HG21 ILE A 52 10.811 11.764 -3.203 1.00 0.67 H new ATOM 0 HG22 ILE A 52 10.437 12.562 -1.657 1.00 0.67 H new ATOM 0 HG23 ILE A 52 11.992 11.725 -1.873 1.00 0.67 H new ATOM 0 HD11 ILE A 52 11.223 8.280 -4.196 1.00 0.54 H new ATOM 0 HD12 ILE A 52 9.685 9.158 -4.018 1.00 0.54 H new ATOM 0 HD13 ILE A 52 11.206 10.059 -4.224 1.00 0.54 H new ATOM 794 N ALA A 53 8.668 11.610 0.915 1.00 0.50 N ATOM 795 CA ALA A 53 8.049 12.788 1.513 1.00 0.60 C ATOM 796 C ALA A 53 8.466 12.957 2.969 1.00 0.64 C ATOM 797 O ALA A 53 8.778 14.064 3.409 1.00 0.73 O ATOM 798 CB ALA A 53 6.536 12.703 1.401 1.00 0.67 C ATOM 0 H ALA A 53 8.042 10.811 0.811 1.00 0.50 H new ATOM 0 HA ALA A 53 8.396 13.664 0.964 1.00 0.60 H new ATOM 0 HB1 ALA A 53 6.088 13.589 1.851 1.00 0.67 H new ATOM 0 HB2 ALA A 53 6.252 12.647 0.350 1.00 0.67 H new ATOM 0 HB3 ALA A 53 6.182 11.813 1.921 1.00 0.67 H new ATOM 804 N GLU A 54 8.466 11.858 3.715 1.00 0.63 N ATOM 805 CA GLU A 54 8.846 11.892 5.122 1.00 0.72 C ATOM 806 C GLU A 54 10.322 12.243 5.272 1.00 0.66 C ATOM 807 O GLU A 54 10.686 13.119 6.057 1.00 0.72 O ATOM 808 CB GLU A 54 8.559 10.542 5.784 1.00 0.81 C ATOM 809 CG GLU A 54 8.916 10.498 7.261 1.00 1.18 C ATOM 810 CD GLU A 54 8.121 11.494 8.084 1.00 1.71 C ATOM 811 OE1 GLU A 54 8.553 12.662 8.182 1.00 2.45 O ATOM 812 OE2 GLU A 54 7.068 11.105 8.630 1.00 1.82 O ATOM 0 H GLU A 54 8.207 10.934 3.369 1.00 0.63 H new ATOM 0 HA GLU A 54 8.253 12.661 5.617 1.00 0.72 H new ATOM 0 HB2 GLU A 54 7.501 10.308 5.668 1.00 0.81 H new ATOM 0 HB3 GLU A 54 9.117 9.765 5.261 1.00 0.81 H new ATOM 0 HG2 GLU A 54 8.739 9.493 7.644 1.00 1.18 H new ATOM 0 HG3 GLU A 54 9.980 10.702 7.380 1.00 1.18 H new ATOM 819 N ALA A 55 11.166 11.553 4.513 1.00 0.58 N ATOM 820 CA ALA A 55 12.604 11.787 4.554 1.00 0.56 C ATOM 821 C ALA A 55 12.991 13.013 3.729 1.00 0.58 C ATOM 822 O ALA A 55 14.115 13.507 3.827 1.00 0.62 O ATOM 823 CB ALA A 55 13.349 10.557 4.060 1.00 0.56 C ATOM 0 H ALA A 55 10.877 10.825 3.860 1.00 0.58 H new ATOM 0 HA ALA A 55 12.886 11.980 5.589 1.00 0.56 H new ATOM 0 HB1 ALA A 55 14.422 10.743 4.095 1.00 0.56 H new ATOM 0 HB2 ALA A 55 13.108 9.705 4.696 1.00 0.56 H new ATOM 0 HB3 ALA A 55 13.052 10.339 3.034 1.00 0.56 H new ATOM 829 N GLU A 56 12.051 13.488 2.913 1.00 0.59 N ATOM 830 CA GLU A 56 12.273 14.648 2.045 1.00 0.65 C ATOM 831 C GLU A 56 13.082 15.746 2.732 1.00 0.72 C ATOM 832 O GLU A 56 14.078 16.224 2.187 1.00 0.77 O ATOM 833 CB GLU A 56 10.934 15.235 1.591 1.00 0.72 C ATOM 834 CG GLU A 56 11.049 16.135 0.371 1.00 0.82 C ATOM 835 CD GLU A 56 9.702 16.642 -0.108 1.00 1.52 C ATOM 836 OE1 GLU A 56 9.038 15.922 -0.883 1.00 1.79 O ATOM 837 OE2 GLU A 56 9.312 17.758 0.294 1.00 2.45 O ATOM 0 H GLU A 56 11.118 13.083 2.834 1.00 0.59 H new ATOM 0 HA GLU A 56 12.844 14.290 1.188 1.00 0.65 H new ATOM 0 HB2 GLU A 56 10.246 14.420 1.368 1.00 0.72 H new ATOM 0 HB3 GLU A 56 10.498 15.804 2.413 1.00 0.72 H new ATOM 0 HG2 GLU A 56 11.689 16.984 0.610 1.00 0.82 H new ATOM 0 HG3 GLU A 56 11.535 15.587 -0.436 1.00 0.82 H new ATOM 844 N ASN A 57 12.652 16.144 3.927 1.00 0.77 N ATOM 845 CA ASN A 57 13.327 17.214 4.656 1.00 0.88 C ATOM 846 C ASN A 57 13.688 16.804 6.083 1.00 0.82 C ATOM 847 O ASN A 57 14.239 17.603 6.841 1.00 1.21 O ATOM 848 CB ASN A 57 12.435 18.454 4.671 1.00 1.17 C ATOM 849 CG ASN A 57 11.919 18.789 3.284 1.00 1.21 C ATOM 850 OD1 ASN A 57 10.896 18.064 2.841 1.00 1.80 O flip ATOM 851 ND2 ASN A 57 12.442 19.678 2.612 1.00 1.19 N flip ATOM 0 H ASN A 57 11.846 15.745 4.408 1.00 0.77 H new ATOM 0 HA ASN A 57 14.263 17.433 4.142 1.00 0.88 H new ATOM 0 HB2 ASN A 57 11.593 18.289 5.343 1.00 1.17 H new ATOM 0 HB3 ASN A 57 12.996 19.301 5.065 1.00 1.17 H new ATOM 0 HD21 ASN A 57 13.225 20.210 2.991 1.00 1.19 H new ATOM 0 HD22 ASN A 57 12.092 19.883 1.676 1.00 1.19 H new ATOM 858 N ASN A 58 13.380 15.564 6.449 1.00 1.05 N ATOM 859 CA ASN A 58 13.696 15.070 7.787 1.00 1.01 C ATOM 860 C ASN A 58 15.199 14.853 7.927 1.00 0.95 C ATOM 861 O ASN A 58 15.700 14.534 9.006 1.00 1.57 O ATOM 862 CB ASN A 58 12.949 13.764 8.066 1.00 1.04 C ATOM 863 CG ASN A 58 13.174 13.258 9.479 1.00 1.42 C ATOM 864 OD1 ASN A 58 14.083 12.469 9.730 1.00 1.82 O ATOM 865 ND2 ASN A 58 12.344 13.716 10.410 1.00 1.89 N ATOM 0 H ASN A 58 12.916 14.886 5.844 1.00 1.05 H new ATOM 0 HA ASN A 58 13.377 15.816 8.515 1.00 1.01 H new ATOM 0 HB2 ASN A 58 11.882 13.917 7.904 1.00 1.04 H new ATOM 0 HB3 ASN A 58 13.274 13.004 7.355 1.00 1.04 H new ATOM 0 HD21 ASN A 58 12.447 13.414 11.379 1.00 1.89 H new ATOM 0 HD22 ASN A 58 11.604 14.370 10.156 1.00 1.89 H new ATOM 872 N ASN A 59 15.908 15.039 6.819 1.00 0.75 N ATOM 873 CA ASN A 59 17.354 14.868 6.779 1.00 0.73 C ATOM 874 C ASN A 59 17.884 15.272 5.405 1.00 0.84 C ATOM 875 O ASN A 59 18.561 16.290 5.260 1.00 1.76 O ATOM 876 CB ASN A 59 17.716 13.413 7.099 1.00 0.76 C ATOM 877 CG ASN A 59 19.080 13.011 6.576 1.00 0.95 C ATOM 878 OD1 ASN A 59 19.097 12.117 5.592 1.00 1.75 O flip ATOM 879 ND2 ASN A 59 20.109 13.486 7.057 1.00 0.92 N flip ATOM 0 H ASN A 59 15.497 15.312 5.926 1.00 0.75 H new ATOM 0 HA ASN A 59 17.817 15.509 7.529 1.00 0.73 H new ATOM 0 HB2 ASN A 59 17.690 13.268 8.179 1.00 0.76 H new ATOM 0 HB3 ASN A 59 16.961 12.754 6.671 1.00 0.76 H new ATOM 0 HD21 ASN A 59 20.051 14.170 7.812 1.00 0.92 H new ATOM 0 HD22 ASN A 59 21.020 13.196 6.701 1.00 0.92 H new ATOM 886 N ASN A 60 17.556 14.462 4.403 1.00 0.57 N ATOM 887 CA ASN A 60 17.951 14.709 3.019 1.00 0.52 C ATOM 888 C ASN A 60 17.489 13.558 2.147 1.00 0.42 C ATOM 889 O ASN A 60 17.886 13.435 0.987 1.00 0.53 O ATOM 890 CB ASN A 60 19.467 14.890 2.875 1.00 0.58 C ATOM 891 CG ASN A 60 20.250 13.603 3.061 1.00 0.93 C ATOM 892 OD1 ASN A 60 20.794 13.348 4.134 1.00 1.99 O ATOM 893 ND2 ASN A 60 20.316 12.785 2.013 1.00 0.55 N ATOM 0 H ASN A 60 17.006 13.612 4.528 1.00 0.57 H new ATOM 0 HA ASN A 60 17.477 15.637 2.700 1.00 0.52 H new ATOM 0 HB2 ASN A 60 19.684 15.299 1.888 1.00 0.58 H new ATOM 0 HB3 ASN A 60 19.809 15.623 3.606 1.00 0.58 H new ATOM 0 HD21 ASN A 60 20.833 11.908 2.082 1.00 0.55 H new ATOM 0 HD22 ASN A 60 19.850 13.035 1.141 1.00 0.55 H new ATOM 900 N GLY A 61 16.633 12.719 2.716 1.00 0.37 N ATOM 901 CA GLY A 61 16.136 11.571 1.998 1.00 0.33 C ATOM 902 C GLY A 61 17.100 10.411 2.083 1.00 0.27 C ATOM 903 O GLY A 61 17.647 9.982 1.078 1.00 0.33 O ATOM 0 H GLY A 61 16.275 12.817 3.666 1.00 0.37 H new ATOM 0 HA2 GLY A 61 15.170 11.274 2.406 1.00 0.33 H new ATOM 0 HA3 GLY A 61 15.973 11.835 0.953 1.00 0.33 H new ATOM 907 N GLN A 62 17.330 9.922 3.294 1.00 0.29 N ATOM 908 CA GLN A 62 18.243 8.803 3.506 1.00 0.25 C ATOM 909 C GLN A 62 17.568 7.670 4.281 1.00 0.29 C ATOM 910 O GLN A 62 16.868 7.912 5.264 1.00 0.42 O ATOM 911 CB GLN A 62 19.476 9.277 4.277 1.00 0.30 C ATOM 912 CG GLN A 62 20.415 10.165 3.481 1.00 0.31 C ATOM 913 CD GLN A 62 21.369 9.373 2.612 1.00 0.32 C ATOM 914 OE1 GLN A 62 22.425 8.937 3.065 1.00 0.38 O ATOM 915 NE2 GLN A 62 21.010 9.200 1.353 1.00 0.54 N ATOM 0 H GLN A 62 16.898 10.281 4.145 1.00 0.29 H new ATOM 0 HA GLN A 62 18.538 8.423 2.528 1.00 0.25 H new ATOM 0 HB2 GLN A 62 19.148 9.820 5.163 1.00 0.30 H new ATOM 0 HB3 GLN A 62 20.029 8.404 4.624 1.00 0.30 H new ATOM 0 HG2 GLN A 62 19.829 10.836 2.853 1.00 0.31 H new ATOM 0 HG3 GLN A 62 20.987 10.789 4.167 1.00 0.31 H new ATOM 0 HE21 GLN A 62 20.124 9.579 1.019 1.00 0.54 H new ATOM 0 HE22 GLN A 62 21.619 8.687 0.715 1.00 0.54 H new ATOM 924 N LEU A 63 17.785 6.432 3.833 1.00 0.28 N ATOM 925 CA LEU A 63 17.212 5.264 4.501 1.00 0.37 C ATOM 926 C LEU A 63 18.309 4.397 5.086 1.00 0.27 C ATOM 927 O LEU A 63 19.447 4.418 4.622 1.00 0.23 O ATOM 928 CB LEU A 63 16.372 4.404 3.553 1.00 0.57 C ATOM 929 CG LEU A 63 15.344 5.141 2.705 1.00 0.90 C ATOM 930 CD1 LEU A 63 14.653 6.244 3.498 1.00 1.58 C ATOM 931 CD2 LEU A 63 16.015 5.692 1.469 1.00 1.61 C ATOM 0 H LEU A 63 18.351 6.214 3.013 1.00 0.28 H new ATOM 0 HA LEU A 63 16.564 5.647 5.290 1.00 0.37 H new ATOM 0 HB2 LEU A 63 17.048 3.871 2.884 1.00 0.57 H new ATOM 0 HB3 LEU A 63 15.851 3.652 4.145 1.00 0.57 H new ATOM 0 HG LEU A 63 14.568 4.437 2.404 1.00 0.90 H new ATOM 0 HD11 LEU A 63 13.926 6.749 2.862 1.00 1.58 H new ATOM 0 HD12 LEU A 63 14.143 5.809 4.358 1.00 1.58 H new ATOM 0 HD13 LEU A 63 15.395 6.964 3.843 1.00 1.58 H new ATOM 0 HD21 LEU A 63 15.280 6.220 0.861 1.00 1.61 H new ATOM 0 HD22 LEU A 63 16.807 6.382 1.762 1.00 1.61 H new ATOM 0 HD23 LEU A 63 16.443 4.873 0.891 1.00 1.61 H new ATOM 943 N ASN A 64 17.945 3.611 6.083 1.00 0.31 N ATOM 944 CA ASN A 64 18.886 2.730 6.746 1.00 0.28 C ATOM 945 C ASN A 64 18.539 1.286 6.440 1.00 0.25 C ATOM 946 O ASN A 64 17.412 0.995 6.044 1.00 0.27 O ATOM 947 CB ASN A 64 18.873 2.939 8.264 1.00 0.41 C ATOM 948 CG ASN A 64 18.426 4.326 8.678 1.00 0.53 C ATOM 949 OD1 ASN A 64 18.392 5.254 7.876 1.00 1.34 O ATOM 950 ND2 ASN A 64 18.081 4.471 9.951 1.00 0.95 N ATOM 0 H ASN A 64 16.996 3.566 6.453 1.00 0.31 H new ATOM 0 HA ASN A 64 19.883 2.964 6.373 1.00 0.28 H new ATOM 0 HB2 ASN A 64 18.212 2.202 8.719 1.00 0.41 H new ATOM 0 HB3 ASN A 64 19.873 2.756 8.657 1.00 0.41 H new ATOM 0 HD21 ASN A 64 17.773 5.380 10.296 1.00 0.95 H new ATOM 0 HD22 ASN A 64 18.124 3.673 10.585 1.00 0.95 H new ATOM 957 N PHE A 65 19.508 0.393 6.571 1.00 0.25 N ATOM 958 CA PHE A 65 19.269 -1.021 6.315 1.00 0.26 C ATOM 959 C PHE A 65 17.929 -1.459 6.911 1.00 0.27 C ATOM 960 O PHE A 65 17.280 -2.364 6.394 1.00 0.31 O ATOM 961 CB PHE A 65 20.408 -1.856 6.902 1.00 0.32 C ATOM 962 CG PHE A 65 20.175 -3.338 6.836 1.00 0.30 C ATOM 963 CD1 PHE A 65 20.320 -4.024 5.639 1.00 0.36 C ATOM 964 CD2 PHE A 65 19.805 -4.043 7.967 1.00 0.39 C ATOM 965 CE1 PHE A 65 20.101 -5.387 5.576 1.00 0.44 C ATOM 966 CE2 PHE A 65 19.584 -5.405 7.910 1.00 0.45 C ATOM 967 CZ PHE A 65 19.757 -6.083 6.714 1.00 0.45 C ATOM 0 H PHE A 65 20.462 0.619 6.851 1.00 0.25 H new ATOM 0 HA PHE A 65 19.231 -1.178 5.237 1.00 0.26 H new ATOM 0 HB2 PHE A 65 21.330 -1.619 6.370 1.00 0.32 H new ATOM 0 HB3 PHE A 65 20.557 -1.568 7.943 1.00 0.32 H new ATOM 0 HD1 PHE A 65 20.607 -3.487 4.747 1.00 0.36 H new ATOM 0 HD2 PHE A 65 19.688 -3.522 8.906 1.00 0.39 H new ATOM 0 HE1 PHE A 65 20.200 -5.907 4.634 1.00 0.44 H new ATOM 0 HE2 PHE A 65 19.277 -5.941 8.796 1.00 0.45 H new ATOM 0 HZ PHE A 65 19.623 -7.154 6.674 1.00 0.45 H new ATOM 977 N THR A 66 17.515 -0.794 7.989 1.00 0.28 N ATOM 978 CA THR A 66 16.252 -1.115 8.648 1.00 0.32 C ATOM 979 C THR A 66 15.065 -0.508 7.908 1.00 0.31 C ATOM 980 O THR A 66 13.996 -1.110 7.851 1.00 0.33 O ATOM 981 CB THR A 66 16.221 -0.608 10.098 1.00 0.38 C ATOM 982 OG1 THR A 66 17.542 -0.253 10.527 1.00 0.56 O ATOM 983 CG2 THR A 66 15.648 -1.663 11.030 1.00 0.52 C ATOM 0 H THR A 66 18.035 -0.031 8.423 1.00 0.28 H new ATOM 0 HA THR A 66 16.176 -2.202 8.640 1.00 0.32 H new ATOM 0 HB THR A 66 15.580 0.273 10.134 1.00 0.38 H new ATOM 0 HG1 THR A 66 17.510 0.070 11.452 1.00 0.56 H new ATOM 0 HG21 THR A 66 15.637 -1.280 12.050 1.00 0.52 H new ATOM 0 HG22 THR A 66 14.631 -1.906 10.723 1.00 0.52 H new ATOM 0 HG23 THR A 66 16.265 -2.561 10.986 1.00 0.52 H new ATOM 991 N GLU A 67 15.241 0.697 7.369 1.00 0.30 N ATOM 992 CA GLU A 67 14.168 1.355 6.631 1.00 0.33 C ATOM 993 C GLU A 67 13.798 0.536 5.404 1.00 0.30 C ATOM 994 O GLU A 67 12.629 0.202 5.192 1.00 0.33 O ATOM 995 CB GLU A 67 14.570 2.777 6.214 1.00 0.36 C ATOM 996 CG GLU A 67 14.993 3.652 7.385 1.00 0.42 C ATOM 997 CD GLU A 67 13.873 3.870 8.383 1.00 0.93 C ATOM 998 OE1 GLU A 67 13.073 4.807 8.182 1.00 1.22 O ATOM 999 OE2 GLU A 67 13.796 3.103 9.366 1.00 1.70 O ATOM 0 H GLU A 67 16.107 1.232 7.429 1.00 0.30 H new ATOM 0 HA GLU A 67 13.302 1.428 7.289 1.00 0.33 H new ATOM 0 HB2 GLU A 67 15.390 2.720 5.498 1.00 0.36 H new ATOM 0 HB3 GLU A 67 13.731 3.248 5.702 1.00 0.36 H new ATOM 0 HG2 GLU A 67 15.841 3.191 7.891 1.00 0.42 H new ATOM 0 HG3 GLU A 67 15.333 4.617 7.009 1.00 0.42 H new ATOM 1006 N PHE A 68 14.804 0.202 4.602 1.00 0.27 N ATOM 1007 CA PHE A 68 14.574 -0.581 3.401 1.00 0.26 C ATOM 1008 C PHE A 68 14.099 -1.980 3.754 1.00 0.27 C ATOM 1009 O PHE A 68 13.030 -2.407 3.317 1.00 0.31 O ATOM 1010 CB PHE A 68 15.847 -0.671 2.554 1.00 0.26 C ATOM 1011 CG PHE A 68 15.626 -1.281 1.193 1.00 0.27 C ATOM 1012 CD1 PHE A 68 14.347 -1.401 0.673 1.00 0.38 C ATOM 1013 CD2 PHE A 68 16.695 -1.749 0.438 1.00 0.35 C ATOM 1014 CE1 PHE A 68 14.142 -1.971 -0.569 1.00 0.44 C ATOM 1015 CE2 PHE A 68 16.493 -2.322 -0.800 1.00 0.37 C ATOM 1016 CZ PHE A 68 15.219 -2.380 -1.329 1.00 0.37 C ATOM 0 H PHE A 68 15.777 0.460 4.763 1.00 0.27 H new ATOM 0 HA PHE A 68 13.800 -0.077 2.822 1.00 0.26 H new ATOM 0 HB2 PHE A 68 16.263 0.329 2.431 1.00 0.26 H new ATOM 0 HB3 PHE A 68 16.589 -1.261 3.091 1.00 0.26 H new ATOM 0 HD1 PHE A 68 13.502 -1.045 1.244 1.00 0.38 H new ATOM 0 HD2 PHE A 68 17.699 -1.663 0.827 1.00 0.35 H new ATOM 0 HE1 PHE A 68 13.138 -2.097 -0.946 1.00 0.44 H new ATOM 0 HE2 PHE A 68 17.328 -2.724 -1.354 1.00 0.37 H new ATOM 0 HZ PHE A 68 15.066 -2.744 -2.334 1.00 0.37 H new ATOM 1026 N CYS A 69 14.888 -2.684 4.556 1.00 0.26 N ATOM 1027 CA CYS A 69 14.539 -4.037 4.963 1.00 0.28 C ATOM 1028 C CYS A 69 13.166 -4.045 5.613 1.00 0.29 C ATOM 1029 O CYS A 69 12.456 -5.049 5.583 1.00 0.34 O ATOM 1030 CB CYS A 69 15.575 -4.592 5.941 1.00 0.27 C ATOM 1031 SG CYS A 69 15.389 -6.354 6.294 1.00 0.49 S ATOM 0 H CYS A 69 15.770 -2.341 4.936 1.00 0.26 H new ATOM 0 HA CYS A 69 14.524 -4.669 4.075 1.00 0.28 H new ATOM 0 HB2 CYS A 69 16.572 -4.417 5.535 1.00 0.27 H new ATOM 0 HB3 CYS A 69 15.510 -4.036 6.876 1.00 0.27 H new ATOM 0 HG CYS A 69 16.191 -7.036 5.532 1.00 0.49 H new ATOM 1037 N GLY A 70 12.808 -2.913 6.209 1.00 0.31 N ATOM 1038 CA GLY A 70 11.519 -2.790 6.850 1.00 0.34 C ATOM 1039 C GLY A 70 10.399 -3.016 5.857 1.00 0.35 C ATOM 1040 O GLY A 70 9.540 -3.878 6.050 1.00 0.35 O ATOM 0 H GLY A 70 13.392 -2.078 6.258 1.00 0.31 H new ATOM 0 HA2 GLY A 70 11.442 -3.513 7.662 1.00 0.34 H new ATOM 0 HA3 GLY A 70 11.422 -1.799 7.294 1.00 0.34 H new ATOM 1044 N ILE A 71 10.429 -2.242 4.776 1.00 0.38 N ATOM 1045 CA ILE A 71 9.426 -2.353 3.729 1.00 0.41 C ATOM 1046 C ILE A 71 9.505 -3.703 3.036 1.00 0.41 C ATOM 1047 O ILE A 71 8.490 -4.260 2.622 1.00 0.45 O ATOM 1048 CB ILE A 71 9.595 -1.259 2.661 1.00 0.43 C ATOM 1049 CG1 ILE A 71 9.429 0.128 3.283 1.00 0.46 C ATOM 1050 CG2 ILE A 71 8.594 -1.474 1.533 1.00 0.47 C ATOM 1051 CD1 ILE A 71 9.873 1.252 2.372 1.00 0.49 C ATOM 0 H ILE A 71 11.140 -1.531 4.605 1.00 0.38 H new ATOM 0 HA ILE A 71 8.459 -2.238 4.218 1.00 0.41 H new ATOM 0 HB ILE A 71 10.601 -1.322 2.247 1.00 0.43 H new ATOM 0 HG12 ILE A 71 8.382 0.277 3.547 1.00 0.46 H new ATOM 0 HG13 ILE A 71 10.001 0.173 4.210 1.00 0.46 H new ATOM 0 HG21 ILE A 71 8.720 -0.695 0.781 1.00 0.47 H new ATOM 0 HG22 ILE A 71 8.764 -2.449 1.077 1.00 0.47 H new ATOM 0 HG23 ILE A 71 7.581 -1.431 1.933 1.00 0.47 H new ATOM 0 HD11 ILE A 71 9.728 2.208 2.876 1.00 0.49 H new ATOM 0 HD12 ILE A 71 10.928 1.127 2.128 1.00 0.49 H new ATOM 0 HD13 ILE A 71 9.283 1.232 1.455 1.00 0.49 H new ATOM 1063 N MET A 72 10.715 -4.228 2.919 1.00 0.39 N ATOM 1064 CA MET A 72 10.920 -5.504 2.256 1.00 0.41 C ATOM 1065 C MET A 72 10.322 -6.606 3.095 1.00 0.42 C ATOM 1066 O MET A 72 9.882 -7.634 2.585 1.00 0.50 O ATOM 1067 CB MET A 72 12.405 -5.763 2.023 1.00 0.41 C ATOM 1068 CG MET A 72 13.079 -4.686 1.193 1.00 0.45 C ATOM 1069 SD MET A 72 14.667 -5.208 0.528 1.00 0.78 S ATOM 1070 CE MET A 72 14.186 -6.658 -0.408 1.00 0.36 C ATOM 0 H MET A 72 11.566 -3.791 3.273 1.00 0.39 H new ATOM 0 HA MET A 72 10.427 -5.479 1.284 1.00 0.41 H new ATOM 0 HB2 MET A 72 12.909 -5.838 2.986 1.00 0.41 H new ATOM 0 HB3 MET A 72 12.525 -6.725 1.524 1.00 0.41 H new ATOM 0 HG2 MET A 72 12.422 -4.403 0.371 1.00 0.45 H new ATOM 0 HG3 MET A 72 13.222 -3.797 1.807 1.00 0.45 H new ATOM 0 HE1 MET A 72 14.788 -7.510 -0.093 1.00 0.36 H new ATOM 0 HE2 MET A 72 13.132 -6.873 -0.231 1.00 0.36 H new ATOM 0 HE3 MET A 72 14.345 -6.474 -1.471 1.00 0.36 H new ATOM 1080 N ALA A 73 10.314 -6.375 4.394 1.00 0.41 N ATOM 1081 CA ALA A 73 9.753 -7.318 5.332 1.00 0.44 C ATOM 1082 C ALA A 73 8.243 -7.366 5.156 1.00 0.45 C ATOM 1083 O ALA A 73 7.625 -8.419 5.279 1.00 0.51 O ATOM 1084 CB ALA A 73 10.127 -6.912 6.746 1.00 0.46 C ATOM 0 H ALA A 73 10.695 -5.532 4.823 1.00 0.41 H new ATOM 0 HA ALA A 73 10.154 -8.314 5.146 1.00 0.44 H new ATOM 0 HB1 ALA A 73 9.703 -7.625 7.453 1.00 0.46 H new ATOM 0 HB2 ALA A 73 11.212 -6.903 6.847 1.00 0.46 H new ATOM 0 HB3 ALA A 73 9.735 -5.917 6.955 1.00 0.46 H new ATOM 1090 N LYS A 74 7.659 -6.207 4.855 1.00 0.42 N ATOM 1091 CA LYS A 74 6.218 -6.104 4.640 1.00 0.46 C ATOM 1092 C LYS A 74 5.820 -6.770 3.329 1.00 0.47 C ATOM 1093 O LYS A 74 4.923 -7.612 3.289 1.00 0.57 O ATOM 1094 CB LYS A 74 5.782 -4.637 4.603 1.00 0.50 C ATOM 1095 CG LYS A 74 6.573 -3.738 5.529 1.00 1.17 C ATOM 1096 CD LYS A 74 5.925 -2.375 5.690 1.00 1.08 C ATOM 1097 CE LYS A 74 5.752 -1.663 4.353 1.00 1.83 C ATOM 1098 NZ LYS A 74 5.116 -0.327 4.512 1.00 2.52 N ATOM 0 H LYS A 74 8.163 -5.326 4.755 1.00 0.42 H new ATOM 0 HA LYS A 74 5.723 -6.610 5.469 1.00 0.46 H new ATOM 0 HB2 LYS A 74 5.878 -4.265 3.583 1.00 0.50 H new ATOM 0 HB3 LYS A 74 4.726 -4.575 4.867 1.00 0.50 H new ATOM 0 HG2 LYS A 74 6.664 -4.214 6.506 1.00 1.17 H new ATOM 0 HG3 LYS A 74 7.583 -3.615 5.139 1.00 1.17 H new ATOM 0 HD2 LYS A 74 4.952 -2.490 6.168 1.00 1.08 H new ATOM 0 HD3 LYS A 74 6.534 -1.760 6.352 1.00 1.08 H new ATOM 0 HE2 LYS A 74 6.725 -1.547 3.875 1.00 1.83 H new ATOM 0 HE3 LYS A 74 5.143 -2.278 3.691 1.00 1.83 H new ATOM 0 HZ1 LYS A 74 5.017 0.123 3.580 1.00 2.52 H new ATOM 0 HZ2 LYS A 74 4.177 -0.439 4.944 1.00 2.52 H new ATOM 0 HZ3 LYS A 74 5.710 0.270 5.123 1.00 2.52 H new ATOM 1112 N GLN A 75 6.496 -6.376 2.255 1.00 0.45 N ATOM 1113 CA GLN A 75 6.214 -6.910 0.927 1.00 0.50 C ATOM 1114 C GLN A 75 6.506 -8.408 0.821 1.00 0.52 C ATOM 1115 O GLN A 75 5.637 -9.191 0.440 1.00 0.67 O ATOM 1116 CB GLN A 75 7.040 -6.163 -0.118 1.00 0.50 C ATOM 1117 CG GLN A 75 6.596 -4.729 -0.335 1.00 0.76 C ATOM 1118 CD GLN A 75 7.738 -3.836 -0.770 1.00 0.66 C ATOM 1119 OE1 GLN A 75 8.877 -4.021 -0.347 1.00 1.60 O ATOM 1120 NE2 GLN A 75 7.442 -2.869 -1.627 1.00 0.86 N ATOM 0 H GLN A 75 7.246 -5.686 2.279 1.00 0.45 H new ATOM 0 HA GLN A 75 5.149 -6.767 0.746 1.00 0.50 H new ATOM 0 HB2 GLN A 75 8.086 -6.168 0.188 1.00 0.50 H new ATOM 0 HB3 GLN A 75 6.982 -6.699 -1.065 1.00 0.50 H new ATOM 0 HG2 GLN A 75 5.810 -4.704 -1.090 1.00 0.76 H new ATOM 0 HG3 GLN A 75 6.164 -4.341 0.588 1.00 0.76 H new ATOM 0 HE21 GLN A 75 6.482 -2.752 -1.952 1.00 0.86 H new ATOM 0 HE22 GLN A 75 8.174 -2.242 -1.961 1.00 0.86 H new ATOM 1129 N MET A 76 7.731 -8.796 1.159 1.00 0.55 N ATOM 1130 CA MET A 76 8.148 -10.193 1.062 1.00 0.66 C ATOM 1131 C MET A 76 7.315 -11.130 1.939 1.00 0.71 C ATOM 1132 O MET A 76 6.978 -12.236 1.516 1.00 0.83 O ATOM 1133 CB MET A 76 9.631 -10.332 1.398 1.00 0.87 C ATOM 1134 CG MET A 76 10.535 -9.764 0.317 1.00 1.02 C ATOM 1135 SD MET A 76 12.242 -10.313 0.472 1.00 1.03 S ATOM 1136 CE MET A 76 12.655 -9.627 2.068 1.00 0.64 C ATOM 0 H MET A 76 8.454 -8.164 1.503 1.00 0.55 H new ATOM 0 HA MET A 76 7.978 -10.497 0.029 1.00 0.66 H new ATOM 0 HB2 MET A 76 9.835 -9.823 2.340 1.00 0.87 H new ATOM 0 HB3 MET A 76 9.868 -11.385 1.547 1.00 0.87 H new ATOM 0 HG2 MET A 76 10.152 -10.056 -0.661 1.00 1.02 H new ATOM 0 HG3 MET A 76 10.504 -8.675 0.359 1.00 1.02 H new ATOM 0 HE1 MET A 76 13.373 -10.276 2.568 1.00 0.64 H new ATOM 0 HE2 MET A 76 13.091 -8.637 1.937 1.00 0.64 H new ATOM 0 HE3 MET A 76 11.753 -9.548 2.675 1.00 0.64 H new ATOM 1240 N GLU A 83 3.667 -14.392 -6.152 1.00 7.37 N ATOM 1241 CA GLU A 83 2.597 -15.299 -5.743 1.00 8.31 C ATOM 1242 C GLU A 83 2.025 -16.045 -6.944 1.00 8.90 C ATOM 1243 O GLU A 83 1.692 -17.227 -6.852 1.00 9.79 O ATOM 1244 CB GLU A 83 1.486 -14.529 -5.024 1.00 8.42 C ATOM 1245 CG GLU A 83 0.875 -13.413 -5.857 1.00 8.14 C ATOM 1246 CD GLU A 83 -0.320 -12.768 -5.182 1.00 8.51 C ATOM 1247 OE1 GLU A 83 -1.419 -13.360 -5.226 1.00 9.06 O ATOM 1248 OE2 GLU A 83 -0.158 -11.670 -4.608 1.00 8.45 O ATOM 0 HA GLU A 83 3.021 -16.030 -5.055 1.00 8.31 H new ATOM 0 HB2 GLU A 83 0.700 -15.227 -4.737 1.00 8.42 H new ATOM 0 HB3 GLU A 83 1.888 -14.105 -4.104 1.00 8.42 H new ATOM 0 HG2 GLU A 83 1.632 -12.653 -6.051 1.00 8.14 H new ATOM 0 HG3 GLU A 83 0.569 -13.812 -6.824 1.00 8.14 H new ATOM 1255 N GLU A 84 1.914 -15.348 -8.071 1.00 8.58 N ATOM 1256 CA GLU A 84 1.383 -15.946 -9.291 1.00 9.37 C ATOM 1257 C GLU A 84 2.401 -16.890 -9.919 1.00 9.77 C ATOM 1258 O GLU A 84 2.037 -17.880 -10.556 1.00 10.65 O ATOM 1259 CB GLU A 84 0.996 -14.855 -10.292 1.00 9.24 C ATOM 1260 CG GLU A 84 -0.115 -13.941 -9.801 1.00 9.88 C ATOM 1261 CD GLU A 84 -0.411 -12.812 -10.768 1.00 10.30 C ATOM 1262 OE1 GLU A 84 -1.089 -13.065 -11.786 1.00 10.72 O ATOM 1263 OE2 GLU A 84 0.032 -11.674 -10.506 1.00 10.41 O ATOM 0 H GLU A 84 2.185 -14.369 -8.164 1.00 8.58 H new ATOM 0 HA GLU A 84 0.494 -16.520 -9.029 1.00 9.37 H new ATOM 0 HB2 GLU A 84 1.876 -14.253 -10.518 1.00 9.24 H new ATOM 0 HB3 GLU A 84 0.683 -15.324 -11.224 1.00 9.24 H new ATOM 0 HG2 GLU A 84 -1.020 -14.527 -9.645 1.00 9.88 H new ATOM 0 HG3 GLU A 84 0.165 -13.522 -8.834 1.00 9.88 H new ATOM 1270 N MET A 85 3.680 -16.579 -9.733 1.00 9.28 N ATOM 1271 CA MET A 85 4.754 -17.397 -10.280 1.00 9.90 C ATOM 1272 C MET A 85 4.870 -18.706 -9.511 1.00 10.59 C ATOM 1273 O MET A 85 5.121 -19.760 -10.094 1.00 11.45 O ATOM 1274 CB MET A 85 6.078 -16.634 -10.230 1.00 9.48 C ATOM 1275 CG MET A 85 6.038 -15.301 -10.958 1.00 8.93 C ATOM 1276 SD MET A 85 7.482 -14.276 -10.618 1.00 8.96 S ATOM 1277 CE MET A 85 8.805 -15.360 -11.148 1.00 9.60 C ATOM 0 H MET A 85 3.997 -15.765 -9.207 1.00 9.28 H new ATOM 0 HA MET A 85 4.521 -17.626 -11.320 1.00 9.90 H new ATOM 0 HB2 MET A 85 6.350 -16.462 -9.189 1.00 9.48 H new ATOM 0 HB3 MET A 85 6.862 -17.254 -10.666 1.00 9.48 H new ATOM 0 HG2 MET A 85 5.970 -15.480 -12.031 1.00 8.93 H new ATOM 0 HG3 MET A 85 5.137 -14.760 -10.667 1.00 8.93 H new ATOM 0 HE1 MET A 85 9.566 -14.778 -11.668 1.00 9.60 H new ATOM 0 HE2 MET A 85 9.249 -15.844 -10.278 1.00 9.60 H new ATOM 0 HE3 MET A 85 8.406 -16.119 -11.821 1.00 9.60 H new ATOM 1287 N ARG A 86 4.685 -18.631 -8.196 1.00 10.35 N ATOM 1288 CA ARG A 86 4.756 -19.813 -7.349 1.00 11.19 C ATOM 1289 C ARG A 86 3.615 -20.764 -7.675 1.00 11.96 C ATOM 1290 O ARG A 86 3.807 -21.977 -7.754 1.00 12.88 O ATOM 1291 CB ARG A 86 4.701 -19.425 -5.877 1.00 10.99 C ATOM 1292 CG ARG A 86 5.327 -20.469 -4.979 1.00 11.99 C ATOM 1293 CD ARG A 86 4.973 -20.239 -3.527 1.00 12.13 C ATOM 1294 NE ARG A 86 3.530 -20.266 -3.303 1.00 12.84 N ATOM 1295 CZ ARG A 86 2.966 -20.165 -2.102 1.00 13.32 C ATOM 1296 NH1 ARG A 86 3.720 -20.031 -1.019 1.00 13.18 N ATOM 1297 NH2 ARG A 86 1.646 -20.198 -1.986 1.00 14.09 N ATOM 0 H ARG A 86 4.485 -17.764 -7.696 1.00 10.35 H new ATOM 0 HA ARG A 86 5.704 -20.314 -7.542 1.00 11.19 H new ATOM 0 HB2 ARG A 86 5.214 -18.474 -5.736 1.00 10.99 H new ATOM 0 HB3 ARG A 86 3.662 -19.273 -5.583 1.00 10.99 H new ATOM 0 HG2 ARG A 86 4.991 -21.460 -5.283 1.00 11.99 H new ATOM 0 HG3 ARG A 86 6.410 -20.449 -5.097 1.00 11.99 H new ATOM 0 HD2 ARG A 86 5.449 -21.003 -2.913 1.00 12.13 H new ATOM 0 HD3 ARG A 86 5.372 -19.277 -3.205 1.00 12.13 H new ATOM 0 HE ARG A 86 2.920 -20.368 -4.114 1.00 12.84 H new ATOM 0 HH11 ARG A 86 4.736 -20.005 -1.105 1.00 13.18 H new ATOM 0 HH12 ARG A 86 3.284 -19.954 -0.100 1.00 13.18 H new ATOM 0 HH21 ARG A 86 1.063 -20.301 -2.817 1.00 14.09 H new ATOM 0 HH22 ARG A 86 1.213 -20.121 -1.066 1.00 14.09 H new ATOM 1311 N GLU A 87 2.424 -20.202 -7.862 1.00 11.71 N ATOM 1312 CA GLU A 87 1.248 -20.994 -8.195 1.00 12.58 C ATOM 1313 C GLU A 87 1.501 -21.796 -9.464 1.00 13.20 C ATOM 1314 O GLU A 87 1.189 -22.985 -9.533 1.00 14.14 O ATOM 1315 CB GLU A 87 0.028 -20.090 -8.380 1.00 12.36 C ATOM 1316 CG GLU A 87 -1.256 -20.851 -8.667 1.00 12.89 C ATOM 1317 CD GLU A 87 -2.454 -19.935 -8.821 1.00 13.23 C ATOM 1318 OE1 GLU A 87 -3.114 -19.644 -7.801 1.00 13.47 O ATOM 1319 OE2 GLU A 87 -2.734 -19.510 -9.962 1.00 13.40 O ATOM 0 H GLU A 87 2.250 -19.200 -7.788 1.00 11.71 H new ATOM 0 HA GLU A 87 1.049 -21.682 -7.373 1.00 12.58 H new ATOM 0 HB2 GLU A 87 -0.109 -19.490 -7.480 1.00 12.36 H new ATOM 0 HB3 GLU A 87 0.221 -19.397 -9.199 1.00 12.36 H new ATOM 0 HG2 GLU A 87 -1.131 -21.436 -9.578 1.00 12.89 H new ATOM 0 HG3 GLU A 87 -1.444 -21.557 -7.858 1.00 12.89 H new ATOM 1326 N ALA A 88 2.072 -21.133 -10.468 1.00 12.78 N ATOM 1327 CA ALA A 88 2.381 -21.781 -11.736 1.00 13.49 C ATOM 1328 C ALA A 88 3.298 -22.979 -11.513 1.00 14.13 C ATOM 1329 O ALA A 88 3.105 -24.040 -12.109 1.00 15.06 O ATOM 1330 CB ALA A 88 3.025 -20.790 -12.693 1.00 13.06 C ATOM 0 H ALA A 88 2.329 -20.147 -10.425 1.00 12.78 H new ATOM 0 HA ALA A 88 1.451 -22.137 -12.179 1.00 13.49 H new ATOM 0 HB1 ALA A 88 3.250 -21.288 -13.636 1.00 13.06 H new ATOM 0 HB2 ALA A 88 2.340 -19.962 -12.875 1.00 13.06 H new ATOM 0 HB3 ALA A 88 3.947 -20.408 -12.255 1.00 13.06 H new ATOM 1336 N PHE A 89 4.293 -22.799 -10.648 1.00 13.73 N ATOM 1337 CA PHE A 89 5.238 -23.863 -10.331 1.00 14.46 C ATOM 1338 C PHE A 89 4.506 -25.079 -9.770 1.00 15.32 C ATOM 1339 O PHE A 89 4.862 -26.222 -10.059 1.00 16.24 O ATOM 1340 CB PHE A 89 6.278 -23.357 -9.326 1.00 14.00 C ATOM 1341 CG PHE A 89 7.064 -24.451 -8.660 1.00 14.89 C ATOM 1342 CD1 PHE A 89 8.132 -25.050 -9.307 1.00 15.46 C ATOM 1343 CD2 PHE A 89 6.730 -24.881 -7.386 1.00 15.30 C ATOM 1344 CE1 PHE A 89 8.853 -26.057 -8.694 1.00 16.38 C ATOM 1345 CE2 PHE A 89 7.446 -25.887 -6.769 1.00 16.22 C ATOM 1346 CZ PHE A 89 8.509 -26.475 -7.424 1.00 16.75 C ATOM 0 H PHE A 89 4.465 -21.923 -10.154 1.00 13.73 H new ATOM 0 HA PHE A 89 5.748 -24.162 -11.247 1.00 14.46 H new ATOM 0 HB2 PHE A 89 6.969 -22.687 -9.839 1.00 14.00 H new ATOM 0 HB3 PHE A 89 5.773 -22.768 -8.560 1.00 14.00 H new ATOM 0 HD1 PHE A 89 8.404 -24.727 -10.301 1.00 15.46 H new ATOM 0 HD2 PHE A 89 5.899 -24.423 -6.869 1.00 15.30 H new ATOM 0 HE1 PHE A 89 9.685 -26.516 -9.208 1.00 16.38 H new ATOM 0 HE2 PHE A 89 7.175 -26.213 -5.776 1.00 16.22 H new ATOM 0 HZ PHE A 89 9.071 -27.262 -6.943 1.00 16.75 H new ATOM 1356 N LYS A 90 3.483 -24.818 -8.964 1.00 15.11 N ATOM 1357 CA LYS A 90 2.690 -25.881 -8.357 1.00 16.01 C ATOM 1358 C LYS A 90 1.853 -26.607 -9.405 1.00 16.75 C ATOM 1359 O LYS A 90 1.704 -27.828 -9.357 1.00 17.70 O ATOM 1360 CB LYS A 90 1.775 -25.307 -7.274 1.00 15.74 C ATOM 1361 CG LYS A 90 2.526 -24.689 -6.105 1.00 15.19 C ATOM 1362 CD LYS A 90 1.577 -24.071 -5.098 1.00 15.14 C ATOM 1363 CE LYS A 90 2.328 -23.321 -4.010 1.00 14.45 C ATOM 1364 NZ LYS A 90 3.168 -24.232 -3.185 1.00 14.90 N ATOM 0 H LYS A 90 3.182 -23.876 -8.715 1.00 15.11 H new ATOM 0 HA LYS A 90 3.378 -26.597 -7.906 1.00 16.01 H new ATOM 0 HB2 LYS A 90 1.129 -24.551 -7.720 1.00 15.74 H new ATOM 0 HB3 LYS A 90 1.127 -26.100 -6.900 1.00 15.74 H new ATOM 0 HG2 LYS A 90 3.131 -25.452 -5.615 1.00 15.19 H new ATOM 0 HG3 LYS A 90 3.212 -23.927 -6.474 1.00 15.19 H new ATOM 0 HD2 LYS A 90 0.897 -23.389 -5.609 1.00 15.14 H new ATOM 0 HD3 LYS A 90 0.965 -24.852 -4.647 1.00 15.14 H new ATOM 0 HE2 LYS A 90 2.959 -22.558 -4.465 1.00 14.45 H new ATOM 0 HE3 LYS A 90 1.615 -22.804 -3.368 1.00 14.45 H new ATOM 0 HZ1 LYS A 90 3.597 -23.696 -2.403 1.00 14.90 H new ATOM 0 HZ2 LYS A 90 2.576 -24.995 -2.798 1.00 14.90 H new ATOM 0 HZ3 LYS A 90 3.919 -24.642 -3.776 1.00 14.90 H new ATOM 1378 N ILE A 91 1.305 -25.847 -10.349 1.00 16.40 N ATOM 1379 CA ILE A 91 0.482 -26.417 -11.411 1.00 17.17 C ATOM 1380 C ILE A 91 1.239 -27.497 -12.178 1.00 17.84 C ATOM 1381 O ILE A 91 0.706 -28.578 -12.432 1.00 18.78 O ATOM 1382 CB ILE A 91 0.005 -25.331 -12.399 1.00 16.77 C ATOM 1383 CG1 ILE A 91 -0.832 -24.278 -11.666 1.00 16.16 C ATOM 1384 CG2 ILE A 91 -0.797 -25.958 -13.532 1.00 17.75 C ATOM 1385 CD1 ILE A 91 -1.178 -23.075 -12.516 1.00 16.20 C ATOM 0 H ILE A 91 1.416 -24.834 -10.400 1.00 16.40 H new ATOM 0 HA ILE A 91 -0.388 -26.864 -10.930 1.00 17.17 H new ATOM 0 HB ILE A 91 0.879 -24.841 -12.828 1.00 16.77 H new ATOM 0 HG12 ILE A 91 -1.754 -24.740 -11.314 1.00 16.16 H new ATOM 0 HG13 ILE A 91 -0.287 -23.943 -10.784 1.00 16.16 H new ATOM 0 HG21 ILE A 91 -1.126 -25.179 -14.220 1.00 17.75 H new ATOM 0 HG22 ILE A 91 -0.173 -26.674 -14.067 1.00 17.75 H new ATOM 0 HG23 ILE A 91 -1.667 -26.471 -13.122 1.00 17.75 H new ATOM 0 HD11 ILE A 91 -1.771 -22.373 -11.929 1.00 16.20 H new ATOM 0 HD12 ILE A 91 -0.261 -22.587 -12.846 1.00 16.20 H new ATOM 0 HD13 ILE A 91 -1.751 -23.397 -13.385 1.00 16.20 H new ATOM 1397 N PHE A 92 2.482 -27.202 -12.545 1.00 17.43 N ATOM 1398 CA PHE A 92 3.306 -28.155 -13.281 1.00 18.14 C ATOM 1399 C PHE A 92 3.846 -29.239 -12.351 1.00 18.80 C ATOM 1400 O PHE A 92 4.338 -30.272 -12.806 1.00 19.63 O ATOM 1401 CB PHE A 92 4.454 -27.434 -13.995 1.00 17.63 C ATOM 1402 CG PHE A 92 3.981 -26.451 -15.031 1.00 17.41 C ATOM 1403 CD1 PHE A 92 3.378 -26.891 -16.201 1.00 17.12 C ATOM 1404 CD2 PHE A 92 4.130 -25.088 -14.831 1.00 17.64 C ATOM 1405 CE1 PHE A 92 2.933 -25.991 -17.149 1.00 17.07 C ATOM 1406 CE2 PHE A 92 3.684 -24.183 -15.777 1.00 17.60 C ATOM 1407 CZ PHE A 92 3.085 -24.634 -16.935 1.00 17.34 C ATOM 0 H PHE A 92 2.940 -26.313 -12.345 1.00 17.43 H new ATOM 0 HA PHE A 92 2.681 -28.636 -14.033 1.00 18.14 H new ATOM 0 HB2 PHE A 92 5.061 -26.910 -13.257 1.00 17.63 H new ATOM 0 HB3 PHE A 92 5.098 -28.173 -14.471 1.00 17.63 H new ATOM 0 HD1 PHE A 92 3.255 -27.950 -16.372 1.00 17.12 H new ATOM 0 HD2 PHE A 92 4.599 -24.729 -13.927 1.00 17.64 H new ATOM 0 HE1 PHE A 92 2.467 -26.347 -18.056 1.00 17.07 H new ATOM 0 HE2 PHE A 92 3.805 -23.123 -15.609 1.00 17.60 H new ATOM 0 HZ PHE A 92 2.735 -23.928 -17.673 1.00 17.34 H new ATOM 1417 N ASP A 93 3.749 -28.994 -11.046 1.00 18.51 N ATOM 1418 CA ASP A 93 4.214 -29.954 -10.047 1.00 19.23 C ATOM 1419 C ASP A 93 3.032 -30.607 -9.337 1.00 19.92 C ATOM 1420 O ASP A 93 2.549 -30.105 -8.323 1.00 19.65 O ATOM 1421 CB ASP A 93 5.118 -29.266 -9.021 1.00 18.69 C ATOM 1422 CG ASP A 93 5.729 -30.247 -8.040 1.00 19.57 C ATOM 1423 OD1 ASP A 93 6.067 -31.374 -8.459 1.00 19.89 O ATOM 1424 OD2 ASP A 93 5.868 -29.891 -6.848 1.00 20.02 O ATOM 0 H ASP A 93 3.353 -28.139 -10.656 1.00 18.51 H new ATOM 0 HA ASP A 93 4.786 -30.726 -10.562 1.00 19.23 H new ATOM 0 HB2 ASP A 93 5.914 -28.733 -9.541 1.00 18.69 H new ATOM 0 HB3 ASP A 93 4.541 -28.521 -8.474 1.00 18.69 H new ATOM 1429 N ARG A 94 2.573 -31.733 -9.874 1.00 20.90 N ATOM 1430 CA ARG A 94 1.439 -32.448 -9.298 1.00 21.70 C ATOM 1431 C ARG A 94 1.800 -33.086 -7.959 1.00 22.13 C ATOM 1432 O ARG A 94 0.920 -33.485 -7.197 1.00 22.63 O ATOM 1433 CB ARG A 94 0.937 -33.515 -10.268 1.00 22.67 C ATOM 1434 CG ARG A 94 0.362 -32.937 -11.549 1.00 22.53 C ATOM 1435 CD ARG A 94 1.002 -33.564 -12.769 1.00 22.13 C ATOM 1436 NE ARG A 94 0.756 -35.004 -12.835 1.00 22.41 N ATOM 1437 CZ ARG A 94 1.467 -35.842 -13.582 1.00 22.68 C ATOM 1438 NH1 ARG A 94 2.465 -35.387 -14.329 1.00 22.72 N ATOM 1439 NH2 ARG A 94 1.182 -37.138 -13.584 1.00 23.01 N ATOM 0 H ARG A 94 2.968 -32.170 -10.707 1.00 20.90 H new ATOM 0 HA ARG A 94 0.646 -31.722 -9.121 1.00 21.70 H new ATOM 0 HB2 ARG A 94 1.759 -34.186 -10.517 1.00 22.67 H new ATOM 0 HB3 ARG A 94 0.174 -34.116 -9.774 1.00 22.67 H new ATOM 0 HG2 ARG A 94 -0.715 -33.103 -11.574 1.00 22.53 H new ATOM 0 HG3 ARG A 94 0.519 -31.858 -11.567 1.00 22.53 H new ATOM 0 HD2 ARG A 94 0.612 -33.088 -13.669 1.00 22.13 H new ATOM 0 HD3 ARG A 94 2.076 -33.380 -12.751 1.00 22.13 H new ATOM 0 HE ARG A 94 -0.006 -35.387 -12.275 1.00 22.41 H new ATOM 0 HH11 ARG A 94 2.688 -34.392 -14.331 1.00 22.72 H new ATOM 0 HH12 ARG A 94 3.009 -36.033 -14.901 1.00 22.72 H new ATOM 0 HH21 ARG A 94 0.416 -37.493 -13.011 1.00 23.01 H new ATOM 0 HH22 ARG A 94 1.729 -37.780 -14.158 1.00 23.01 H new ATOM 1453 N ASP A 95 3.096 -33.180 -7.677 1.00 22.06 N ATOM 1454 CA ASP A 95 3.562 -33.774 -6.427 1.00 22.57 C ATOM 1455 C ASP A 95 3.873 -32.702 -5.391 1.00 21.80 C ATOM 1456 O ASP A 95 4.049 -31.530 -5.724 1.00 20.81 O ATOM 1457 CB ASP A 95 4.817 -34.615 -6.665 1.00 23.28 C ATOM 1458 CG ASP A 95 4.712 -35.500 -7.889 1.00 23.89 C ATOM 1459 OD1 ASP A 95 3.665 -36.160 -8.061 1.00 24.00 O ATOM 1460 OD2 ASP A 95 5.681 -35.532 -8.676 1.00 24.34 O ATOM 0 H ASP A 95 3.840 -32.854 -8.294 1.00 22.06 H new ATOM 0 HA ASP A 95 2.761 -34.410 -6.051 1.00 22.57 H new ATOM 0 HB2 ASP A 95 5.676 -33.953 -6.775 1.00 23.28 H new ATOM 0 HB3 ASP A 95 5.003 -35.236 -5.789 1.00 23.28 H new ATOM 1465 N GLY A 96 3.938 -33.117 -4.131 1.00 22.31 N ATOM 1466 CA GLY A 96 4.249 -32.195 -3.056 1.00 21.77 C ATOM 1467 C GLY A 96 5.724 -32.222 -2.712 1.00 21.93 C ATOM 1468 O GLY A 96 6.162 -31.582 -1.755 1.00 21.68 O ATOM 0 H GLY A 96 3.780 -34.080 -3.834 1.00 22.31 H new ATOM 0 HA2 GLY A 96 3.960 -31.185 -3.346 1.00 21.77 H new ATOM 0 HA3 GLY A 96 3.664 -32.452 -2.173 1.00 21.77 H new ATOM 1472 N ASP A 97 6.485 -32.975 -3.500 1.00 22.44 N ATOM 1473 CA ASP A 97 7.923 -33.109 -3.298 1.00 22.79 C ATOM 1474 C ASP A 97 8.617 -31.749 -3.292 1.00 21.82 C ATOM 1475 O ASP A 97 9.572 -31.534 -2.545 1.00 22.02 O ATOM 1476 CB ASP A 97 8.527 -34.003 -4.386 1.00 23.40 C ATOM 1477 CG ASP A 97 8.055 -33.636 -5.784 1.00 22.73 C ATOM 1478 OD1 ASP A 97 7.420 -32.572 -5.941 1.00 22.35 O ATOM 1479 OD2 ASP A 97 8.317 -34.415 -6.725 1.00 22.66 O ATOM 0 H ASP A 97 6.125 -33.507 -4.292 1.00 22.44 H new ATOM 0 HA ASP A 97 8.082 -33.570 -2.323 1.00 22.79 H new ATOM 0 HB2 ASP A 97 9.614 -33.932 -4.345 1.00 23.40 H new ATOM 0 HB3 ASP A 97 8.267 -35.042 -4.181 1.00 23.40 H new ATOM 1484 N GLY A 98 8.134 -30.835 -4.129 1.00 20.85 N ATOM 1485 CA GLY A 98 8.721 -29.512 -4.201 1.00 19.90 C ATOM 1486 C GLY A 98 9.595 -29.343 -5.424 1.00 19.67 C ATOM 1487 O GLY A 98 10.299 -28.341 -5.560 1.00 18.98 O ATOM 0 H GLY A 98 7.346 -30.989 -4.758 1.00 20.85 H new ATOM 0 HA2 GLY A 98 7.928 -28.764 -4.217 1.00 19.90 H new ATOM 0 HA3 GLY A 98 9.314 -29.329 -3.304 1.00 19.90 H new ATOM 1491 N PHE A 99 9.558 -30.331 -6.315 1.00 20.36 N ATOM 1492 CA PHE A 99 10.349 -30.284 -7.539 1.00 20.37 C ATOM 1493 C PHE A 99 9.566 -30.867 -8.716 1.00 20.60 C ATOM 1494 O PHE A 99 8.665 -31.688 -8.532 1.00 21.08 O ATOM 1495 CB PHE A 99 11.668 -31.042 -7.367 1.00 21.34 C ATOM 1496 CG PHE A 99 12.332 -30.825 -6.036 1.00 21.51 C ATOM 1497 CD1 PHE A 99 13.222 -29.779 -5.852 1.00 21.38 C ATOM 1498 CD2 PHE A 99 12.072 -31.673 -4.971 1.00 21.92 C ATOM 1499 CE1 PHE A 99 13.839 -29.582 -4.631 1.00 21.65 C ATOM 1500 CE2 PHE A 99 12.684 -31.481 -3.748 1.00 22.21 C ATOM 1501 CZ PHE A 99 13.569 -30.434 -3.578 1.00 22.08 C ATOM 0 H PHE A 99 8.990 -31.172 -6.211 1.00 20.36 H new ATOM 0 HA PHE A 99 10.571 -29.238 -7.749 1.00 20.37 H new ATOM 0 HB2 PHE A 99 11.482 -32.108 -7.498 1.00 21.34 H new ATOM 0 HB3 PHE A 99 12.355 -30.739 -8.157 1.00 21.34 H new ATOM 0 HD1 PHE A 99 13.436 -29.110 -6.672 1.00 21.38 H new ATOM 0 HD2 PHE A 99 11.382 -32.494 -5.099 1.00 21.92 H new ATOM 0 HE1 PHE A 99 14.531 -28.763 -4.501 1.00 21.65 H new ATOM 0 HE2 PHE A 99 12.471 -32.148 -2.926 1.00 22.21 H new ATOM 0 HZ PHE A 99 14.049 -30.282 -2.623 1.00 22.08 H new ATOM 1511 N ILE A 100 9.924 -30.443 -9.929 1.00 20.36 N ATOM 1512 CA ILE A 100 9.248 -30.910 -11.136 1.00 20.66 C ATOM 1513 C ILE A 100 10.182 -31.735 -12.016 1.00 21.62 C ATOM 1514 O ILE A 100 11.390 -31.501 -12.052 1.00 21.77 O ATOM 1515 CB ILE A 100 8.710 -29.730 -11.971 1.00 19.72 C ATOM 1516 CG1 ILE A 100 7.976 -28.731 -11.075 1.00 18.71 C ATOM 1517 CG2 ILE A 100 7.789 -30.238 -13.072 1.00 20.15 C ATOM 1518 CD1 ILE A 100 7.602 -27.446 -11.782 1.00 17.74 C ATOM 0 H ILE A 100 10.678 -29.777 -10.100 1.00 20.36 H new ATOM 0 HA ILE A 100 8.417 -31.532 -10.803 1.00 20.66 H new ATOM 0 HB ILE A 100 9.554 -29.219 -12.434 1.00 19.72 H new ATOM 0 HG12 ILE A 100 7.071 -29.199 -10.687 1.00 18.71 H new ATOM 0 HG13 ILE A 100 8.605 -28.494 -10.217 1.00 18.71 H new ATOM 0 HG21 ILE A 100 7.417 -29.394 -13.653 1.00 20.15 H new ATOM 0 HG22 ILE A 100 8.341 -30.913 -13.726 1.00 20.15 H new ATOM 0 HG23 ILE A 100 6.949 -30.771 -12.627 1.00 20.15 H new ATOM 0 HD11 ILE A 100 7.085 -26.785 -11.086 1.00 17.74 H new ATOM 0 HD12 ILE A 100 8.505 -26.955 -12.146 1.00 17.74 H new ATOM 0 HD13 ILE A 100 6.947 -27.671 -12.624 1.00 17.74 H new ATOM 1530 N SER A 101 9.608 -32.700 -12.727 1.00 22.35 N ATOM 1531 CA SER A 101 10.372 -33.560 -13.624 1.00 23.35 C ATOM 1532 C SER A 101 9.852 -33.420 -15.053 1.00 23.43 C ATOM 1533 O SER A 101 8.698 -33.047 -15.253 1.00 22.96 O ATOM 1534 CB SER A 101 10.280 -35.019 -13.175 1.00 24.38 C ATOM 1535 OG SER A 101 10.887 -35.204 -11.909 1.00 24.61 O ATOM 0 H SER A 101 8.610 -32.907 -12.699 1.00 22.35 H new ATOM 0 HA SER A 101 11.417 -33.252 -13.593 1.00 23.35 H new ATOM 0 HB2 SER A 101 9.234 -35.323 -13.128 1.00 24.38 H new ATOM 0 HB3 SER A 101 10.765 -35.660 -13.911 1.00 24.38 H new ATOM 0 HG SER A 101 10.813 -36.145 -11.645 1.00 24.61 H new ATOM 1541 N PRO A 102 10.690 -33.708 -16.067 1.00 24.11 N ATOM 1542 CA PRO A 102 10.282 -33.601 -17.472 1.00 24.36 C ATOM 1543 C PRO A 102 8.920 -34.238 -17.730 1.00 24.64 C ATOM 1544 O PRO A 102 8.129 -33.737 -18.531 1.00 24.44 O ATOM 1545 CB PRO A 102 11.382 -34.360 -18.211 1.00 25.42 C ATOM 1546 CG PRO A 102 12.588 -34.201 -17.352 1.00 25.38 C ATOM 1547 CD PRO A 102 12.088 -34.163 -15.932 1.00 24.81 C ATOM 0 HA PRO A 102 10.171 -32.565 -17.792 1.00 24.36 H new ATOM 0 HB2 PRO A 102 11.122 -35.411 -18.339 1.00 25.42 H new ATOM 0 HB3 PRO A 102 11.547 -33.949 -19.207 1.00 25.42 H new ATOM 0 HG2 PRO A 102 13.282 -35.028 -17.498 1.00 25.38 H new ATOM 0 HG3 PRO A 102 13.125 -33.286 -17.600 1.00 25.38 H new ATOM 0 HD2 PRO A 102 12.146 -35.144 -15.460 1.00 24.81 H new ATOM 0 HD3 PRO A 102 12.675 -33.479 -15.319 1.00 24.81 H new ATOM 1555 N ALA A 103 8.650 -35.340 -17.036 1.00 25.18 N ATOM 1556 CA ALA A 103 7.383 -36.047 -17.187 1.00 25.58 C ATOM 1557 C ALA A 103 6.218 -35.197 -16.696 1.00 24.70 C ATOM 1558 O ALA A 103 5.201 -35.064 -17.377 1.00 24.78 O ATOM 1559 CB ALA A 103 7.424 -37.365 -16.431 1.00 26.36 C ATOM 0 H ALA A 103 9.291 -35.762 -16.364 1.00 25.18 H new ATOM 0 HA ALA A 103 7.233 -36.249 -18.248 1.00 25.58 H new ATOM 0 HB1 ALA A 103 6.473 -37.883 -16.551 1.00 26.36 H new ATOM 0 HB2 ALA A 103 8.228 -37.986 -16.826 1.00 26.36 H new ATOM 0 HB3 ALA A 103 7.601 -37.172 -15.373 1.00 26.36 H new ATOM 1565 N GLU A 104 6.374 -34.626 -15.506 1.00 23.94 N ATOM 1566 CA GLU A 104 5.340 -33.789 -14.911 1.00 23.10 C ATOM 1567 C GLU A 104 5.150 -32.499 -15.700 1.00 22.34 C ATOM 1568 O GLU A 104 4.035 -31.991 -15.823 1.00 22.06 O ATOM 1569 CB GLU A 104 5.710 -33.446 -13.468 1.00 22.54 C ATOM 1570 CG GLU A 104 5.636 -34.626 -12.515 1.00 23.20 C ATOM 1571 CD GLU A 104 6.145 -34.278 -11.130 1.00 22.77 C ATOM 1572 OE1 GLU A 104 5.421 -33.579 -10.390 1.00 22.57 O ATOM 1573 OE2 GLU A 104 7.267 -34.703 -10.784 1.00 22.70 O ATOM 0 H GLU A 104 7.211 -34.729 -14.933 1.00 23.94 H new ATOM 0 HA GLU A 104 4.406 -34.350 -14.931 1.00 23.10 H new ATOM 0 HB2 GLU A 104 6.721 -33.040 -13.450 1.00 22.54 H new ATOM 0 HB3 GLU A 104 5.045 -32.660 -13.110 1.00 22.54 H new ATOM 0 HG2 GLU A 104 4.604 -34.970 -12.445 1.00 23.20 H new ATOM 0 HG3 GLU A 104 6.221 -35.453 -12.918 1.00 23.20 H new ATOM 1580 N LEU A 105 6.246 -31.979 -16.234 1.00 22.13 N ATOM 1581 CA LEU A 105 6.215 -30.738 -16.996 1.00 21.50 C ATOM 1582 C LEU A 105 5.367 -30.882 -18.257 1.00 22.09 C ATOM 1583 O LEU A 105 4.451 -30.093 -18.487 1.00 21.66 O ATOM 1584 CB LEU A 105 7.638 -30.307 -17.353 1.00 21.47 C ATOM 1585 CG LEU A 105 7.795 -28.837 -17.749 1.00 20.64 C ATOM 1586 CD1 LEU A 105 9.217 -28.364 -17.489 1.00 20.35 C ATOM 1587 CD2 LEU A 105 7.431 -28.637 -19.208 1.00 20.76 C ATOM 0 H LEU A 105 7.172 -32.399 -16.153 1.00 22.13 H new ATOM 0 HA LEU A 105 5.756 -29.969 -16.375 1.00 21.50 H new ATOM 0 HB2 LEU A 105 8.286 -30.508 -16.500 1.00 21.47 H new ATOM 0 HB3 LEU A 105 7.993 -30.928 -18.176 1.00 21.47 H new ATOM 0 HG LEU A 105 7.115 -28.243 -17.138 1.00 20.64 H new ATOM 0 HD11 LEU A 105 9.310 -27.317 -17.776 1.00 20.35 H new ATOM 0 HD12 LEU A 105 9.448 -28.471 -16.429 1.00 20.35 H new ATOM 0 HD13 LEU A 105 9.913 -28.964 -18.075 1.00 20.35 H new ATOM 0 HD21 LEU A 105 7.549 -27.586 -19.472 1.00 20.76 H new ATOM 0 HD22 LEU A 105 8.087 -29.243 -19.833 1.00 20.76 H new ATOM 0 HD23 LEU A 105 6.396 -28.938 -19.369 1.00 20.76 H new ATOM 1599 N ARG A 106 5.671 -31.890 -19.072 1.00 23.15 N ATOM 1600 CA ARG A 106 4.928 -32.112 -20.310 1.00 23.87 C ATOM 1601 C ARG A 106 3.484 -32.515 -20.027 1.00 23.93 C ATOM 1602 O ARG A 106 2.558 -32.008 -20.658 1.00 24.00 O ATOM 1603 CB ARG A 106 5.602 -33.188 -21.166 1.00 25.01 C ATOM 1604 CG ARG A 106 5.764 -34.524 -20.461 1.00 25.84 C ATOM 1605 CD ARG A 106 5.379 -35.677 -21.373 1.00 26.70 C ATOM 1606 NE ARG A 106 5.468 -36.967 -20.695 1.00 27.44 N ATOM 1607 CZ ARG A 106 5.092 -38.117 -21.246 1.00 28.28 C ATOM 1608 NH1 ARG A 106 4.620 -38.141 -22.486 1.00 28.51 N ATOM 1609 NH2 ARG A 106 5.187 -39.247 -20.557 1.00 28.96 N ATOM 0 H ARG A 106 6.420 -32.561 -18.900 1.00 23.15 H new ATOM 0 HA ARG A 106 4.925 -31.170 -20.858 1.00 23.87 H new ATOM 0 HB2 ARG A 106 5.017 -33.336 -22.073 1.00 25.01 H new ATOM 0 HB3 ARG A 106 6.584 -32.830 -21.475 1.00 25.01 H new ATOM 0 HG2 ARG A 106 6.797 -34.644 -20.136 1.00 25.84 H new ATOM 0 HG3 ARG A 106 5.144 -34.543 -19.565 1.00 25.84 H new ATOM 0 HD2 ARG A 106 4.362 -35.528 -21.735 1.00 26.70 H new ATOM 0 HD3 ARG A 106 6.031 -35.681 -22.246 1.00 26.70 H new ATOM 0 HE ARG A 106 5.840 -36.987 -19.745 1.00 27.44 H new ATOM 0 HH11 ARG A 106 4.545 -37.275 -23.020 1.00 28.51 H new ATOM 0 HH12 ARG A 106 4.333 -39.025 -22.905 1.00 28.51 H new ATOM 0 HH21 ARG A 106 5.549 -39.234 -19.603 1.00 28.96 H new ATOM 0 HH22 ARG A 106 4.898 -40.129 -20.981 1.00 28.96 H new ATOM 1623 N PHE A 107 3.301 -33.423 -19.074 1.00 24.01 N ATOM 1624 CA PHE A 107 1.973 -33.908 -18.716 1.00 24.21 C ATOM 1625 C PHE A 107 1.011 -32.752 -18.465 1.00 23.32 C ATOM 1626 O PHE A 107 -0.141 -32.786 -18.900 1.00 23.61 O ATOM 1627 CB PHE A 107 2.050 -34.803 -17.477 1.00 24.45 C ATOM 1628 CG PHE A 107 0.778 -35.549 -17.191 1.00 25.01 C ATOM 1629 CD1 PHE A 107 0.546 -36.793 -17.755 1.00 25.30 C ATOM 1630 CD2 PHE A 107 -0.188 -35.004 -16.359 1.00 25.33 C ATOM 1631 CE1 PHE A 107 -0.625 -37.480 -17.495 1.00 25.91 C ATOM 1632 CE2 PHE A 107 -1.360 -35.686 -16.096 1.00 25.94 C ATOM 1633 CZ PHE A 107 -1.572 -36.934 -16.656 1.00 26.22 C ATOM 0 H PHE A 107 4.059 -33.839 -18.534 1.00 24.01 H new ATOM 0 HA PHE A 107 1.593 -34.491 -19.555 1.00 24.21 H new ATOM 0 HB2 PHE A 107 2.860 -35.521 -17.608 1.00 24.45 H new ATOM 0 HB3 PHE A 107 2.304 -34.190 -16.612 1.00 24.45 H new ATOM 0 HD1 PHE A 107 1.289 -37.231 -18.405 1.00 25.30 H new ATOM 0 HD2 PHE A 107 -0.022 -34.035 -15.911 1.00 25.33 H new ATOM 0 HE1 PHE A 107 -0.798 -38.444 -17.949 1.00 25.91 H new ATOM 0 HE2 PHE A 107 -2.110 -35.246 -15.455 1.00 25.94 H new ATOM 0 HZ PHE A 107 -2.478 -37.479 -16.436 1.00 26.22 H new ATOM 1643 N VAL A 108 1.487 -31.731 -17.762 1.00 22.31 N ATOM 1644 CA VAL A 108 0.662 -30.570 -17.454 1.00 21.42 C ATOM 1645 C VAL A 108 0.588 -29.610 -18.637 1.00 21.31 C ATOM 1646 O VAL A 108 -0.492 -29.145 -18.994 1.00 21.31 O ATOM 1647 CB VAL A 108 1.186 -29.817 -16.216 1.00 20.36 C ATOM 1648 CG1 VAL A 108 0.327 -28.593 -15.929 1.00 19.77 C ATOM 1649 CG2 VAL A 108 1.224 -30.741 -15.008 1.00 20.26 C ATOM 0 H VAL A 108 2.438 -31.684 -17.395 1.00 22.31 H new ATOM 0 HA VAL A 108 -0.339 -30.945 -17.240 1.00 21.42 H new ATOM 0 HB VAL A 108 2.202 -29.480 -16.423 1.00 20.36 H new ATOM 0 HG11 VAL A 108 0.713 -28.075 -15.051 1.00 19.77 H new ATOM 0 HG12 VAL A 108 0.352 -27.921 -16.787 1.00 19.77 H new ATOM 0 HG13 VAL A 108 -0.701 -28.905 -15.743 1.00 19.77 H new ATOM 0 HG21 VAL A 108 1.596 -30.193 -14.142 1.00 20.26 H new ATOM 0 HG22 VAL A 108 0.219 -31.109 -14.800 1.00 20.26 H new ATOM 0 HG23 VAL A 108 1.883 -31.584 -15.215 1.00 20.26 H new ATOM 1659 N MET A 109 1.736 -29.319 -19.245 1.00 21.33 N ATOM 1660 CA MET A 109 1.795 -28.408 -20.387 1.00 21.35 C ATOM 1661 C MET A 109 0.747 -28.763 -21.439 1.00 22.24 C ATOM 1662 O MET A 109 0.133 -27.880 -22.038 1.00 22.21 O ATOM 1663 CB MET A 109 3.188 -28.430 -21.014 1.00 21.65 C ATOM 1664 CG MET A 109 4.222 -27.627 -20.240 1.00 20.93 C ATOM 1665 SD MET A 109 3.943 -25.848 -20.347 1.00 20.76 S ATOM 1666 CE MET A 109 4.166 -25.571 -22.103 1.00 21.25 C ATOM 0 H MET A 109 2.639 -29.701 -18.966 1.00 21.33 H new ATOM 0 HA MET A 109 1.582 -27.404 -20.020 1.00 21.35 H new ATOM 0 HB2 MET A 109 3.526 -29.463 -21.089 1.00 21.65 H new ATOM 0 HB3 MET A 109 3.125 -28.040 -22.030 1.00 21.65 H new ATOM 0 HG2 MET A 109 4.204 -27.931 -19.194 1.00 20.93 H new ATOM 0 HG3 MET A 109 5.216 -27.858 -20.622 1.00 20.93 H new ATOM 0 HE1 MET A 109 3.771 -24.591 -22.370 1.00 21.25 H new ATOM 0 HE2 MET A 109 5.228 -25.613 -22.346 1.00 21.25 H new ATOM 0 HE3 MET A 109 3.635 -26.340 -22.663 1.00 21.25 H new ATOM 1676 N ILE A 110 0.550 -30.059 -21.662 1.00 23.11 N ATOM 1677 CA ILE A 110 -0.426 -30.524 -22.642 1.00 24.06 C ATOM 1678 C ILE A 110 -1.836 -30.101 -22.243 1.00 23.82 C ATOM 1679 O ILE A 110 -2.682 -29.835 -23.098 1.00 24.33 O ATOM 1680 CB ILE A 110 -0.368 -32.057 -22.804 1.00 25.05 C ATOM 1681 CG1 ILE A 110 1.031 -32.482 -23.255 1.00 25.40 C ATOM 1682 CG2 ILE A 110 -1.418 -32.530 -23.799 1.00 26.06 C ATOM 1683 CD1 ILE A 110 1.291 -33.968 -23.119 1.00 26.28 C ATOM 0 H ILE A 110 1.052 -30.804 -21.179 1.00 23.11 H new ATOM 0 HA ILE A 110 -0.174 -30.065 -23.598 1.00 24.06 H new ATOM 0 HB ILE A 110 -0.581 -32.520 -21.840 1.00 25.05 H new ATOM 0 HG12 ILE A 110 1.171 -32.192 -24.296 1.00 25.40 H new ATOM 0 HG13 ILE A 110 1.772 -31.938 -22.670 1.00 25.40 H new ATOM 0 HG21 ILE A 110 -1.362 -33.614 -23.900 1.00 26.06 H new ATOM 0 HG22 ILE A 110 -2.409 -32.250 -23.443 1.00 26.06 H new ATOM 0 HG23 ILE A 110 -1.236 -32.065 -24.768 1.00 26.06 H new ATOM 0 HD11 ILE A 110 2.302 -34.193 -23.458 1.00 26.28 H new ATOM 0 HD12 ILE A 110 1.184 -34.262 -22.075 1.00 26.28 H new ATOM 0 HD13 ILE A 110 0.574 -34.520 -23.726 1.00 26.28 H new ATOM 1695 N ASN A 111 -2.080 -30.040 -20.938 1.00 23.14 N ATOM 1696 CA ASN A 111 -3.382 -29.635 -20.419 1.00 22.94 C ATOM 1697 C ASN A 111 -3.645 -28.167 -20.735 1.00 22.38 C ATOM 1698 O ASN A 111 -4.752 -27.791 -21.120 1.00 22.72 O ATOM 1699 CB ASN A 111 -3.445 -29.862 -18.907 1.00 22.34 C ATOM 1700 CG ASN A 111 -3.363 -31.331 -18.537 1.00 23.08 C ATOM 1701 OD1 ASN A 111 -2.757 -32.131 -19.250 1.00 23.74 O ATOM 1702 ND2 ASN A 111 -3.975 -31.694 -17.415 1.00 23.04 N ATOM 0 H ASN A 111 -1.392 -30.266 -20.219 1.00 23.14 H new ATOM 0 HA ASN A 111 -4.149 -30.242 -20.900 1.00 22.94 H new ATOM 0 HB2 ASN A 111 -2.628 -29.324 -18.427 1.00 22.34 H new ATOM 0 HB3 ASN A 111 -4.374 -29.444 -18.518 1.00 22.34 H new ATOM 0 HD21 ASN A 111 -3.954 -32.669 -17.115 1.00 23.04 H new ATOM 0 HD22 ASN A 111 -4.466 -30.998 -16.854 1.00 23.04 H new ATOM 1709 N LEU A 112 -2.614 -27.345 -20.566 1.00 21.58 N ATOM 1710 CA LEU A 112 -2.717 -25.915 -20.836 1.00 21.04 C ATOM 1711 C LEU A 112 -3.117 -25.674 -22.284 1.00 21.87 C ATOM 1712 O LEU A 112 -3.829 -24.720 -22.596 1.00 21.84 O ATOM 1713 CB LEU A 112 -1.389 -25.218 -20.539 1.00 20.05 C ATOM 1714 CG LEU A 112 -1.055 -25.049 -19.053 1.00 19.21 C ATOM 1715 CD1 LEU A 112 -0.881 -26.394 -18.371 1.00 19.02 C ATOM 1716 CD2 LEU A 112 0.198 -24.204 -18.879 1.00 18.68 C ATOM 0 H LEU A 112 -1.695 -27.646 -20.242 1.00 21.58 H new ATOM 0 HA LEU A 112 -3.486 -25.499 -20.185 1.00 21.04 H new ATOM 0 HB2 LEU A 112 -0.587 -25.784 -21.012 1.00 20.05 H new ATOM 0 HB3 LEU A 112 -1.402 -24.233 -21.006 1.00 20.05 H new ATOM 0 HG LEU A 112 -1.893 -24.536 -18.581 1.00 19.21 H new ATOM 0 HD11 LEU A 112 -0.645 -26.240 -17.318 1.00 19.02 H new ATOM 0 HD12 LEU A 112 -1.804 -26.967 -18.456 1.00 19.02 H new ATOM 0 HD13 LEU A 112 -0.069 -26.942 -18.849 1.00 19.02 H new ATOM 0 HD21 LEU A 112 0.419 -24.095 -17.817 1.00 18.68 H new ATOM 0 HD22 LEU A 112 1.037 -24.691 -19.376 1.00 18.68 H new ATOM 0 HD23 LEU A 112 0.037 -23.220 -19.319 1.00 18.68 H new ATOM 1728 N GLY A 113 -2.648 -26.552 -23.162 1.00 22.70 N ATOM 1729 CA GLY A 113 -2.963 -26.437 -24.574 1.00 23.62 C ATOM 1730 C GLY A 113 -1.782 -25.968 -25.398 1.00 23.76 C ATOM 1731 O GLY A 113 -1.943 -25.553 -26.546 1.00 24.44 O ATOM 0 H GLY A 113 -2.053 -27.345 -22.921 1.00 22.70 H new ATOM 0 HA2 GLY A 113 -3.300 -27.404 -24.947 1.00 23.62 H new ATOM 0 HA3 GLY A 113 -3.791 -25.739 -24.702 1.00 23.62 H new ATOM 1735 N GLU A 114 -0.590 -26.037 -24.814 1.00 23.22 N ATOM 1736 CA GLU A 114 0.623 -25.612 -25.502 1.00 23.41 C ATOM 1737 C GLU A 114 1.238 -26.767 -26.288 1.00 24.22 C ATOM 1738 O GLU A 114 1.810 -26.561 -27.358 1.00 24.14 O ATOM 1739 CB GLU A 114 1.633 -25.064 -24.495 1.00 22.59 C ATOM 1740 CG GLU A 114 1.124 -23.857 -23.722 1.00 21.89 C ATOM 1741 CD GLU A 114 0.774 -22.690 -24.626 1.00 21.84 C ATOM 1742 OE1 GLU A 114 -0.387 -22.617 -25.079 1.00 21.76 O ATOM 1743 OE2 GLU A 114 1.662 -21.850 -24.882 1.00 21.97 O ATOM 0 H GLU A 114 -0.439 -26.383 -23.867 1.00 23.22 H new ATOM 0 HA GLU A 114 0.358 -24.824 -26.206 1.00 23.41 H new ATOM 0 HB2 GLU A 114 1.896 -25.853 -23.790 1.00 22.59 H new ATOM 0 HB3 GLU A 114 2.547 -24.789 -25.022 1.00 22.59 H new ATOM 0 HG2 GLU A 114 0.243 -24.143 -23.147 1.00 21.89 H new ATOM 0 HG3 GLU A 114 1.883 -23.542 -23.006 1.00 21.89 H new ATOM 1750 N LYS A 115 1.113 -27.978 -25.750 1.00 25.07 N ATOM 1751 CA LYS A 115 1.653 -29.172 -26.396 1.00 25.94 C ATOM 1752 C LYS A 115 3.154 -29.035 -26.643 1.00 25.87 C ATOM 1753 O LYS A 115 3.580 -28.412 -27.616 1.00 26.08 O ATOM 1754 CB LYS A 115 0.933 -29.439 -27.720 1.00 27.05 C ATOM 1755 CG LYS A 115 1.336 -30.750 -28.375 1.00 27.83 C ATOM 1756 CD LYS A 115 0.858 -30.827 -29.816 1.00 28.38 C ATOM 1757 CE LYS A 115 1.648 -29.890 -30.716 1.00 29.16 C ATOM 1758 NZ LYS A 115 3.099 -30.223 -30.730 1.00 29.75 N ATOM 0 H LYS A 115 0.640 -28.159 -24.864 1.00 25.07 H new ATOM 0 HA LYS A 115 1.489 -30.014 -25.724 1.00 25.94 H new ATOM 0 HB2 LYS A 115 -0.143 -29.445 -27.545 1.00 27.05 H new ATOM 0 HB3 LYS A 115 1.139 -28.619 -28.408 1.00 27.05 H new ATOM 0 HG2 LYS A 115 2.421 -30.854 -28.345 1.00 27.83 H new ATOM 0 HG3 LYS A 115 0.920 -31.583 -27.808 1.00 27.83 H new ATOM 0 HD2 LYS A 115 0.956 -31.850 -30.179 1.00 28.38 H new ATOM 0 HD3 LYS A 115 -0.201 -30.572 -29.863 1.00 28.38 H new ATOM 0 HE2 LYS A 115 1.254 -29.944 -31.731 1.00 29.16 H new ATOM 0 HE3 LYS A 115 1.515 -28.863 -30.376 1.00 29.16 H new ATOM 0 HZ1 LYS A 115 3.541 -29.812 -31.577 1.00 29.75 H new ATOM 0 HZ2 LYS A 115 3.553 -29.834 -29.879 1.00 29.75 H new ATOM 0 HZ3 LYS A 115 3.218 -31.256 -30.744 1.00 29.75 H new ATOM 1772 N VAL A 116 3.947 -29.629 -25.759 1.00 25.67 N ATOM 1773 CA VAL A 116 5.399 -29.579 -25.876 1.00 25.69 C ATOM 1774 C VAL A 116 5.999 -30.974 -25.948 1.00 26.53 C ATOM 1775 O VAL A 116 5.413 -31.941 -25.463 1.00 26.78 O ATOM 1776 CB VAL A 116 6.039 -28.848 -24.682 1.00 24.51 C ATOM 1777 CG1 VAL A 116 5.931 -27.342 -24.841 1.00 23.77 C ATOM 1778 CG2 VAL A 116 5.402 -29.303 -23.379 1.00 24.02 C ATOM 0 H VAL A 116 3.608 -30.152 -24.952 1.00 25.67 H new ATOM 0 HA VAL A 116 5.611 -29.036 -26.797 1.00 25.69 H new ATOM 0 HB VAL A 116 7.098 -29.103 -24.655 1.00 24.51 H new ATOM 0 HG11 VAL A 116 6.391 -26.852 -23.983 1.00 23.77 H new ATOM 0 HG12 VAL A 116 6.443 -27.035 -25.753 1.00 23.77 H new ATOM 0 HG13 VAL A 116 4.881 -27.057 -24.901 1.00 23.77 H new ATOM 0 HG21 VAL A 116 5.865 -28.777 -22.544 1.00 24.02 H new ATOM 0 HG22 VAL A 116 4.335 -29.082 -23.399 1.00 24.02 H new ATOM 0 HG23 VAL A 116 5.548 -30.376 -23.258 1.00 24.02 H new ATOM 1788 N THR A 117 7.172 -31.067 -26.558 1.00 27.04 N ATOM 1789 CA THR A 117 7.875 -32.332 -26.674 1.00 27.90 C ATOM 1790 C THR A 117 8.819 -32.504 -25.493 1.00 27.38 C ATOM 1791 O THR A 117 9.409 -31.535 -25.017 1.00 26.61 O ATOM 1792 CB THR A 117 8.681 -32.417 -27.984 1.00 28.88 C ATOM 1793 OG1 THR A 117 9.684 -31.395 -28.009 1.00 28.45 O ATOM 1794 CG2 THR A 117 7.770 -32.265 -29.194 1.00 29.54 C ATOM 0 H THR A 117 7.657 -30.276 -26.981 1.00 27.04 H new ATOM 0 HA THR A 117 7.129 -33.127 -26.680 1.00 27.90 H new ATOM 0 HB THR A 117 9.156 -33.397 -28.027 1.00 28.88 H new ATOM 0 HG1 THR A 117 10.193 -31.457 -28.844 1.00 28.45 H new ATOM 0 HG21 THR A 117 8.363 -32.329 -30.106 1.00 29.54 H new ATOM 0 HG22 THR A 117 7.024 -33.060 -29.190 1.00 29.54 H new ATOM 0 HG23 THR A 117 7.270 -31.298 -29.153 1.00 29.54 H new ATOM 1802 N ASP A 118 8.956 -33.737 -25.020 1.00 27.85 N ATOM 1803 CA ASP A 118 9.823 -34.031 -23.884 1.00 27.53 C ATOM 1804 C ASP A 118 11.236 -33.500 -24.111 1.00 27.56 C ATOM 1805 O ASP A 118 12.005 -33.349 -23.166 1.00 27.11 O ATOM 1806 CB ASP A 118 9.870 -35.538 -23.630 1.00 28.39 C ATOM 1807 CG ASP A 118 8.521 -36.096 -23.223 1.00 28.44 C ATOM 1808 OD1 ASP A 118 7.683 -36.333 -24.117 1.00 28.58 O ATOM 1809 OD2 ASP A 118 8.304 -36.295 -22.009 1.00 28.40 O ATOM 0 H ASP A 118 8.477 -34.551 -25.406 1.00 27.85 H new ATOM 0 HA ASP A 118 9.407 -33.530 -23.010 1.00 27.53 H new ATOM 0 HB2 ASP A 118 10.213 -36.045 -24.532 1.00 28.39 H new ATOM 0 HB3 ASP A 118 10.599 -35.750 -22.848 1.00 28.39 H new ATOM 1814 N GLU A 119 11.566 -33.206 -25.364 1.00 28.18 N ATOM 1815 CA GLU A 119 12.891 -32.705 -25.709 1.00 28.39 C ATOM 1816 C GLU A 119 13.034 -31.213 -25.414 1.00 27.39 C ATOM 1817 O GLU A 119 13.946 -30.802 -24.697 1.00 26.99 O ATOM 1818 CB GLU A 119 13.186 -32.969 -27.187 1.00 29.53 C ATOM 1819 CG GLU A 119 13.162 -34.442 -27.560 1.00 30.59 C ATOM 1820 CD GLU A 119 13.442 -34.674 -29.033 1.00 31.58 C ATOM 1821 OE1 GLU A 119 14.630 -34.805 -29.398 1.00 32.06 O ATOM 1822 OE2 GLU A 119 12.475 -34.722 -29.820 1.00 31.92 O ATOM 0 H GLU A 119 10.934 -33.306 -26.158 1.00 28.18 H new ATOM 0 HA GLU A 119 13.611 -33.238 -25.088 1.00 28.39 H new ATOM 0 HB2 GLU A 119 12.454 -32.437 -27.795 1.00 29.53 H new ATOM 0 HB3 GLU A 119 14.165 -32.557 -27.433 1.00 29.53 H new ATOM 0 HG2 GLU A 119 13.902 -34.976 -26.964 1.00 30.59 H new ATOM 0 HG3 GLU A 119 12.188 -34.861 -27.308 1.00 30.59 H new ATOM 1829 N GLU A 120 12.132 -30.405 -25.968 1.00 27.04 N ATOM 1830 CA GLU A 120 12.184 -28.956 -25.773 1.00 26.15 C ATOM 1831 C GLU A 120 12.106 -28.574 -24.297 1.00 24.97 C ATOM 1832 O GLU A 120 12.849 -27.703 -23.834 1.00 24.41 O ATOM 1833 CB GLU A 120 11.071 -28.265 -26.565 1.00 26.05 C ATOM 1834 CG GLU A 120 9.667 -28.624 -26.114 1.00 25.61 C ATOM 1835 CD GLU A 120 8.606 -27.865 -26.887 1.00 25.53 C ATOM 1836 OE1 GLU A 120 8.435 -26.656 -26.627 1.00 24.93 O ATOM 1837 OE2 GLU A 120 7.952 -28.477 -27.757 1.00 26.13 O ATOM 0 H GLU A 120 11.360 -30.726 -26.552 1.00 27.04 H new ATOM 0 HA GLU A 120 13.149 -28.614 -26.148 1.00 26.15 H new ATOM 0 HB2 GLU A 120 11.201 -27.186 -26.485 1.00 26.05 H new ATOM 0 HB3 GLU A 120 11.178 -28.522 -27.619 1.00 26.05 H new ATOM 0 HG2 GLU A 120 9.509 -29.695 -26.240 1.00 25.61 H new ATOM 0 HG3 GLU A 120 9.563 -28.409 -25.050 1.00 25.61 H new ATOM 1844 N ILE A 121 11.222 -29.226 -23.552 1.00 24.65 N ATOM 1845 CA ILE A 121 11.069 -28.920 -22.137 1.00 23.60 C ATOM 1846 C ILE A 121 12.234 -29.468 -21.321 1.00 23.80 C ATOM 1847 O ILE A 121 12.672 -28.837 -20.360 1.00 23.05 O ATOM 1848 CB ILE A 121 9.736 -29.443 -21.575 1.00 23.30 C ATOM 1849 CG1 ILE A 121 9.678 -30.968 -21.616 1.00 24.33 C ATOM 1850 CG2 ILE A 121 8.578 -28.847 -22.361 1.00 22.99 C ATOM 1851 CD1 ILE A 121 8.571 -31.552 -20.769 1.00 24.19 C ATOM 0 H ILE A 121 10.607 -29.962 -23.900 1.00 24.65 H new ATOM 0 HA ILE A 121 11.066 -27.833 -22.052 1.00 23.60 H new ATOM 0 HB ILE A 121 9.659 -29.136 -20.532 1.00 23.30 H new ATOM 0 HG12 ILE A 121 9.544 -31.291 -22.648 1.00 24.33 H new ATOM 0 HG13 ILE A 121 10.633 -31.369 -21.278 1.00 24.33 H new ATOM 0 HG21 ILE A 121 7.636 -29.220 -21.960 1.00 22.99 H new ATOM 0 HG22 ILE A 121 8.603 -27.760 -22.278 1.00 22.99 H new ATOM 0 HG23 ILE A 121 8.664 -29.133 -23.409 1.00 22.99 H new ATOM 0 HD11 ILE A 121 8.589 -32.639 -20.846 1.00 24.19 H new ATOM 0 HD12 ILE A 121 8.715 -31.259 -19.729 1.00 24.19 H new ATOM 0 HD13 ILE A 121 7.609 -31.180 -21.121 1.00 24.19 H new ATOM 1863 N ASP A 122 12.737 -30.643 -21.701 1.00 24.87 N ATOM 1864 CA ASP A 122 13.872 -31.232 -20.999 1.00 25.26 C ATOM 1865 C ASP A 122 15.053 -30.272 -21.035 1.00 25.13 C ATOM 1866 O ASP A 122 15.839 -30.199 -20.090 1.00 24.95 O ATOM 1867 CB ASP A 122 14.269 -32.569 -21.627 1.00 26.55 C ATOM 1868 CG ASP A 122 15.526 -33.148 -21.007 1.00 27.08 C ATOM 1869 OD1 ASP A 122 15.408 -33.881 -20.003 1.00 27.39 O ATOM 1870 OD2 ASP A 122 16.626 -32.869 -21.527 1.00 27.28 O ATOM 0 H ASP A 122 12.381 -31.197 -22.480 1.00 24.87 H new ATOM 0 HA ASP A 122 13.581 -31.413 -19.964 1.00 25.26 H new ATOM 0 HB2 ASP A 122 13.450 -33.279 -21.512 1.00 26.55 H new ATOM 0 HB3 ASP A 122 14.424 -32.433 -22.697 1.00 26.55 H new ATOM 1875 N GLU A 123 15.169 -29.537 -22.139 1.00 25.32 N ATOM 1876 CA GLU A 123 16.242 -28.567 -22.304 1.00 25.30 C ATOM 1877 C GLU A 123 16.020 -27.374 -21.383 1.00 24.05 C ATOM 1878 O GLU A 123 16.960 -26.876 -20.765 1.00 23.89 O ATOM 1879 CB GLU A 123 16.332 -28.099 -23.758 1.00 25.91 C ATOM 1880 CG GLU A 123 16.801 -29.181 -24.717 1.00 27.23 C ATOM 1881 CD GLU A 123 16.991 -28.664 -26.130 1.00 27.86 C ATOM 1882 OE1 GLU A 123 18.098 -28.176 -26.440 1.00 28.28 O ATOM 1883 OE2 GLU A 123 16.032 -28.748 -26.926 1.00 27.98 O ATOM 0 H GLU A 123 14.530 -29.597 -22.932 1.00 25.32 H new ATOM 0 HA GLU A 123 17.183 -29.050 -22.039 1.00 25.30 H new ATOM 0 HB2 GLU A 123 15.353 -27.742 -24.077 1.00 25.91 H new ATOM 0 HB3 GLU A 123 17.015 -27.252 -23.817 1.00 25.91 H new ATOM 0 HG2 GLU A 123 17.741 -29.598 -24.357 1.00 27.23 H new ATOM 0 HG3 GLU A 123 16.075 -29.994 -24.726 1.00 27.23 H new ATOM 1890 N MET A 124 14.772 -26.916 -21.297 1.00 23.22 N ATOM 1891 CA MET A 124 14.437 -25.789 -20.437 1.00 21.99 C ATOM 1892 C MET A 124 14.723 -26.133 -18.979 1.00 21.54 C ATOM 1893 O MET A 124 15.094 -25.268 -18.185 1.00 20.82 O ATOM 1894 CB MET A 124 12.967 -25.400 -20.610 1.00 21.32 C ATOM 1895 CG MET A 124 12.483 -24.390 -19.584 1.00 20.01 C ATOM 1896 SD MET A 124 10.811 -23.798 -19.917 1.00 19.35 S ATOM 1897 CE MET A 124 9.867 -25.310 -19.746 1.00 19.76 C ATOM 0 H MET A 124 13.982 -27.307 -21.810 1.00 23.22 H new ATOM 0 HA MET A 124 15.056 -24.939 -20.725 1.00 21.99 H new ATOM 0 HB2 MET A 124 12.823 -24.988 -21.609 1.00 21.32 H new ATOM 0 HB3 MET A 124 12.352 -26.297 -20.543 1.00 21.32 H new ATOM 0 HG2 MET A 124 12.512 -24.844 -18.593 1.00 20.01 H new ATOM 0 HG3 MET A 124 13.167 -23.541 -19.566 1.00 20.01 H new ATOM 0 HE1 MET A 124 8.973 -25.116 -19.154 1.00 19.76 H new ATOM 0 HE2 MET A 124 9.578 -25.672 -20.733 1.00 19.76 H new ATOM 0 HE3 MET A 124 10.475 -26.064 -19.247 1.00 19.76 H new ATOM 1907 N ILE A 125 14.546 -27.405 -18.635 1.00 22.08 N ATOM 1908 CA ILE A 125 14.792 -27.873 -17.278 1.00 21.89 C ATOM 1909 C ILE A 125 16.288 -27.925 -16.988 1.00 22.49 C ATOM 1910 O ILE A 125 16.729 -27.579 -15.896 1.00 22.09 O ATOM 1911 CB ILE A 125 14.181 -29.269 -17.045 1.00 22.46 C ATOM 1912 CG1 ILE A 125 12.657 -29.211 -17.185 1.00 21.89 C ATOM 1913 CG2 ILE A 125 14.577 -29.805 -15.674 1.00 22.55 C ATOM 1914 CD1 ILE A 125 11.993 -30.571 -17.154 1.00 22.55 C ATOM 0 H ILE A 125 14.232 -28.130 -19.280 1.00 22.08 H new ATOM 0 HA ILE A 125 14.315 -27.164 -16.601 1.00 21.89 H new ATOM 0 HB ILE A 125 14.571 -29.950 -17.801 1.00 22.46 H new ATOM 0 HG12 ILE A 125 12.250 -28.599 -16.380 1.00 21.89 H new ATOM 0 HG13 ILE A 125 12.405 -28.714 -18.122 1.00 21.89 H new ATOM 0 HG21 ILE A 125 14.136 -30.791 -15.528 1.00 22.55 H new ATOM 0 HG22 ILE A 125 15.663 -29.880 -15.612 1.00 22.55 H new ATOM 0 HG23 ILE A 125 14.216 -29.128 -14.900 1.00 22.55 H new ATOM 0 HD11 ILE A 125 10.915 -30.452 -17.258 1.00 22.55 H new ATOM 0 HD12 ILE A 125 12.372 -31.180 -17.975 1.00 22.55 H new ATOM 0 HD13 ILE A 125 12.214 -31.062 -16.206 1.00 22.55 H new ATOM 1926 N ARG A 126 17.062 -28.360 -17.978 1.00 23.53 N ATOM 1927 CA ARG A 126 18.509 -28.458 -17.834 1.00 24.28 C ATOM 1928 C ARG A 126 19.137 -27.075 -17.686 1.00 23.77 C ATOM 1929 O ARG A 126 20.065 -26.884 -16.902 1.00 23.91 O ATOM 1930 CB ARG A 126 19.114 -29.175 -19.044 1.00 25.52 C ATOM 1931 CG ARG A 126 20.613 -29.405 -18.932 1.00 26.44 C ATOM 1932 CD ARG A 126 21.186 -29.971 -20.220 1.00 27.30 C ATOM 1933 NE ARG A 126 22.598 -30.316 -20.086 1.00 28.16 N ATOM 1934 CZ ARG A 126 23.421 -30.470 -21.119 1.00 28.99 C ATOM 1935 NH1 ARG A 126 22.975 -30.307 -22.357 1.00 29.08 N ATOM 1936 NH2 ARG A 126 24.692 -30.792 -20.915 1.00 29.80 N ATOM 0 H ARG A 126 16.709 -28.651 -18.890 1.00 23.53 H new ATOM 0 HA ARG A 126 18.721 -29.033 -16.933 1.00 24.28 H new ATOM 0 HB2 ARG A 126 18.616 -30.136 -19.172 1.00 25.52 H new ATOM 0 HB3 ARG A 126 18.911 -28.590 -19.941 1.00 25.52 H new ATOM 0 HG2 ARG A 126 21.110 -28.465 -18.694 1.00 26.44 H new ATOM 0 HG3 ARG A 126 20.817 -30.091 -18.109 1.00 26.44 H new ATOM 0 HD2 ARG A 126 20.622 -30.858 -20.509 1.00 27.30 H new ATOM 0 HD3 ARG A 126 21.066 -29.242 -21.021 1.00 27.30 H new ATOM 0 HE ARG A 126 22.975 -30.446 -19.147 1.00 28.16 H new ATOM 0 HH11 ARG A 126 21.998 -30.063 -22.519 1.00 29.08 H new ATOM 0 HH12 ARG A 126 23.609 -30.426 -23.147 1.00 29.08 H new ATOM 0 HH21 ARG A 126 25.039 -30.922 -19.965 1.00 29.80 H new ATOM 0 HH22 ARG A 126 25.322 -30.910 -21.709 1.00 29.80 H new ATOM 1950 N GLU A 127 18.620 -26.115 -18.447 1.00 23.26 N ATOM 1951 CA GLU A 127 19.127 -24.749 -18.408 1.00 22.80 C ATOM 1952 C GLU A 127 18.736 -24.052 -17.109 1.00 21.68 C ATOM 1953 O GLU A 127 19.438 -23.157 -16.640 1.00 21.50 O ATOM 1954 CB GLU A 127 18.598 -23.956 -19.606 1.00 22.59 C ATOM 1955 CG GLU A 127 19.107 -24.466 -20.944 1.00 23.70 C ATOM 1956 CD GLU A 127 18.494 -23.732 -22.121 1.00 23.91 C ATOM 1957 OE1 GLU A 127 18.848 -22.553 -22.333 1.00 24.13 O ATOM 1958 OE2 GLU A 127 17.665 -24.337 -22.832 1.00 23.95 O ATOM 0 H GLU A 127 17.849 -26.259 -19.099 1.00 23.26 H new ATOM 0 HA GLU A 127 20.215 -24.792 -18.457 1.00 22.80 H new ATOM 0 HB2 GLU A 127 17.509 -23.992 -19.603 1.00 22.59 H new ATOM 0 HB3 GLU A 127 18.882 -22.910 -19.493 1.00 22.59 H new ATOM 0 HG2 GLU A 127 20.191 -24.360 -20.980 1.00 23.70 H new ATOM 0 HG3 GLU A 127 18.887 -25.530 -21.030 1.00 23.70 H new ATOM 1965 N ALA A 128 17.613 -24.467 -16.532 1.00 21.01 N ATOM 1966 CA ALA A 128 17.133 -23.880 -15.287 1.00 19.97 C ATOM 1967 C ALA A 128 17.681 -24.626 -14.076 1.00 20.40 C ATOM 1968 O ALA A 128 17.744 -24.079 -12.975 1.00 19.88 O ATOM 1969 CB ALA A 128 15.610 -23.873 -15.260 1.00 19.05 C ATOM 0 H ALA A 128 17.019 -25.207 -16.907 1.00 21.01 H new ATOM 0 HA ALA A 128 17.493 -22.852 -15.239 1.00 19.97 H new ATOM 0 HB1 ALA A 128 15.265 -23.432 -14.325 1.00 19.05 H new ATOM 0 HB2 ALA A 128 15.234 -23.287 -16.098 1.00 19.05 H new ATOM 0 HB3 ALA A 128 15.240 -24.895 -15.337 1.00 19.05 H new ATOM 1975 N ASP A 129 18.083 -25.875 -14.289 1.00 21.43 N ATOM 1976 CA ASP A 129 18.623 -26.697 -13.214 1.00 22.05 C ATOM 1977 C ASP A 129 20.115 -26.443 -13.027 1.00 22.75 C ATOM 1978 O ASP A 129 20.935 -26.868 -13.840 1.00 23.69 O ATOM 1979 CB ASP A 129 18.375 -28.179 -13.501 1.00 22.95 C ATOM 1980 CG ASP A 129 19.031 -29.087 -12.480 1.00 23.80 C ATOM 1981 OD1 ASP A 129 19.017 -28.740 -11.281 1.00 23.96 O ATOM 1982 OD2 ASP A 129 19.563 -30.144 -12.880 1.00 24.38 O ATOM 0 H ASP A 129 18.045 -26.339 -15.196 1.00 21.43 H new ATOM 0 HA ASP A 129 18.111 -26.423 -12.291 1.00 22.05 H new ATOM 0 HB2 ASP A 129 17.302 -28.368 -13.514 1.00 22.95 H new ATOM 0 HB3 ASP A 129 18.753 -28.421 -14.494 1.00 22.95 H new ATOM 1987 N PHE A 130 20.455 -25.746 -11.949 1.00 22.35 N ATOM 1988 CA PHE A 130 21.848 -25.434 -11.649 1.00 23.04 C ATOM 1989 C PHE A 130 22.489 -26.548 -10.825 1.00 24.02 C ATOM 1990 O PHE A 130 23.710 -26.700 -10.814 1.00 25.05 O ATOM 1991 CB PHE A 130 21.950 -24.106 -10.897 1.00 22.22 C ATOM 1992 CG PHE A 130 21.378 -22.941 -11.652 1.00 21.35 C ATOM 1993 CD1 PHE A 130 22.083 -22.360 -12.695 1.00 21.23 C ATOM 1994 CD2 PHE A 130 20.136 -22.423 -11.318 1.00 20.73 C ATOM 1995 CE1 PHE A 130 21.561 -21.287 -13.391 1.00 20.51 C ATOM 1996 CE2 PHE A 130 19.609 -21.349 -12.011 1.00 20.01 C ATOM 1997 CZ PHE A 130 20.322 -20.780 -13.048 1.00 19.90 C ATOM 0 H PHE A 130 19.786 -25.386 -11.268 1.00 22.35 H new ATOM 0 HA PHE A 130 22.384 -25.348 -12.594 1.00 23.04 H new ATOM 0 HB2 PHE A 130 21.433 -24.198 -9.942 1.00 22.22 H new ATOM 0 HB3 PHE A 130 22.998 -23.904 -10.674 1.00 22.22 H new ATOM 0 HD1 PHE A 130 23.052 -22.751 -12.967 1.00 21.23 H new ATOM 0 HD2 PHE A 130 19.574 -22.863 -10.508 1.00 20.73 H new ATOM 0 HE1 PHE A 130 22.120 -20.845 -14.202 1.00 20.51 H new ATOM 0 HE2 PHE A 130 18.640 -20.955 -11.742 1.00 20.01 H new ATOM 0 HZ PHE A 130 19.912 -19.940 -13.590 1.00 19.90 H new ATOM 2007 N ASP A 131 21.655 -27.324 -10.137 1.00 23.76 N ATOM 2008 CA ASP A 131 22.142 -28.422 -9.308 1.00 24.71 C ATOM 2009 C ASP A 131 22.668 -29.567 -10.167 1.00 25.78 C ATOM 2010 O ASP A 131 23.634 -30.238 -9.802 1.00 26.78 O ATOM 2011 CB ASP A 131 21.036 -28.938 -8.395 1.00 24.21 C ATOM 2012 CG ASP A 131 20.153 -27.830 -7.856 1.00 23.32 C ATOM 2013 OD1 ASP A 131 20.692 -26.893 -7.229 1.00 22.53 O ATOM 2014 OD2 ASP A 131 18.923 -27.901 -8.060 1.00 23.46 O ATOM 0 H ASP A 131 20.641 -27.213 -10.137 1.00 23.76 H new ATOM 0 HA ASP A 131 22.960 -28.036 -8.699 1.00 24.71 H new ATOM 0 HB2 ASP A 131 20.421 -29.651 -8.944 1.00 24.21 H new ATOM 0 HB3 ASP A 131 21.483 -29.478 -7.561 1.00 24.21 H new ATOM 2019 N GLY A 132 22.022 -29.784 -11.308 1.00 25.60 N ATOM 2020 CA GLY A 132 22.433 -30.852 -12.203 1.00 26.62 C ATOM 2021 C GLY A 132 21.777 -32.173 -11.858 1.00 26.95 C ATOM 2022 O GLY A 132 22.303 -33.238 -12.182 1.00 27.86 O ATOM 0 H GLY A 132 21.221 -29.240 -11.630 1.00 25.60 H new ATOM 0 HA2 GLY A 132 22.182 -30.581 -13.229 1.00 26.62 H new ATOM 0 HA3 GLY A 132 23.516 -30.964 -12.159 1.00 26.62 H new ATOM 2026 N ASP A 133 20.622 -32.105 -11.201 1.00 26.26 N ATOM 2027 CA ASP A 133 19.894 -33.306 -10.806 1.00 26.58 C ATOM 2028 C ASP A 133 18.860 -33.700 -11.857 1.00 26.27 C ATOM 2029 O ASP A 133 18.715 -34.877 -12.184 1.00 26.65 O ATOM 2030 CB ASP A 133 19.212 -33.092 -9.453 1.00 26.12 C ATOM 2031 CG ASP A 133 18.175 -31.986 -9.492 1.00 24.90 C ATOM 2032 OD1 ASP A 133 18.569 -30.810 -9.624 1.00 24.55 O ATOM 2033 OD2 ASP A 133 16.968 -32.296 -9.394 1.00 24.32 O ATOM 0 H ASP A 133 20.171 -31.231 -10.931 1.00 26.26 H new ATOM 0 HA ASP A 133 20.614 -34.119 -10.719 1.00 26.58 H new ATOM 0 HB2 ASP A 133 18.736 -34.021 -9.139 1.00 26.12 H new ATOM 0 HB3 ASP A 133 19.966 -32.852 -8.704 1.00 26.12 H new ATOM 2038 N GLY A 134 18.144 -32.709 -12.384 1.00 25.66 N ATOM 2039 CA GLY A 134 17.137 -32.981 -13.396 1.00 25.42 C ATOM 2040 C GLY A 134 15.740 -32.577 -12.961 1.00 24.43 C ATOM 2041 O GLY A 134 14.760 -32.888 -13.639 1.00 24.42 O ATOM 0 H GLY A 134 18.243 -31.726 -12.129 1.00 25.66 H new ATOM 0 HA2 GLY A 134 17.396 -32.449 -14.311 1.00 25.42 H new ATOM 0 HA3 GLY A 134 17.145 -34.045 -13.633 1.00 25.42 H new ATOM 2045 N MET A 135 15.647 -31.881 -11.832 1.00 23.66 N ATOM 2046 CA MET A 135 14.358 -31.437 -11.309 1.00 22.72 C ATOM 2047 C MET A 135 14.345 -29.921 -11.124 1.00 21.56 C ATOM 2048 O MET A 135 15.396 -29.298 -10.976 1.00 21.55 O ATOM 2049 CB MET A 135 14.045 -32.137 -9.985 1.00 23.01 C ATOM 2050 CG MET A 135 14.183 -33.651 -10.052 1.00 24.25 C ATOM 2051 SD MET A 135 13.510 -34.479 -8.599 1.00 24.43 S ATOM 2052 CE MET A 135 11.752 -34.284 -8.884 1.00 23.79 C ATOM 0 H MET A 135 16.448 -31.612 -11.261 1.00 23.66 H new ATOM 0 HA MET A 135 13.587 -31.703 -12.032 1.00 22.72 H new ATOM 0 HB2 MET A 135 14.712 -31.753 -9.213 1.00 23.01 H new ATOM 0 HB3 MET A 135 13.029 -31.886 -9.682 1.00 23.01 H new ATOM 0 HG2 MET A 135 13.673 -34.019 -10.943 1.00 24.25 H new ATOM 0 HG3 MET A 135 15.236 -33.911 -10.157 1.00 24.25 H new ATOM 0 HE1 MET A 135 11.240 -34.163 -7.929 1.00 23.79 H new ATOM 0 HE2 MET A 135 11.579 -33.403 -9.503 1.00 23.79 H new ATOM 0 HE3 MET A 135 11.366 -35.167 -9.394 1.00 23.79 H new ATOM 2062 N ILE A 136 13.146 -29.337 -11.125 1.00 20.64 N ATOM 2063 CA ILE A 136 12.997 -27.891 -10.975 1.00 19.48 C ATOM 2064 C ILE A 136 12.326 -27.527 -9.657 1.00 18.80 C ATOM 2065 O ILE A 136 11.308 -28.101 -9.284 1.00 18.85 O ATOM 2066 CB ILE A 136 12.160 -27.289 -12.124 1.00 18.91 C ATOM 2067 CG1 ILE A 136 12.899 -27.409 -13.461 1.00 19.65 C ATOM 2068 CG2 ILE A 136 11.807 -25.834 -11.827 1.00 17.71 C ATOM 2069 CD1 ILE A 136 14.189 -26.618 -13.529 1.00 19.77 C ATOM 0 H ILE A 136 12.266 -29.843 -11.228 1.00 20.64 H new ATOM 0 HA ILE A 136 14.006 -27.478 -10.996 1.00 19.48 H new ATOM 0 HB ILE A 136 11.232 -27.856 -12.202 1.00 18.91 H new ATOM 0 HG12 ILE A 136 13.120 -28.460 -13.649 1.00 19.65 H new ATOM 0 HG13 ILE A 136 12.238 -27.074 -14.260 1.00 19.65 H new ATOM 0 HG21 ILE A 136 11.217 -25.428 -12.649 1.00 17.71 H new ATOM 0 HG22 ILE A 136 11.229 -25.781 -10.904 1.00 17.71 H new ATOM 0 HG23 ILE A 136 12.722 -25.253 -11.716 1.00 17.71 H new ATOM 0 HD11 ILE A 136 14.650 -26.757 -14.507 1.00 19.77 H new ATOM 0 HD12 ILE A 136 13.976 -25.560 -13.375 1.00 19.77 H new ATOM 0 HD13 ILE A 136 14.871 -26.967 -12.754 1.00 19.77 H new ATOM 2081 N ASN A 137 12.903 -26.547 -8.975 1.00 18.27 N ATOM 2082 CA ASN A 137 12.381 -26.068 -7.703 1.00 17.67 C ATOM 2083 C ASN A 137 11.895 -24.634 -7.867 1.00 16.40 C ATOM 2084 O ASN A 137 12.310 -23.957 -8.802 1.00 16.12 O ATOM 2085 CB ASN A 137 13.459 -26.143 -6.620 1.00 18.25 C ATOM 2086 CG ASN A 137 12.928 -25.785 -5.245 1.00 18.20 C ATOM 2087 OD1 ASN A 137 11.758 -26.015 -4.939 1.00 18.03 O ATOM 2088 ND2 ASN A 137 13.789 -25.219 -4.407 1.00 18.49 N ATOM 0 H ASN A 137 13.745 -26.063 -9.287 1.00 18.27 H new ATOM 0 HA ASN A 137 11.547 -26.700 -7.397 1.00 17.67 H new ATOM 0 HB2 ASN A 137 13.874 -27.151 -6.594 1.00 18.25 H new ATOM 0 HB3 ASN A 137 14.275 -25.468 -6.877 1.00 18.25 H new ATOM 0 HD21 ASN A 137 13.489 -24.957 -3.468 1.00 18.49 H new ATOM 0 HD22 ASN A 137 14.750 -25.047 -4.702 1.00 18.49 H new ATOM 2095 N TYR A 138 11.000 -24.182 -6.988 1.00 15.73 N ATOM 2096 CA TYR A 138 10.468 -22.817 -7.067 1.00 14.51 C ATOM 2097 C TYR A 138 11.552 -21.810 -7.460 1.00 14.21 C ATOM 2098 O TYR A 138 11.260 -20.772 -8.055 1.00 13.35 O ATOM 2099 CB TYR A 138 9.843 -22.413 -5.728 1.00 14.11 C ATOM 2100 CG TYR A 138 9.429 -20.958 -5.661 1.00 12.93 C ATOM 2101 CD1 TYR A 138 8.521 -20.432 -6.573 1.00 12.24 C ATOM 2102 CD2 TYR A 138 9.943 -20.112 -4.685 1.00 12.60 C ATOM 2103 CE1 TYR A 138 8.138 -19.105 -6.514 1.00 11.18 C ATOM 2104 CE2 TYR A 138 9.564 -18.784 -4.621 1.00 11.56 C ATOM 2105 CZ TYR A 138 8.676 -18.282 -5.538 1.00 10.81 C ATOM 2106 OH TYR A 138 8.284 -16.965 -5.476 1.00 9.80 O ATOM 0 H TYR A 138 10.629 -24.736 -6.216 1.00 15.73 H new ATOM 0 HA TYR A 138 9.702 -22.807 -7.843 1.00 14.51 H new ATOM 0 HB2 TYR A 138 8.970 -23.038 -5.542 1.00 14.11 H new ATOM 0 HB3 TYR A 138 10.556 -22.615 -4.929 1.00 14.11 H new ATOM 0 HD1 TYR A 138 8.108 -21.070 -7.340 1.00 12.24 H new ATOM 0 HD2 TYR A 138 10.650 -20.498 -3.965 1.00 12.60 H new ATOM 0 HE1 TYR A 138 7.425 -18.713 -7.224 1.00 11.18 H new ATOM 0 HE2 TYR A 138 9.966 -18.143 -3.850 1.00 11.56 H new ATOM 0 HH TYR A 138 8.749 -16.520 -4.737 1.00 9.80 H new ATOM 2116 N GLU A 139 12.805 -22.128 -7.147 1.00 15.05 N ATOM 2117 CA GLU A 139 13.922 -21.249 -7.471 1.00 15.05 C ATOM 2118 C GLU A 139 14.284 -21.371 -8.947 1.00 15.40 C ATOM 2119 O GLU A 139 14.325 -20.374 -9.671 1.00 14.88 O ATOM 2120 CB GLU A 139 15.136 -21.582 -6.601 1.00 16.02 C ATOM 2121 CG GLU A 139 14.885 -21.411 -5.112 1.00 15.89 C ATOM 2122 CD GLU A 139 14.560 -19.979 -4.735 1.00 16.64 C ATOM 2123 OE1 GLU A 139 13.366 -19.612 -4.769 1.00 17.06 O ATOM 2124 OE2 GLU A 139 15.499 -19.224 -4.406 1.00 16.91 O ATOM 0 H GLU A 139 13.071 -22.989 -6.669 1.00 15.05 H new ATOM 0 HA GLU A 139 13.620 -20.221 -7.269 1.00 15.05 H new ATOM 0 HB2 GLU A 139 15.439 -22.611 -6.794 1.00 16.02 H new ATOM 0 HB3 GLU A 139 15.969 -20.944 -6.896 1.00 16.02 H new ATOM 0 HG2 GLU A 139 14.061 -22.058 -4.810 1.00 15.89 H new ATOM 0 HG3 GLU A 139 15.766 -21.737 -4.559 1.00 15.89 H new ATOM 2131 N GLU A 140 14.543 -22.598 -9.390 1.00 16.39 N ATOM 2132 CA GLU A 140 14.893 -22.846 -10.783 1.00 16.95 C ATOM 2133 C GLU A 140 13.739 -22.440 -11.695 1.00 16.22 C ATOM 2134 O GLU A 140 13.949 -22.014 -12.831 1.00 16.37 O ATOM 2135 CB GLU A 140 15.230 -24.324 -11.005 1.00 18.12 C ATOM 2136 CG GLU A 140 15.968 -24.976 -9.846 1.00 18.79 C ATOM 2137 CD GLU A 140 16.806 -26.158 -10.288 1.00 20.10 C ATOM 2138 OE1 GLU A 140 16.311 -26.959 -11.105 1.00 20.52 O ATOM 2139 OE2 GLU A 140 17.954 -26.283 -9.817 1.00 20.75 O ATOM 0 H GLU A 140 14.517 -23.433 -8.805 1.00 16.39 H new ATOM 0 HA GLU A 140 15.772 -22.248 -11.024 1.00 16.95 H new ATOM 0 HB2 GLU A 140 14.306 -24.872 -11.187 1.00 18.12 H new ATOM 0 HB3 GLU A 140 15.838 -24.415 -11.905 1.00 18.12 H new ATOM 0 HG2 GLU A 140 16.610 -24.238 -9.366 1.00 18.79 H new ATOM 0 HG3 GLU A 140 15.246 -25.305 -9.098 1.00 18.79 H new ATOM 2146 N PHE A 141 12.520 -22.577 -11.180 1.00 15.58 N ATOM 2147 CA PHE A 141 11.321 -22.227 -11.930 1.00 14.98 C ATOM 2148 C PHE A 141 11.275 -20.726 -12.183 1.00 14.05 C ATOM 2149 O PHE A 141 11.163 -20.284 -13.325 1.00 14.12 O ATOM 2150 CB PHE A 141 10.069 -22.671 -11.164 1.00 14.62 C ATOM 2151 CG PHE A 141 8.781 -22.347 -11.870 1.00 14.16 C ATOM 2152 CD1 PHE A 141 8.169 -21.116 -11.694 1.00 13.21 C ATOM 2153 CD2 PHE A 141 8.180 -23.276 -12.703 1.00 14.81 C ATOM 2154 CE1 PHE A 141 6.981 -20.820 -12.334 1.00 12.98 C ATOM 2155 CE2 PHE A 141 6.994 -22.985 -13.347 1.00 14.61 C ATOM 2156 CZ PHE A 141 6.409 -21.743 -13.187 1.00 13.73 C ATOM 0 H PHE A 141 12.338 -22.930 -10.241 1.00 15.58 H new ATOM 0 HA PHE A 141 11.348 -22.743 -12.890 1.00 14.98 H new ATOM 0 HB2 PHE A 141 10.120 -23.747 -10.995 1.00 14.62 H new ATOM 0 HB3 PHE A 141 10.066 -22.194 -10.184 1.00 14.62 H new ATOM 0 HD1 PHE A 141 8.626 -20.380 -11.049 1.00 13.21 H new ATOM 0 HD2 PHE A 141 8.645 -24.240 -12.851 1.00 14.81 H new ATOM 0 HE1 PHE A 141 6.500 -19.867 -12.167 1.00 12.98 H new ATOM 0 HE2 PHE A 141 6.524 -23.727 -13.975 1.00 14.61 H new ATOM 0 HZ PHE A 141 5.507 -21.495 -13.727 1.00 13.73 H new ATOM 2166 N VAL A 142 11.356 -19.952 -11.106 1.00 13.29 N ATOM 2167 CA VAL A 142 11.334 -18.496 -11.196 1.00 12.40 C ATOM 2168 C VAL A 142 12.351 -17.988 -12.217 1.00 12.96 C ATOM 2169 O VAL A 142 12.090 -17.029 -12.946 1.00 12.60 O ATOM 2170 CB VAL A 142 11.617 -17.851 -9.821 1.00 11.84 C ATOM 2171 CG1 VAL A 142 11.999 -16.385 -9.972 1.00 11.29 C ATOM 2172 CG2 VAL A 142 10.405 -17.996 -8.913 1.00 11.16 C ATOM 0 H VAL A 142 11.438 -20.311 -10.155 1.00 13.29 H new ATOM 0 HA VAL A 142 10.335 -18.209 -11.524 1.00 12.40 H new ATOM 0 HB VAL A 142 12.460 -18.372 -9.367 1.00 11.84 H new ATOM 0 HG11 VAL A 142 12.193 -15.956 -8.989 1.00 11.29 H new ATOM 0 HG12 VAL A 142 12.896 -16.304 -10.586 1.00 11.29 H new ATOM 0 HG13 VAL A 142 11.182 -15.844 -10.449 1.00 11.29 H new ATOM 0 HG21 VAL A 142 10.617 -17.538 -7.947 1.00 11.16 H new ATOM 0 HG22 VAL A 142 9.547 -17.501 -9.369 1.00 11.16 H new ATOM 0 HG23 VAL A 142 10.181 -19.053 -8.771 1.00 11.16 H new ATOM 2182 N TRP A 143 13.504 -18.644 -12.272 1.00 13.99 N ATOM 2183 CA TRP A 143 14.564 -18.250 -13.193 1.00 14.75 C ATOM 2184 C TRP A 143 14.153 -18.427 -14.656 1.00 15.22 C ATOM 2185 O TRP A 143 14.300 -17.507 -15.458 1.00 15.27 O ATOM 2186 CB TRP A 143 15.833 -19.059 -12.922 1.00 15.86 C ATOM 2187 CG TRP A 143 16.973 -18.683 -13.817 1.00 16.76 C ATOM 2188 CD1 TRP A 143 17.912 -17.714 -13.605 1.00 16.94 C ATOM 2189 CD2 TRP A 143 17.281 -19.272 -15.077 1.00 17.71 C ATOM 2190 NE1 TRP A 143 18.787 -17.669 -14.666 1.00 17.96 N ATOM 2191 CE2 TRP A 143 18.418 -18.620 -15.583 1.00 18.43 C ATOM 2192 CE3 TRP A 143 16.699 -20.294 -15.821 1.00 18.11 C ATOM 2193 CZ2 TRP A 143 18.983 -18.959 -16.810 1.00 19.50 C ATOM 2194 CZ3 TRP A 143 17.258 -20.633 -17.039 1.00 19.15 C ATOM 2195 CH2 TRP A 143 18.392 -19.968 -17.523 1.00 19.83 C ATOM 0 H TRP A 143 13.729 -19.451 -11.690 1.00 13.99 H new ATOM 0 HA TRP A 143 14.756 -17.191 -13.022 1.00 14.75 H new ATOM 0 HB2 TRP A 143 16.132 -18.917 -11.884 1.00 15.86 H new ATOM 0 HB3 TRP A 143 15.614 -20.119 -13.048 1.00 15.86 H new ATOM 0 HD1 TRP A 143 17.960 -17.078 -12.734 1.00 16.94 H new ATOM 0 HE1 TRP A 143 19.579 -17.033 -14.756 1.00 17.96 H new ATOM 0 HE3 TRP A 143 15.826 -20.813 -15.453 1.00 18.11 H new ATOM 0 HZ2 TRP A 143 19.855 -18.445 -17.186 1.00 19.50 H new ATOM 0 HZ3 TRP A 143 16.814 -21.423 -17.627 1.00 19.15 H new ATOM 0 HH2 TRP A 143 18.808 -20.257 -18.477 1.00 19.83 H new ATOM 2206 N MET A 144 13.639 -19.606 -14.997 1.00 15.69 N ATOM 2207 CA MET A 144 13.256 -19.902 -16.379 1.00 16.33 C ATOM 2208 C MET A 144 11.968 -19.191 -16.798 1.00 15.63 C ATOM 2209 O MET A 144 11.837 -18.773 -17.949 1.00 16.10 O ATOM 2210 CB MET A 144 13.113 -21.414 -16.581 1.00 17.12 C ATOM 2211 CG MET A 144 11.869 -22.013 -15.946 1.00 16.59 C ATOM 2212 SD MET A 144 11.847 -23.815 -16.044 1.00 17.69 S ATOM 2213 CE MET A 144 10.415 -24.195 -15.039 1.00 17.05 C ATOM 0 H MET A 144 13.478 -20.370 -14.341 1.00 15.69 H new ATOM 0 HA MET A 144 14.055 -19.523 -17.017 1.00 16.33 H new ATOM 0 HB2 MET A 144 13.100 -21.627 -17.650 1.00 17.12 H new ATOM 0 HB3 MET A 144 13.992 -21.909 -16.168 1.00 17.12 H new ATOM 0 HG2 MET A 144 11.815 -21.708 -14.901 1.00 16.59 H new ATOM 0 HG3 MET A 144 10.984 -21.614 -16.441 1.00 16.59 H new ATOM 0 HE1 MET A 144 10.026 -25.175 -15.316 1.00 17.05 H new ATOM 0 HE2 MET A 144 10.700 -24.202 -13.987 1.00 17.05 H new ATOM 0 HE3 MET A 144 9.646 -23.440 -15.201 1.00 17.05 H new ATOM 2223 N ILE A 145 11.020 -19.058 -15.878 1.00 14.62 N ATOM 2224 CA ILE A 145 9.754 -18.402 -16.191 1.00 14.03 C ATOM 2225 C ILE A 145 9.964 -16.934 -16.546 1.00 13.62 C ATOM 2226 O ILE A 145 9.295 -16.398 -17.431 1.00 13.74 O ATOM 2227 CB ILE A 145 8.746 -18.508 -15.030 1.00 13.14 C ATOM 2228 CG1 ILE A 145 7.414 -17.881 -15.436 1.00 12.79 C ATOM 2229 CG2 ILE A 145 9.293 -17.833 -13.785 1.00 12.26 C ATOM 2230 CD1 ILE A 145 6.260 -18.257 -14.533 1.00 12.37 C ATOM 0 H ILE A 145 11.101 -19.392 -14.918 1.00 14.62 H new ATOM 0 HA ILE A 145 9.342 -18.924 -17.054 1.00 14.03 H new ATOM 0 HB ILE A 145 8.584 -19.562 -14.803 1.00 13.14 H new ATOM 0 HG12 ILE A 145 7.521 -16.796 -15.441 1.00 12.79 H new ATOM 0 HG13 ILE A 145 7.178 -18.183 -16.456 1.00 12.79 H new ATOM 0 HG21 ILE A 145 8.567 -17.918 -12.976 1.00 12.26 H new ATOM 0 HG22 ILE A 145 10.225 -18.315 -13.489 1.00 12.26 H new ATOM 0 HG23 ILE A 145 9.481 -16.780 -13.995 1.00 12.26 H new ATOM 0 HD11 ILE A 145 5.349 -17.773 -14.886 1.00 12.37 H new ATOM 0 HD12 ILE A 145 6.125 -19.339 -14.546 1.00 12.37 H new ATOM 0 HD13 ILE A 145 6.473 -17.931 -13.515 1.00 12.37 H new ATOM 2242 N SER A 146 10.897 -16.288 -15.855 1.00 13.30 N ATOM 2243 CA SER A 146 11.195 -14.883 -16.104 1.00 13.04 C ATOM 2244 C SER A 146 11.750 -14.703 -17.512 1.00 14.17 C ATOM 2245 O SER A 146 11.825 -13.587 -18.028 1.00 14.26 O ATOM 2246 CB SER A 146 12.197 -14.359 -15.073 1.00 12.74 C ATOM 2247 OG SER A 146 11.656 -14.410 -13.764 1.00 12.48 O ATOM 0 H SER A 146 11.459 -16.715 -15.119 1.00 13.30 H new ATOM 0 HA SER A 146 10.271 -14.312 -16.014 1.00 13.04 H new ATOM 0 HB2 SER A 146 13.111 -14.952 -15.116 1.00 12.74 H new ATOM 0 HB3 SER A 146 12.471 -13.333 -15.317 1.00 12.74 H new ATOM 0 HG SER A 146 11.754 -15.317 -13.405 1.00 12.48 H new ATOM 2253 N GLN A 147 12.137 -15.817 -18.124 1.00 15.13 N ATOM 2254 CA GLN A 147 12.693 -15.805 -19.471 1.00 16.31 C ATOM 2255 C GLN A 147 11.587 -15.870 -20.522 1.00 16.62 C ATOM 2256 O GLN A 147 11.679 -15.233 -21.572 1.00 17.39 O ATOM 2257 CB GLN A 147 13.648 -16.985 -19.648 1.00 17.27 C ATOM 2258 CG GLN A 147 14.501 -17.269 -18.422 1.00 17.07 C ATOM 2259 CD GLN A 147 15.539 -16.193 -18.157 1.00 17.24 C ATOM 2260 OE1 GLN A 147 15.353 -15.029 -18.510 1.00 17.61 O ATOM 2261 NE2 GLN A 147 16.642 -16.581 -17.526 1.00 17.09 N ATOM 0 H GLN A 147 12.075 -16.745 -17.705 1.00 15.13 H new ATOM 0 HA GLN A 147 13.239 -14.871 -19.607 1.00 16.31 H new ATOM 0 HB2 GLN A 147 13.069 -17.876 -19.892 1.00 17.27 H new ATOM 0 HB3 GLN A 147 14.302 -16.788 -20.497 1.00 17.27 H new ATOM 0 HG2 GLN A 147 13.854 -17.364 -17.550 1.00 17.07 H new ATOM 0 HG3 GLN A 147 15.004 -18.227 -18.551 1.00 17.07 H new ATOM 0 HE21 GLN A 147 16.756 -17.557 -17.251 1.00 17.09 H new ATOM 0 HE22 GLN A 147 17.375 -15.903 -17.317 1.00 17.09 H new ATOM 2270 N LYS A 148 10.545 -16.644 -20.233 1.00 16.13 N ATOM 2271 CA LYS A 148 9.423 -16.797 -21.155 1.00 16.53 C ATOM 2272 C LYS A 148 8.772 -15.448 -21.448 1.00 16.32 C ATOM 2273 O LYS A 148 9.128 -14.830 -22.474 1.00 16.11 O ATOM 2274 CB LYS A 148 8.383 -17.759 -20.579 1.00 16.16 C ATOM 2275 CG LYS A 148 8.980 -19.037 -20.009 1.00 16.47 C ATOM 2276 CD LYS A 148 7.911 -20.081 -19.707 1.00 16.26 C ATOM 2277 CE LYS A 148 7.026 -19.674 -18.537 1.00 16.41 C ATOM 2278 NZ LYS A 148 6.043 -18.618 -18.910 1.00 16.72 N ATOM 2279 OXT LYS A 148 7.912 -15.020 -20.650 1.00 16.50 O ATOM 0 H LYS A 148 10.454 -17.175 -19.367 1.00 16.13 H new ATOM 0 HA LYS A 148 9.810 -17.208 -22.088 1.00 16.53 H new ATOM 0 HB2 LYS A 148 7.824 -17.248 -19.795 1.00 16.16 H new ATOM 0 HB3 LYS A 148 7.670 -18.019 -21.361 1.00 16.16 H new ATOM 0 HG2 LYS A 148 9.699 -19.449 -20.717 1.00 16.47 H new ATOM 0 HG3 LYS A 148 9.529 -18.805 -19.096 1.00 16.47 H new ATOM 0 HD2 LYS A 148 7.293 -20.233 -20.592 1.00 16.26 H new ATOM 0 HD3 LYS A 148 8.389 -21.035 -19.484 1.00 16.26 H new ATOM 0 HE2 LYS A 148 6.492 -20.549 -18.167 1.00 16.41 H new ATOM 0 HE3 LYS A 148 7.651 -19.313 -17.720 1.00 16.41 H new ATOM 0 HZ1 LYS A 148 6.332 -17.711 -18.490 1.00 16.72 H new ATOM 0 HZ2 LYS A 148 6.009 -18.525 -19.945 1.00 16.72 H new ATOM 0 HZ3 LYS A 148 5.101 -18.879 -18.555 1.00 16.72 H new