USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1123 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 91 THR OG1 : rot 63:sc= 0.731 USER MOD Set 1.2: A 116 THR OG1 : rot -95:sc= 0.798 USER MOD Set 2.1: A 89 GLN : amide:sc= 0.739 K(o=0.74,f=-3.3!) USER MOD Set 2.2: A 117 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 7 TYR OH : rot -21:sc= 1.35 USER MOD Set 3.2: A 9 THR OG1 : rot -145:sc= 1.39 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 176:sc= 0 (180deg=-0.0175) USER MOD Single : A 3 HIS : no HD1:sc= -0.019 X(o=-0.019,f=-0.13) USER MOD Single : A 11 LYS NZ :NH3+ -167:sc= 2.26 (180deg=2.04) USER MOD Single : A 14 GLN : amide:sc= -6.4! C(o=-6.4!,f=-11!) USER MOD Single : A 16 ASN :FLIP amide:sc= -0.642 F(o=-1.4,f=-0.64) USER MOD Single : A 17 HIS : no HE2:sc= -0.0777 X(o=-0.078,f=-0.13) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -134:sc= -1.64 (180deg=-2.11) USER MOD Single : A 23 HIS : no HE2:sc= -0.337 X(o=-0.34,f=-0.65) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HE2:sc= 0.195 K(o=0.2,f=-4.1!) USER MOD Single : A 35 CYS SG : rot -150:sc= -1.4 USER MOD Single : A 36 THR OG1 : rot 43:sc= 0.676 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0741 USER MOD Single : A 48 HIS : no HD1:sc=-0.00156 X(o=-0.0016,f=-0.1) USER MOD Single : A 49 ASN : amide:sc= -0.354 X(o=-0.35,f=-0.16) USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 HIS : no HE2:sc= -0.284 X(o=-0.28,f=-0.42) USER MOD Single : A 62 CYS SG : rot -69:sc= 0.173 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.0371 USER MOD Single : A 68 TYR OH : rot 32:sc= 1.21 USER MOD Single : A 73 GLN : amide:sc= -0.253 X(o=-0.25,f=-0.18) USER MOD Single : A 74 MET CE :methyl 167:sc= -0.355 (180deg=-0.88) USER MOD Single : A 84 CYS SG : rot 162:sc= -0.382! USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl -163:sc= -0.111 (180deg=-0.747) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN :FLIP amide:sc= -0.0487 F(o=-0.58,f=-0.049) USER MOD Single : A 96 GLN : amide:sc= -0.567 K(o=-0.57,f=-1.9) USER MOD Single : A 109 SER OG : rot 24:sc= -0.307 USER MOD Single : A 111 GLN : amide:sc= 0.198 X(o=0.2,f=-0.1) USER MOD Single : A 112 CYS SG : rot -53:sc= -2.6 USER MOD Single : A 115 TYR OH : rot -99:sc= -0.569! USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 HIS : no HE2:sc= -0.398 X(o=-0.4,f=-0.57) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 SER OG : rot 180:sc= 0.131 USER MOD Single : A 139 HIS : no HD1:sc= -0.401 X(o=-0.4,f=-0.084) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -0.254 K(o=-0.25,f=-5.5!) USER MOD Single : A 148 ASN : amide:sc= -0.172 X(o=-0.17,f=-0.0094) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.051 -4.715 7.396 1.00 0.00 N ATOM 2 CA MET A 1 -16.642 -3.469 7.908 1.00 0.00 C ATOM 3 C MET A 1 -15.577 -2.394 8.183 1.00 0.00 C ATOM 4 O MET A 1 -15.728 -1.601 9.115 1.00 0.00 O ATOM 5 CB MET A 1 -17.545 -3.779 9.118 1.00 0.00 C ATOM 6 CG MET A 1 -16.807 -4.290 10.360 1.00 0.00 C ATOM 7 SD MET A 1 -17.918 -4.644 11.740 1.00 0.00 S ATOM 8 CE MET A 1 -16.682 -4.835 13.051 1.00 0.00 C ATOM 0 H1 MET A 1 -16.795 -5.434 7.289 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.608 -4.535 6.473 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.332 -5.058 8.064 1.00 0.00 H new ATOM 0 HA MET A 1 -17.278 -3.032 7.138 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.093 -2.875 9.385 1.00 0.00 H new ATOM 0 HB3 MET A 1 -18.284 -4.523 8.820 1.00 0.00 H new ATOM 0 HG2 MET A 1 -16.255 -5.194 10.103 1.00 0.00 H new ATOM 0 HG3 MET A 1 -16.073 -3.547 10.672 1.00 0.00 H new ATOM 0 HE1 MET A 1 -17.182 -5.060 13.993 1.00 0.00 H new ATOM 0 HE2 MET A 1 -16.004 -5.650 12.796 1.00 0.00 H new ATOM 0 HE3 MET A 1 -16.115 -3.910 13.154 1.00 0.00 H new ATOM 18 N ALA A 2 -14.516 -2.314 7.374 1.00 0.00 N ATOM 19 CA ALA A 2 -13.414 -1.369 7.492 1.00 0.00 C ATOM 20 C ALA A 2 -12.750 -1.317 6.116 1.00 0.00 C ATOM 21 O ALA A 2 -12.106 -2.295 5.721 1.00 0.00 O ATOM 22 CB ALA A 2 -12.434 -1.859 8.571 1.00 0.00 C ATOM 0 H ALA A 2 -14.402 -2.942 6.579 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.749 -0.375 7.789 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -11.609 -1.153 8.661 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -12.953 -1.934 9.527 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -12.045 -2.838 8.292 1.00 0.00 H new ATOM 28 N HIS A 3 -12.958 -0.246 5.351 1.00 0.00 N ATOM 29 CA HIS A 3 -12.379 -0.110 4.022 1.00 0.00 C ATOM 30 C HIS A 3 -10.896 0.227 4.165 1.00 0.00 C ATOM 31 O HIS A 3 -10.461 0.844 5.145 1.00 0.00 O ATOM 32 CB HIS A 3 -13.121 0.984 3.233 1.00 0.00 C ATOM 33 CG HIS A 3 -14.535 0.577 2.904 1.00 0.00 C ATOM 34 ND1 HIS A 3 -15.695 1.079 3.458 1.00 0.00 N ATOM 35 CD2 HIS A 3 -14.885 -0.407 2.019 1.00 0.00 C ATOM 36 CE1 HIS A 3 -16.719 0.387 2.926 1.00 0.00 C ATOM 37 NE2 HIS A 3 -16.274 -0.529 2.046 1.00 0.00 N ATOM 0 H HIS A 3 -13.531 0.548 5.637 1.00 0.00 H new ATOM 0 HA HIS A 3 -12.481 -1.045 3.471 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -13.134 1.906 3.815 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -12.580 1.197 2.311 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -14.207 -0.985 1.409 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -17.759 0.545 3.172 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -16.840 -1.183 1.506 1.00 0.00 H new ATOM 45 N ILE A 4 -10.101 -0.161 3.173 1.00 0.00 N ATOM 46 CA ILE A 4 -8.682 0.170 3.121 1.00 0.00 C ATOM 47 C ILE A 4 -8.357 0.735 1.746 1.00 0.00 C ATOM 48 O ILE A 4 -9.241 0.930 0.900 1.00 0.00 O ATOM 49 CB ILE A 4 -7.793 -1.031 3.527 1.00 0.00 C ATOM 50 CG1 ILE A 4 -7.880 -2.201 2.524 1.00 0.00 C ATOM 51 CG2 ILE A 4 -8.142 -1.474 4.956 1.00 0.00 C ATOM 52 CD1 ILE A 4 -6.735 -3.205 2.700 1.00 0.00 C ATOM 0 H ILE A 4 -10.424 -0.716 2.380 1.00 0.00 H new ATOM 0 HA ILE A 4 -8.456 0.939 3.859 1.00 0.00 H new ATOM 0 HB ILE A 4 -6.754 -0.703 3.505 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -8.833 -2.715 2.650 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -7.862 -1.807 1.508 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -7.514 -2.319 5.238 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -7.969 -0.648 5.646 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -9.190 -1.770 4.999 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -6.841 -4.009 1.972 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.781 -2.700 2.547 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.767 -3.621 3.707 1.00 0.00 H new ATOM 64 N PHE A 5 -7.083 1.026 1.543 1.00 0.00 N ATOM 65 CA PHE A 5 -6.514 1.358 0.253 1.00 0.00 C ATOM 66 C PHE A 5 -5.283 0.473 0.033 1.00 0.00 C ATOM 67 O PHE A 5 -4.816 -0.168 0.978 1.00 0.00 O ATOM 68 CB PHE A 5 -6.197 2.849 0.303 1.00 0.00 C ATOM 69 CG PHE A 5 -5.526 3.400 -0.929 1.00 0.00 C ATOM 70 CD1 PHE A 5 -6.219 3.415 -2.146 1.00 0.00 C ATOM 71 CD2 PHE A 5 -4.217 3.901 -0.854 1.00 0.00 C ATOM 72 CE1 PHE A 5 -5.609 3.942 -3.293 1.00 0.00 C ATOM 73 CE2 PHE A 5 -3.601 4.423 -2.004 1.00 0.00 C ATOM 74 CZ PHE A 5 -4.303 4.459 -3.219 1.00 0.00 C ATOM 0 H PHE A 5 -6.397 1.037 2.297 1.00 0.00 H new ATOM 0 HA PHE A 5 -7.182 1.174 -0.589 1.00 0.00 H new ATOM 0 HB2 PHE A 5 -7.125 3.397 0.469 1.00 0.00 H new ATOM 0 HB3 PHE A 5 -5.556 3.040 1.164 1.00 0.00 H new ATOM 0 HD1 PHE A 5 -7.223 3.021 -2.201 1.00 0.00 H new ATOM 0 HD2 PHE A 5 -3.684 3.885 0.085 1.00 0.00 H new ATOM 0 HE1 PHE A 5 -6.141 3.951 -4.233 1.00 0.00 H new ATOM 0 HE2 PHE A 5 -2.589 4.796 -1.953 1.00 0.00 H new ATOM 0 HZ PHE A 5 -3.840 4.884 -4.097 1.00 0.00 H new ATOM 84 N VAL A 6 -4.753 0.430 -1.190 1.00 0.00 N ATOM 85 CA VAL A 6 -3.554 -0.327 -1.514 1.00 0.00 C ATOM 86 C VAL A 6 -2.532 0.610 -2.156 1.00 0.00 C ATOM 87 O VAL A 6 -2.850 1.337 -3.096 1.00 0.00 O ATOM 88 CB VAL A 6 -3.907 -1.573 -2.355 1.00 0.00 C ATOM 89 CG1 VAL A 6 -4.214 -1.301 -3.833 1.00 0.00 C ATOM 90 CG2 VAL A 6 -2.773 -2.593 -2.284 1.00 0.00 C ATOM 0 H VAL A 6 -5.151 0.926 -1.987 1.00 0.00 H new ATOM 0 HA VAL A 6 -3.087 -0.724 -0.612 1.00 0.00 H new ATOM 0 HB VAL A 6 -4.828 -1.951 -1.910 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -4.449 -2.240 -4.334 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -5.066 -0.625 -3.909 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -3.345 -0.844 -4.307 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -3.032 -3.468 -2.881 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -1.858 -2.147 -2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -2.618 -2.894 -1.248 1.00 0.00 H new ATOM 100 N TYR A 7 -1.295 0.570 -1.665 1.00 0.00 N ATOM 101 CA TYR A 7 -0.153 1.292 -2.212 1.00 0.00 C ATOM 102 C TYR A 7 0.236 0.724 -3.573 1.00 0.00 C ATOM 103 O TYR A 7 0.597 1.478 -4.479 1.00 0.00 O ATOM 104 CB TYR A 7 1.044 1.245 -1.244 1.00 0.00 C ATOM 105 CG TYR A 7 1.260 -0.073 -0.504 1.00 0.00 C ATOM 106 CD1 TYR A 7 0.396 -0.486 0.537 1.00 0.00 C ATOM 107 CD2 TYR A 7 2.333 -0.899 -0.871 1.00 0.00 C ATOM 108 CE1 TYR A 7 0.539 -1.757 1.120 1.00 0.00 C ATOM 109 CE2 TYR A 7 2.536 -2.125 -0.232 1.00 0.00 C ATOM 110 CZ TYR A 7 1.604 -2.588 0.715 1.00 0.00 C ATOM 111 OH TYR A 7 1.668 -3.894 1.073 1.00 0.00 O ATOM 0 H TYR A 7 -1.054 0.013 -0.845 1.00 0.00 H new ATOM 0 HA TYR A 7 -0.442 2.335 -2.341 1.00 0.00 H new ATOM 0 HB2 TYR A 7 1.949 1.475 -1.807 1.00 0.00 H new ATOM 0 HB3 TYR A 7 0.919 2.036 -0.505 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -0.379 0.180 0.886 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.008 -0.585 -1.654 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.160 -2.094 1.871 1.00 0.00 H new ATOM 0 HE2 TYR A 7 3.408 -2.717 -0.465 1.00 0.00 H new ATOM 0 HH TYR A 7 1.105 -4.045 1.861 1.00 0.00 H new ATOM 121 N GLY A 8 0.133 -0.598 -3.757 1.00 0.00 N ATOM 122 CA GLY A 8 0.313 -1.189 -5.072 1.00 0.00 C ATOM 123 C GLY A 8 0.931 -2.570 -5.111 1.00 0.00 C ATOM 124 O GLY A 8 1.605 -2.844 -6.095 1.00 0.00 O ATOM 0 H GLY A 8 -0.072 -1.266 -3.014 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -0.660 -1.236 -5.561 1.00 0.00 H new ATOM 0 HA3 GLY A 8 0.936 -0.519 -5.665 1.00 0.00 H new ATOM 128 N THR A 9 0.759 -3.409 -4.093 1.00 0.00 N ATOM 129 CA THR A 9 1.279 -4.774 -4.023 1.00 0.00 C ATOM 130 C THR A 9 0.180 -5.774 -4.375 1.00 0.00 C ATOM 131 O THR A 9 0.465 -6.867 -4.863 1.00 0.00 O ATOM 132 CB THR A 9 1.780 -5.005 -2.591 1.00 0.00 C ATOM 133 OG1 THR A 9 1.046 -4.196 -1.691 1.00 0.00 O ATOM 134 CG2 THR A 9 3.250 -4.637 -2.538 1.00 0.00 C ATOM 0 H THR A 9 0.232 -3.147 -3.260 1.00 0.00 H new ATOM 0 HA THR A 9 2.093 -4.913 -4.735 1.00 0.00 H new ATOM 0 HB THR A 9 1.645 -6.049 -2.307 1.00 0.00 H new ATOM 0 HG1 THR A 9 1.632 -3.903 -0.962 1.00 0.00 H new ATOM 0 HG21 THR A 9 3.628 -4.794 -1.528 1.00 0.00 H new ATOM 0 HG22 THR A 9 3.807 -5.263 -3.235 1.00 0.00 H new ATOM 0 HG23 THR A 9 3.373 -3.589 -2.813 1.00 0.00 H new ATOM 142 N LEU A 10 -1.077 -5.408 -4.136 1.00 0.00 N ATOM 143 CA LEU A 10 -2.239 -6.233 -4.380 1.00 0.00 C ATOM 144 C LEU A 10 -3.093 -5.554 -5.460 1.00 0.00 C ATOM 145 O LEU A 10 -4.297 -5.424 -5.282 1.00 0.00 O ATOM 146 CB LEU A 10 -3.037 -6.460 -3.078 1.00 0.00 C ATOM 147 CG LEU A 10 -2.361 -6.916 -1.771 1.00 0.00 C ATOM 148 CD1 LEU A 10 -1.648 -8.255 -1.902 1.00 0.00 C ATOM 149 CD2 LEU A 10 -1.398 -5.949 -1.096 1.00 0.00 C ATOM 0 H LEU A 10 -1.314 -4.493 -3.753 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.932 -7.218 -4.731 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -3.548 -5.523 -2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.807 -7.197 -3.307 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.235 -6.984 -1.123 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.193 -8.520 -0.948 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.367 -9.023 -2.187 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -0.873 -8.182 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.000 -6.405 -0.189 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -0.578 -5.718 -1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.925 -5.030 -0.839 1.00 0.00 H new ATOM 161 N LYS A 11 -2.487 -5.015 -6.533 1.00 0.00 N ATOM 162 CA LYS A 11 -3.240 -4.328 -7.588 1.00 0.00 C ATOM 163 C LYS A 11 -2.771 -4.801 -8.961 1.00 0.00 C ATOM 164 O LYS A 11 -3.345 -5.760 -9.471 1.00 0.00 O ATOM 165 CB LYS A 11 -3.135 -2.803 -7.372 1.00 0.00 C ATOM 166 CG LYS A 11 -3.825 -1.959 -8.456 1.00 0.00 C ATOM 167 CD LYS A 11 -3.516 -0.467 -8.275 1.00 0.00 C ATOM 168 CE LYS A 11 -3.957 0.380 -9.480 1.00 0.00 C ATOM 169 NZ LYS A 11 -5.412 0.617 -9.535 1.00 0.00 N ATOM 0 H LYS A 11 -1.479 -5.044 -6.689 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.300 -4.578 -7.540 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -3.570 -2.555 -6.404 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -2.082 -2.526 -7.329 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -3.493 -2.285 -9.442 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.903 -2.118 -8.414 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -4.016 -0.103 -7.377 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -2.445 -0.338 -8.118 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.442 1.340 -9.446 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -3.644 -0.118 -10.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.667 0.996 -10.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.916 -0.279 -9.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.680 1.301 -8.799 1.00 0.00 H new ATOM 183 N ARG A 12 -1.723 -4.195 -9.532 1.00 0.00 N ATOM 184 CA ARG A 12 -1.419 -4.335 -10.958 1.00 0.00 C ATOM 185 C ARG A 12 -1.092 -5.789 -11.324 1.00 0.00 C ATOM 186 O ARG A 12 -1.824 -6.400 -12.109 1.00 0.00 O ATOM 187 CB ARG A 12 -0.355 -3.310 -11.411 1.00 0.00 C ATOM 188 CG ARG A 12 -0.871 -2.205 -12.352 1.00 0.00 C ATOM 189 CD ARG A 12 -1.588 -1.058 -11.621 1.00 0.00 C ATOM 190 NE ARG A 12 -1.052 0.256 -12.025 1.00 0.00 N ATOM 191 CZ ARG A 12 0.014 0.878 -11.488 1.00 0.00 C ATOM 192 NH1 ARG A 12 0.532 0.502 -10.325 1.00 0.00 N ATOM 193 NH2 ARG A 12 0.563 1.909 -12.113 1.00 0.00 N ATOM 0 H ARG A 12 -1.069 -3.600 -9.023 1.00 0.00 H new ATOM 0 HA ARG A 12 -2.315 -4.091 -11.529 1.00 0.00 H new ATOM 0 HB2 ARG A 12 0.075 -2.841 -10.526 1.00 0.00 H new ATOM 0 HB3 ARG A 12 0.452 -3.845 -11.912 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -0.031 -1.797 -12.914 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -1.555 -2.647 -13.076 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -2.656 -1.099 -11.836 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -1.475 -1.184 -10.544 1.00 0.00 H new ATOM 0 HE ARG A 12 -1.535 0.739 -12.783 1.00 0.00 H new ATOM 0 HH11 ARG A 12 0.122 -0.278 -9.812 1.00 0.00 H new ATOM 0 HH12 ARG A 12 1.341 0.994 -9.944 1.00 0.00 H new ATOM 0 HH21 ARG A 12 0.178 2.231 -13.001 1.00 0.00 H new ATOM 0 HH22 ARG A 12 1.371 2.381 -11.706 1.00 0.00 H new ATOM 207 N GLY A 13 -0.011 -6.344 -10.773 1.00 0.00 N ATOM 208 CA GLY A 13 0.463 -7.678 -11.128 1.00 0.00 C ATOM 209 C GLY A 13 1.820 -7.965 -10.496 1.00 0.00 C ATOM 210 O GLY A 13 2.685 -8.572 -11.118 1.00 0.00 O ATOM 0 H GLY A 13 0.560 -5.878 -10.067 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -0.260 -8.424 -10.798 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.538 -7.764 -12.212 1.00 0.00 H new ATOM 214 N GLN A 14 2.029 -7.482 -9.273 1.00 0.00 N ATOM 215 CA GLN A 14 3.297 -7.546 -8.554 1.00 0.00 C ATOM 216 C GLN A 14 3.225 -8.668 -7.511 1.00 0.00 C ATOM 217 O GLN A 14 2.115 -9.043 -7.123 1.00 0.00 O ATOM 218 CB GLN A 14 3.634 -6.167 -7.964 1.00 0.00 C ATOM 219 CG GLN A 14 2.538 -5.572 -7.112 1.00 0.00 C ATOM 220 CD GLN A 14 1.359 -5.000 -7.897 1.00 0.00 C ATOM 221 OE1 GLN A 14 0.203 -5.247 -7.577 1.00 0.00 O ATOM 222 NE2 GLN A 14 1.614 -4.261 -8.962 1.00 0.00 N ATOM 0 H GLN A 14 1.294 -7.020 -8.738 1.00 0.00 H new ATOM 0 HA GLN A 14 4.118 -7.793 -9.227 1.00 0.00 H new ATOM 0 HB2 GLN A 14 4.539 -6.253 -7.363 1.00 0.00 H new ATOM 0 HB3 GLN A 14 3.857 -5.480 -8.780 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.167 -6.340 -6.433 1.00 0.00 H new ATOM 0 HG3 GLN A 14 2.965 -4.781 -6.496 1.00 0.00 H new ATOM 0 HE21 GLN A 14 2.579 -4.059 -9.223 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.846 -3.893 -9.523 1.00 0.00 H new ATOM 231 N PRO A 15 4.360 -9.178 -6.993 1.00 0.00 N ATOM 232 CA PRO A 15 4.451 -10.525 -6.437 1.00 0.00 C ATOM 233 C PRO A 15 4.023 -10.541 -4.966 1.00 0.00 C ATOM 234 O PRO A 15 4.774 -10.907 -4.056 1.00 0.00 O ATOM 235 CB PRO A 15 5.934 -10.882 -6.611 1.00 0.00 C ATOM 236 CG PRO A 15 6.648 -9.548 -6.432 1.00 0.00 C ATOM 237 CD PRO A 15 5.657 -8.525 -6.977 1.00 0.00 C ATOM 0 HA PRO A 15 3.793 -11.242 -6.928 1.00 0.00 H new ATOM 0 HB2 PRO A 15 6.260 -11.613 -5.871 1.00 0.00 H new ATOM 0 HB3 PRO A 15 6.130 -11.313 -7.593 1.00 0.00 H new ATOM 0 HG2 PRO A 15 6.883 -9.358 -5.385 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.590 -9.523 -6.980 1.00 0.00 H new ATOM 0 HD2 PRO A 15 5.635 -7.633 -6.350 1.00 0.00 H new ATOM 0 HD3 PRO A 15 5.942 -8.204 -7.979 1.00 0.00 H new ATOM 245 N ASN A 16 2.762 -10.190 -4.737 1.00 0.00 N ATOM 246 CA ASN A 16 2.114 -10.145 -3.440 1.00 0.00 C ATOM 247 C ASN A 16 0.627 -10.413 -3.615 1.00 0.00 C ATOM 248 O ASN A 16 0.040 -10.976 -2.701 1.00 0.00 O ATOM 249 CB ASN A 16 2.284 -8.773 -2.765 1.00 0.00 C ATOM 250 CG ASN A 16 3.682 -8.188 -2.891 1.00 0.00 C ATOM 251 OD1 ASN A 16 3.976 -7.549 -4.017 1.00 0.00 O flip ATOM 252 ND2 ASN A 16 4.512 -8.324 -2.001 1.00 0.00 N flip ATOM 0 H ASN A 16 2.135 -9.916 -5.494 1.00 0.00 H new ATOM 0 HA ASN A 16 2.579 -10.902 -2.809 1.00 0.00 H new ATOM 0 HB2 ASN A 16 1.569 -8.075 -3.200 1.00 0.00 H new ATOM 0 HB3 ASN A 16 2.035 -8.867 -1.708 1.00 0.00 H new ATOM 0 HD21 ASN A 16 4.264 -8.819 -1.144 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.451 -7.943 -2.117 1.00 0.00 H new ATOM 259 N HIS A 17 0.027 -10.050 -4.765 1.00 0.00 N ATOM 260 CA HIS A 17 -1.418 -10.093 -5.023 1.00 0.00 C ATOM 261 C HIS A 17 -2.024 -11.441 -4.612 1.00 0.00 C ATOM 262 O HIS A 17 -3.125 -11.482 -4.065 1.00 0.00 O ATOM 263 CB HIS A 17 -1.682 -9.736 -6.504 1.00 0.00 C ATOM 264 CG HIS A 17 -3.084 -9.258 -6.838 1.00 0.00 C ATOM 265 ND1 HIS A 17 -3.409 -8.131 -7.567 1.00 0.00 N ATOM 266 CD2 HIS A 17 -4.263 -9.892 -6.551 1.00 0.00 C ATOM 267 CE1 HIS A 17 -4.747 -8.074 -7.673 1.00 0.00 C ATOM 268 NE2 HIS A 17 -5.312 -9.148 -7.097 1.00 0.00 N ATOM 0 H HIS A 17 0.558 -9.707 -5.566 1.00 0.00 H new ATOM 0 HA HIS A 17 -1.921 -9.349 -4.405 1.00 0.00 H new ATOM 0 HB2 HIS A 17 -0.976 -8.961 -6.801 1.00 0.00 H new ATOM 0 HB3 HIS A 17 -1.465 -10.614 -7.112 1.00 0.00 H new ATOM 0 HD1 HIS A 17 -2.748 -7.459 -7.957 1.00 0.00 H new ATOM 0 HD2 HIS A 17 -4.365 -10.813 -5.996 1.00 0.00 H new ATOM 0 HE1 HIS A 17 -5.292 -7.276 -8.154 1.00 0.00 H new ATOM 276 N LYS A 18 -1.267 -12.530 -4.773 1.00 0.00 N ATOM 277 CA LYS A 18 -1.611 -13.879 -4.338 1.00 0.00 C ATOM 278 C LYS A 18 -2.196 -13.981 -2.930 1.00 0.00 C ATOM 279 O LYS A 18 -3.089 -14.799 -2.737 1.00 0.00 O ATOM 280 CB LYS A 18 -0.408 -14.812 -4.570 1.00 0.00 C ATOM 281 CG LYS A 18 0.856 -14.479 -3.755 1.00 0.00 C ATOM 282 CD LYS A 18 0.899 -15.220 -2.416 1.00 0.00 C ATOM 283 CE LYS A 18 2.161 -14.824 -1.637 1.00 0.00 C ATOM 284 NZ LYS A 18 2.442 -15.737 -0.514 1.00 0.00 N ATOM 0 H LYS A 18 -0.357 -12.489 -5.232 1.00 0.00 H new ATOM 0 HA LYS A 18 -2.444 -14.210 -4.958 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -0.711 -15.832 -4.336 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.152 -14.790 -5.629 1.00 0.00 H new ATOM 0 HG2 LYS A 18 1.740 -14.737 -4.339 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.896 -13.405 -3.574 1.00 0.00 H new ATOM 0 HD2 LYS A 18 0.011 -14.982 -1.831 1.00 0.00 H new ATOM 0 HD3 LYS A 18 0.890 -16.297 -2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.014 -14.814 -2.315 1.00 0.00 H new ATOM 0 HE3 LYS A 18 2.045 -13.809 -1.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 3.303 -15.426 -0.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 1.641 -15.728 0.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 2.580 -16.702 -0.877 1.00 0.00 H new ATOM 298 N VAL A 19 -1.773 -13.158 -1.965 1.00 0.00 N ATOM 299 CA VAL A 19 -2.289 -13.269 -0.604 1.00 0.00 C ATOM 300 C VAL A 19 -3.794 -12.998 -0.570 1.00 0.00 C ATOM 301 O VAL A 19 -4.509 -13.652 0.187 1.00 0.00 O ATOM 302 CB VAL A 19 -1.512 -12.362 0.371 1.00 0.00 C ATOM 303 CG1 VAL A 19 -0.021 -12.731 0.404 1.00 0.00 C ATOM 304 CG2 VAL A 19 -1.702 -10.876 0.095 1.00 0.00 C ATOM 0 H VAL A 19 -1.084 -12.418 -2.101 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.135 -14.294 -0.266 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.938 -12.545 1.358 1.00 0.00 H new ATOM 0 HG11 VAL A 19 0.501 -12.074 1.100 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.091 -13.766 0.728 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.405 -12.615 -0.593 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -1.128 -10.295 0.817 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -1.356 -10.646 -0.913 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -2.758 -10.622 0.183 1.00 0.00 H new ATOM 314 N MET A 20 -4.295 -12.083 -1.405 1.00 0.00 N ATOM 315 CA MET A 20 -5.714 -11.760 -1.464 1.00 0.00 C ATOM 316 C MET A 20 -6.438 -12.563 -2.548 1.00 0.00 C ATOM 317 O MET A 20 -7.585 -12.262 -2.870 1.00 0.00 O ATOM 318 CB MET A 20 -5.928 -10.255 -1.616 1.00 0.00 C ATOM 319 CG MET A 20 -5.439 -9.705 -2.954 1.00 0.00 C ATOM 320 SD MET A 20 -6.358 -8.262 -3.571 1.00 0.00 S ATOM 321 CE MET A 20 -6.364 -7.175 -2.118 1.00 0.00 C ATOM 0 H MET A 20 -3.723 -11.547 -2.058 1.00 0.00 H new ATOM 0 HA MET A 20 -6.161 -12.056 -0.515 1.00 0.00 H new ATOM 0 HB2 MET A 20 -6.990 -10.034 -1.507 1.00 0.00 H new ATOM 0 HB3 MET A 20 -5.410 -9.738 -0.808 1.00 0.00 H new ATOM 0 HG2 MET A 20 -4.388 -9.433 -2.856 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.495 -10.499 -3.699 1.00 0.00 H new ATOM 0 HE1 MET A 20 -7.367 -6.775 -1.967 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.064 -7.743 -1.237 1.00 0.00 H new ATOM 0 HE3 MET A 20 -5.665 -6.353 -2.275 1.00 0.00 H new ATOM 331 N LEU A 21 -5.774 -13.552 -3.149 1.00 0.00 N ATOM 332 CA LEU A 21 -6.391 -14.537 -4.032 1.00 0.00 C ATOM 333 C LEU A 21 -6.608 -15.830 -3.246 1.00 0.00 C ATOM 334 O LEU A 21 -6.699 -16.912 -3.827 1.00 0.00 O ATOM 335 CB LEU A 21 -5.520 -14.764 -5.285 1.00 0.00 C ATOM 336 CG LEU A 21 -5.368 -13.501 -6.149 1.00 0.00 C ATOM 337 CD1 LEU A 21 -4.262 -13.667 -7.194 1.00 0.00 C ATOM 338 CD2 LEU A 21 -6.666 -13.129 -6.867 1.00 0.00 C ATOM 0 H LEU A 21 -4.770 -13.691 -3.031 1.00 0.00 H new ATOM 0 HA LEU A 21 -7.357 -14.173 -4.383 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -4.533 -15.107 -4.977 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -5.960 -15.559 -5.887 1.00 0.00 H new ATOM 0 HG LEU A 21 -5.105 -12.699 -5.459 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -4.182 -12.756 -7.787 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -3.313 -13.858 -6.692 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -4.502 -14.505 -7.848 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -6.507 -12.231 -7.464 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -6.969 -13.949 -7.518 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -7.448 -12.942 -6.131 1.00 0.00 H new ATOM 350 N ASP A 22 -6.650 -15.751 -1.919 1.00 0.00 N ATOM 351 CA ASP A 22 -6.985 -16.855 -1.043 1.00 0.00 C ATOM 352 C ASP A 22 -7.890 -16.300 0.046 1.00 0.00 C ATOM 353 O ASP A 22 -7.422 -15.654 0.984 1.00 0.00 O ATOM 354 CB ASP A 22 -5.712 -17.480 -0.470 1.00 0.00 C ATOM 355 CG ASP A 22 -5.990 -18.801 0.242 1.00 0.00 C ATOM 356 OD1 ASP A 22 -7.124 -19.009 0.732 1.00 0.00 O ATOM 357 OD2 ASP A 22 -5.081 -19.662 0.220 1.00 0.00 O ATOM 0 H ASP A 22 -6.445 -14.889 -1.415 1.00 0.00 H new ATOM 0 HA ASP A 22 -7.503 -17.649 -1.580 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -4.996 -17.647 -1.275 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -5.249 -16.783 0.228 1.00 0.00 H new ATOM 362 N HIS A 23 -9.196 -16.503 -0.102 1.00 0.00 N ATOM 363 CA HIS A 23 -10.215 -16.033 0.829 1.00 0.00 C ATOM 364 C HIS A 23 -10.018 -16.573 2.262 1.00 0.00 C ATOM 365 O HIS A 23 -10.562 -16.026 3.224 1.00 0.00 O ATOM 366 CB HIS A 23 -11.578 -16.428 0.260 1.00 0.00 C ATOM 367 CG HIS A 23 -12.716 -15.915 1.081 1.00 0.00 C ATOM 368 ND1 HIS A 23 -13.611 -16.662 1.804 1.00 0.00 N ATOM 369 CD2 HIS A 23 -13.011 -14.599 1.264 1.00 0.00 C ATOM 370 CE1 HIS A 23 -14.469 -15.812 2.381 1.00 0.00 C ATOM 371 NE2 HIS A 23 -14.137 -14.538 2.094 1.00 0.00 N ATOM 0 H HIS A 23 -9.585 -17.013 -0.895 1.00 0.00 H new ATOM 0 HA HIS A 23 -10.139 -14.950 0.925 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.667 -16.045 -0.757 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -11.640 -17.514 0.198 1.00 0.00 H new ATOM 0 HD1 HIS A 23 -13.621 -17.679 1.887 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -12.476 -13.759 0.847 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.310 -16.106 2.991 1.00 0.00 H new ATOM 379 N SER A 24 -9.216 -17.626 2.428 1.00 0.00 N ATOM 380 CA SER A 24 -8.796 -18.177 3.721 1.00 0.00 C ATOM 381 C SER A 24 -7.813 -17.248 4.453 1.00 0.00 C ATOM 382 O SER A 24 -7.707 -17.318 5.679 1.00 0.00 O ATOM 383 CB SER A 24 -8.171 -19.568 3.507 1.00 0.00 C ATOM 384 OG SER A 24 -8.505 -20.461 4.561 1.00 0.00 O ATOM 0 H SER A 24 -8.826 -18.139 1.637 1.00 0.00 H new ATOM 0 HA SER A 24 -9.679 -18.266 4.354 1.00 0.00 H new ATOM 0 HB2 SER A 24 -8.515 -19.980 2.558 1.00 0.00 H new ATOM 0 HB3 SER A 24 -7.087 -19.474 3.439 1.00 0.00 H new ATOM 0 HG SER A 24 -8.094 -21.334 4.392 1.00 0.00 H new ATOM 390 N HIS A 25 -7.116 -16.356 3.741 1.00 0.00 N ATOM 391 CA HIS A 25 -6.399 -15.246 4.362 1.00 0.00 C ATOM 392 C HIS A 25 -7.341 -14.076 4.670 1.00 0.00 C ATOM 393 O HIS A 25 -6.920 -13.113 5.301 1.00 0.00 O ATOM 394 CB HIS A 25 -5.285 -14.757 3.436 1.00 0.00 C ATOM 395 CG HIS A 25 -4.237 -15.769 3.042 1.00 0.00 C ATOM 396 ND1 HIS A 25 -3.605 -15.782 1.824 1.00 0.00 N ATOM 397 CD2 HIS A 25 -3.689 -16.774 3.797 1.00 0.00 C ATOM 398 CE1 HIS A 25 -2.712 -16.787 1.829 1.00 0.00 C ATOM 399 NE2 HIS A 25 -2.720 -17.420 3.014 1.00 0.00 N ATOM 0 H HIS A 25 -7.035 -16.386 2.725 1.00 0.00 H new ATOM 0 HA HIS A 25 -5.974 -15.610 5.298 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -5.744 -14.371 2.526 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -4.784 -13.919 3.920 1.00 0.00 H new ATOM 0 HD1 HIS A 25 -3.782 -15.141 1.050 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -3.956 -17.024 4.813 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -2.076 -17.049 0.996 1.00 0.00 H new ATOM 407 N GLY A 26 -8.601 -14.129 4.232 1.00 0.00 N ATOM 408 CA GLY A 26 -9.616 -13.119 4.464 1.00 0.00 C ATOM 409 C GLY A 26 -10.184 -12.565 3.165 1.00 0.00 C ATOM 410 O GLY A 26 -9.720 -12.875 2.073 1.00 0.00 O ATOM 0 H GLY A 26 -8.949 -14.915 3.683 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -10.423 -13.548 5.058 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -9.188 -12.304 5.048 1.00 0.00 H new ATOM 414 N LEU A 27 -11.229 -11.754 3.299 1.00 0.00 N ATOM 415 CA LEU A 27 -11.974 -11.168 2.196 1.00 0.00 C ATOM 416 C LEU A 27 -11.212 -9.989 1.606 1.00 0.00 C ATOM 417 O LEU A 27 -10.749 -9.132 2.363 1.00 0.00 O ATOM 418 CB LEU A 27 -13.327 -10.730 2.770 1.00 0.00 C ATOM 419 CG LEU A 27 -14.441 -10.292 1.812 1.00 0.00 C ATOM 420 CD1 LEU A 27 -14.246 -8.879 1.273 1.00 0.00 C ATOM 421 CD2 LEU A 27 -14.625 -11.257 0.647 1.00 0.00 C ATOM 0 H LEU A 27 -11.591 -11.479 4.212 1.00 0.00 H new ATOM 0 HA LEU A 27 -12.116 -11.883 1.385 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -13.713 -11.557 3.366 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -13.140 -9.903 3.455 1.00 0.00 H new ATOM 0 HG LEU A 27 -15.346 -10.302 2.420 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -15.067 -8.629 0.601 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -14.228 -8.172 2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.303 -8.824 0.729 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -15.426 -10.898 0.001 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -13.698 -11.319 0.076 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -14.882 -12.245 1.030 1.00 0.00 H new ATOM 433 N ALA A 28 -11.154 -9.912 0.275 1.00 0.00 N ATOM 434 CA ALA A 28 -10.796 -8.707 -0.467 1.00 0.00 C ATOM 435 C ALA A 28 -11.655 -8.594 -1.727 1.00 0.00 C ATOM 436 O ALA A 28 -11.435 -9.337 -2.686 1.00 0.00 O ATOM 437 CB ALA A 28 -9.322 -8.734 -0.859 1.00 0.00 C ATOM 0 H ALA A 28 -11.360 -10.707 -0.330 1.00 0.00 H new ATOM 0 HA ALA A 28 -10.975 -7.844 0.175 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -9.076 -7.827 -1.411 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.708 -8.790 0.040 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -9.128 -9.604 -1.486 1.00 0.00 H new ATOM 443 N ALA A 29 -12.593 -7.648 -1.766 1.00 0.00 N ATOM 444 CA ALA A 29 -13.470 -7.420 -2.908 1.00 0.00 C ATOM 445 C ALA A 29 -13.253 -6.006 -3.436 1.00 0.00 C ATOM 446 O ALA A 29 -13.032 -5.071 -2.664 1.00 0.00 O ATOM 447 CB ALA A 29 -14.924 -7.669 -2.511 1.00 0.00 C ATOM 0 H ALA A 29 -12.766 -7.009 -0.990 1.00 0.00 H new ATOM 0 HA ALA A 29 -13.231 -8.119 -3.709 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -15.571 -7.496 -3.371 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.038 -8.699 -2.173 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -15.203 -6.990 -1.705 1.00 0.00 H new ATOM 453 N PHE A 30 -13.280 -5.860 -4.759 1.00 0.00 N ATOM 454 CA PHE A 30 -13.072 -4.605 -5.461 1.00 0.00 C ATOM 455 C PHE A 30 -14.199 -3.631 -5.121 1.00 0.00 C ATOM 456 O PHE A 30 -15.345 -3.812 -5.546 1.00 0.00 O ATOM 457 CB PHE A 30 -12.974 -4.871 -6.968 1.00 0.00 C ATOM 458 CG PHE A 30 -12.807 -3.623 -7.811 1.00 0.00 C ATOM 459 CD1 PHE A 30 -11.581 -2.928 -7.816 1.00 0.00 C ATOM 460 CD2 PHE A 30 -13.879 -3.153 -8.591 1.00 0.00 C ATOM 461 CE1 PHE A 30 -11.427 -1.775 -8.606 1.00 0.00 C ATOM 462 CE2 PHE A 30 -13.723 -2.004 -9.385 1.00 0.00 C ATOM 463 CZ PHE A 30 -12.497 -1.322 -9.395 1.00 0.00 C ATOM 0 H PHE A 30 -13.454 -6.643 -5.390 1.00 0.00 H new ATOM 0 HA PHE A 30 -12.135 -4.147 -5.143 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -12.131 -5.536 -7.154 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -13.872 -5.397 -7.292 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -10.758 -3.282 -7.212 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -14.824 -3.676 -8.580 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -10.489 -1.240 -8.606 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -14.546 -1.647 -9.987 1.00 0.00 H new ATOM 0 HZ PHE A 30 -12.375 -0.444 -10.012 1.00 0.00 H new ATOM 473 N ARG A 31 -13.860 -2.578 -4.376 1.00 0.00 N ATOM 474 CA ARG A 31 -14.769 -1.530 -3.937 1.00 0.00 C ATOM 475 C ARG A 31 -14.280 -0.214 -4.542 1.00 0.00 C ATOM 476 O ARG A 31 -14.111 0.784 -3.849 1.00 0.00 O ATOM 477 CB ARG A 31 -14.857 -1.576 -2.396 1.00 0.00 C ATOM 478 CG ARG A 31 -15.866 -0.619 -1.739 1.00 0.00 C ATOM 479 CD ARG A 31 -17.317 -0.913 -2.107 1.00 0.00 C ATOM 480 NE ARG A 31 -17.860 -2.081 -1.403 1.00 0.00 N ATOM 481 CZ ARG A 31 -19.054 -2.627 -1.646 1.00 0.00 C ATOM 482 NH1 ARG A 31 -19.863 -2.118 -2.559 1.00 0.00 N ATOM 483 NH2 ARG A 31 -19.447 -3.692 -0.968 1.00 0.00 N ATOM 0 H ARG A 31 -12.904 -2.430 -4.051 1.00 0.00 H new ATOM 0 HA ARG A 31 -15.794 -1.658 -4.284 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -15.108 -2.594 -2.099 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -13.868 -1.361 -1.991 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -15.756 -0.676 -0.656 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.626 0.404 -2.030 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -17.929 -0.040 -1.878 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -17.387 -1.078 -3.182 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.284 -2.506 -0.676 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -19.579 -1.295 -3.091 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -20.772 -2.548 -2.732 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -18.838 -4.098 -0.258 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -20.360 -4.108 -1.155 1.00 0.00 H new ATOM 497 N GLY A 32 -14.059 -0.212 -5.854 1.00 0.00 N ATOM 498 CA GLY A 32 -13.678 0.980 -6.580 1.00 0.00 C ATOM 499 C GLY A 32 -12.177 1.258 -6.508 1.00 0.00 C ATOM 500 O GLY A 32 -11.353 0.394 -6.194 1.00 0.00 O ATOM 0 H GLY A 32 -14.141 -1.044 -6.439 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -13.975 0.876 -7.624 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -14.222 1.835 -6.178 1.00 0.00 H new ATOM 504 N ARG A 33 -11.792 2.468 -6.912 1.00 0.00 N ATOM 505 CA ARG A 33 -10.403 2.832 -7.232 1.00 0.00 C ATOM 506 C ARG A 33 -10.008 4.057 -6.432 1.00 0.00 C ATOM 507 O ARG A 33 -10.880 4.785 -5.968 1.00 0.00 O ATOM 508 CB ARG A 33 -10.255 3.111 -8.734 1.00 0.00 C ATOM 509 CG ARG A 33 -10.578 1.877 -9.589 1.00 0.00 C ATOM 510 CD ARG A 33 -11.041 2.289 -10.982 1.00 0.00 C ATOM 511 NE ARG A 33 -9.959 2.690 -11.890 1.00 0.00 N ATOM 512 CZ ARG A 33 -9.541 1.972 -12.937 1.00 0.00 C ATOM 513 NH1 ARG A 33 -10.009 0.749 -13.169 1.00 0.00 N ATOM 514 NH2 ARG A 33 -8.633 2.465 -13.767 1.00 0.00 N ATOM 0 H ARG A 33 -12.446 3.242 -7.030 1.00 0.00 H new ATOM 0 HA ARG A 33 -9.747 2.002 -6.971 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -10.917 3.930 -9.016 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -9.236 3.438 -8.942 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -9.695 1.242 -9.667 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -11.354 1.285 -9.103 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -11.585 1.458 -11.431 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -11.744 3.117 -10.887 1.00 0.00 H new ATOM 0 HE ARG A 33 -9.493 3.579 -11.709 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -10.702 0.340 -12.541 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -9.675 0.220 -13.974 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -8.250 3.397 -13.608 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -8.318 1.913 -14.564 1.00 0.00 H new ATOM 528 N GLY A 34 -8.711 4.358 -6.326 1.00 0.00 N ATOM 529 CA GLY A 34 -8.329 5.575 -5.634 1.00 0.00 C ATOM 530 C GLY A 34 -6.883 5.984 -5.779 1.00 0.00 C ATOM 531 O GLY A 34 -6.075 5.285 -6.399 1.00 0.00 O ATOM 0 H GLY A 34 -7.942 3.798 -6.695 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -8.956 6.389 -5.997 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -8.548 5.452 -4.573 1.00 0.00 H new ATOM 535 N CYS A 35 -6.589 7.146 -5.207 1.00 0.00 N ATOM 536 CA CYS A 35 -5.262 7.719 -5.078 1.00 0.00 C ATOM 537 C CYS A 35 -5.128 8.407 -3.721 1.00 0.00 C ATOM 538 O CYS A 35 -6.137 8.789 -3.132 1.00 0.00 O ATOM 539 CB CYS A 35 -5.026 8.704 -6.228 1.00 0.00 C ATOM 540 SG CYS A 35 -6.010 10.213 -6.132 1.00 0.00 S ATOM 0 H CYS A 35 -7.310 7.742 -4.801 1.00 0.00 H new ATOM 0 HA CYS A 35 -4.507 6.935 -5.133 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -3.970 8.974 -6.248 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -5.244 8.202 -7.171 1.00 0.00 H new ATOM 0 HG CYS A 35 -6.248 10.653 -7.332 1.00 0.00 H new ATOM 546 N THR A 36 -3.912 8.614 -3.225 1.00 0.00 N ATOM 547 CA THR A 36 -3.707 9.527 -2.113 1.00 0.00 C ATOM 548 C THR A 36 -3.696 10.950 -2.689 1.00 0.00 C ATOM 549 O THR A 36 -2.697 11.369 -3.275 1.00 0.00 O ATOM 550 CB THR A 36 -2.433 9.162 -1.331 1.00 0.00 C ATOM 551 OG1 THR A 36 -1.267 9.281 -2.117 1.00 0.00 O ATOM 552 CG2 THR A 36 -2.474 7.751 -0.738 1.00 0.00 C ATOM 0 H THR A 36 -3.064 8.166 -3.573 1.00 0.00 H new ATOM 0 HA THR A 36 -4.511 9.456 -1.381 1.00 0.00 H new ATOM 0 HB THR A 36 -2.399 9.884 -0.515 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.309 10.108 -2.641 1.00 0.00 H new ATOM 0 HG21 THR A 36 -1.547 7.556 -0.199 1.00 0.00 H new ATOM 0 HG22 THR A 36 -3.317 7.669 -0.051 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.588 7.022 -1.541 1.00 0.00 H new ATOM 560 N VAL A 37 -4.805 11.685 -2.600 1.00 0.00 N ATOM 561 CA VAL A 37 -4.828 13.097 -2.985 1.00 0.00 C ATOM 562 C VAL A 37 -3.864 13.904 -2.130 1.00 0.00 C ATOM 563 O VAL A 37 -3.196 14.812 -2.627 1.00 0.00 O ATOM 564 CB VAL A 37 -6.231 13.697 -2.860 1.00 0.00 C ATOM 565 CG1 VAL A 37 -6.964 13.459 -4.172 1.00 0.00 C ATOM 566 CG2 VAL A 37 -7.006 13.211 -1.620 1.00 0.00 C ATOM 0 H VAL A 37 -5.699 11.326 -2.265 1.00 0.00 H new ATOM 0 HA VAL A 37 -4.521 13.145 -4.030 1.00 0.00 H new ATOM 0 HB VAL A 37 -6.146 14.770 -2.687 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -7.968 13.878 -4.109 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.420 13.940 -4.985 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.029 12.388 -4.363 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -7.990 13.679 -1.600 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.120 12.128 -1.664 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -6.457 13.482 -0.718 1.00 0.00 H new ATOM 576 N GLU A 38 -3.779 13.560 -0.848 1.00 0.00 N ATOM 577 CA GLU A 38 -2.647 13.892 -0.035 1.00 0.00 C ATOM 578 C GLU A 38 -1.452 13.215 -0.682 1.00 0.00 C ATOM 579 O GLU A 38 -1.313 11.994 -0.658 1.00 0.00 O ATOM 580 CB GLU A 38 -2.880 13.442 1.411 1.00 0.00 C ATOM 581 CG GLU A 38 -3.433 14.604 2.240 1.00 0.00 C ATOM 582 CD GLU A 38 -4.877 15.042 1.984 1.00 0.00 C ATOM 583 OE1 GLU A 38 -5.716 14.282 1.474 1.00 0.00 O ATOM 584 OE2 GLU A 38 -5.156 16.228 2.292 1.00 0.00 O ATOM 0 H GLU A 38 -4.505 13.040 -0.355 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.475 14.967 0.020 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -3.578 12.605 1.432 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.945 13.088 1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -3.347 14.335 3.293 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.788 15.467 2.078 1.00 0.00 H new ATOM 591 N SER A 39 -0.619 14.023 -1.320 1.00 0.00 N ATOM 592 CA SER A 39 0.658 13.600 -1.846 1.00 0.00 C ATOM 593 C SER A 39 1.431 12.956 -0.694 1.00 0.00 C ATOM 594 O SER A 39 1.373 13.483 0.420 1.00 0.00 O ATOM 595 CB SER A 39 1.385 14.841 -2.374 1.00 0.00 C ATOM 596 OG SER A 39 0.508 15.760 -3.008 1.00 0.00 O ATOM 0 H SER A 39 -0.821 15.009 -1.487 1.00 0.00 H new ATOM 0 HA SER A 39 0.557 12.882 -2.660 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.892 15.339 -1.548 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.155 14.533 -3.081 1.00 0.00 H new ATOM 0 HG SER A 39 1.019 16.534 -3.325 1.00 0.00 H new ATOM 602 N PHE A 40 2.155 11.861 -0.938 1.00 0.00 N ATOM 603 CA PHE A 40 2.993 11.283 0.104 1.00 0.00 C ATOM 604 C PHE A 40 4.373 10.958 -0.497 1.00 0.00 C ATOM 605 O PHE A 40 4.499 10.703 -1.701 1.00 0.00 O ATOM 606 CB PHE A 40 2.340 10.002 0.622 1.00 0.00 C ATOM 607 CG PHE A 40 1.260 10.157 1.676 1.00 0.00 C ATOM 608 CD1 PHE A 40 1.576 10.468 3.007 1.00 0.00 C ATOM 609 CD2 PHE A 40 -0.078 9.908 1.327 1.00 0.00 C ATOM 610 CE1 PHE A 40 0.568 10.496 3.990 1.00 0.00 C ATOM 611 CE2 PHE A 40 -1.088 9.946 2.301 1.00 0.00 C ATOM 612 CZ PHE A 40 -0.763 10.207 3.639 1.00 0.00 C ATOM 0 H PHE A 40 2.176 11.368 -1.831 1.00 0.00 H new ATOM 0 HA PHE A 40 3.108 11.986 0.929 1.00 0.00 H new ATOM 0 HB2 PHE A 40 1.910 9.473 -0.229 1.00 0.00 H new ATOM 0 HB3 PHE A 40 3.123 9.364 1.031 1.00 0.00 H new ATOM 0 HD1 PHE A 40 2.598 10.687 3.279 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -0.331 9.686 0.301 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.817 10.739 5.012 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -2.116 9.774 2.019 1.00 0.00 H new ATOM 0 HZ PHE A 40 -1.531 10.186 4.398 1.00 0.00 H new ATOM 622 N PRO A 41 5.425 10.921 0.337 1.00 0.00 N ATOM 623 CA PRO A 41 6.755 10.498 -0.058 1.00 0.00 C ATOM 624 C PRO A 41 6.854 8.969 -0.096 1.00 0.00 C ATOM 625 O PRO A 41 7.122 8.332 0.925 1.00 0.00 O ATOM 626 CB PRO A 41 7.691 11.113 0.979 1.00 0.00 C ATOM 627 CG PRO A 41 6.832 11.329 2.222 1.00 0.00 C ATOM 628 CD PRO A 41 5.419 11.457 1.687 1.00 0.00 C ATOM 0 HA PRO A 41 7.015 10.827 -1.064 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.531 10.451 1.192 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.109 12.054 0.622 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.920 10.493 2.916 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.135 12.225 2.763 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.717 10.909 2.316 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.100 12.499 1.687 1.00 0.00 H new ATOM 636 N LEU A 42 6.664 8.369 -1.272 1.00 0.00 N ATOM 637 CA LEU A 42 6.976 6.955 -1.470 1.00 0.00 C ATOM 638 C LEU A 42 8.477 6.839 -1.770 1.00 0.00 C ATOM 639 O LEU A 42 8.913 7.369 -2.791 1.00 0.00 O ATOM 640 CB LEU A 42 6.108 6.359 -2.611 1.00 0.00 C ATOM 641 CG LEU A 42 5.483 4.975 -2.324 1.00 0.00 C ATOM 642 CD1 LEU A 42 5.012 4.287 -3.612 1.00 0.00 C ATOM 643 CD2 LEU A 42 6.428 3.992 -1.639 1.00 0.00 C ATOM 0 H LEU A 42 6.297 8.840 -2.099 1.00 0.00 H new ATOM 0 HA LEU A 42 6.744 6.381 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.305 7.061 -2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.723 6.281 -3.508 1.00 0.00 H new ATOM 0 HG LEU A 42 4.652 5.203 -1.656 1.00 0.00 H new ATOM 0 HD11 LEU A 42 4.579 3.317 -3.369 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.261 4.907 -4.102 1.00 0.00 H new ATOM 0 HD13 LEU A 42 5.861 4.148 -4.281 1.00 0.00 H new ATOM 0 HD21 LEU A 42 5.912 3.046 -1.474 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.299 3.824 -2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 42 6.749 4.403 -0.682 1.00 0.00 H new ATOM 655 N VAL A 43 9.271 6.195 -0.907 1.00 0.00 N ATOM 656 CA VAL A 43 10.741 6.109 -1.001 1.00 0.00 C ATOM 657 C VAL A 43 11.153 4.634 -1.007 1.00 0.00 C ATOM 658 O VAL A 43 10.660 3.827 -0.212 1.00 0.00 O ATOM 659 CB VAL A 43 11.411 6.902 0.147 1.00 0.00 C ATOM 660 CG1 VAL A 43 11.297 8.404 -0.137 1.00 0.00 C ATOM 661 CG2 VAL A 43 10.736 6.665 1.497 1.00 0.00 C ATOM 0 H VAL A 43 8.900 5.701 -0.095 1.00 0.00 H new ATOM 0 HA VAL A 43 11.082 6.564 -1.931 1.00 0.00 H new ATOM 0 HB VAL A 43 12.445 6.562 0.194 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.768 8.964 0.671 1.00 0.00 H new ATOM 0 HG12 VAL A 43 11.796 8.635 -1.078 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.245 8.682 -0.206 1.00 0.00 H new ATOM 0 HG21 VAL A 43 11.246 7.245 2.266 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.692 6.975 1.441 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.787 5.606 1.748 1.00 0.00 H new ATOM 671 N ILE A 44 12.040 4.264 -1.930 1.00 0.00 N ATOM 672 CA ILE A 44 12.368 2.875 -2.224 1.00 0.00 C ATOM 673 C ILE A 44 13.734 2.585 -1.611 1.00 0.00 C ATOM 674 O ILE A 44 14.762 2.767 -2.268 1.00 0.00 O ATOM 675 CB ILE A 44 12.298 2.589 -3.744 1.00 0.00 C ATOM 676 CG1 ILE A 44 11.019 3.177 -4.395 1.00 0.00 C ATOM 677 CG2 ILE A 44 12.405 1.061 -3.943 1.00 0.00 C ATOM 678 CD1 ILE A 44 10.972 2.995 -5.911 1.00 0.00 C ATOM 0 H ILE A 44 12.557 4.933 -2.501 1.00 0.00 H new ATOM 0 HA ILE A 44 11.637 2.199 -1.782 1.00 0.00 H new ATOM 0 HB ILE A 44 13.127 3.085 -4.249 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.144 2.702 -3.952 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.957 4.240 -4.162 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.358 0.829 -5.007 1.00 0.00 H new ATOM 0 HG22 ILE A 44 13.352 0.706 -3.535 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.581 0.568 -3.428 1.00 0.00 H new ATOM 0 HD11 ILE A 44 10.051 3.429 -6.301 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.829 3.494 -6.364 1.00 0.00 H new ATOM 0 HD13 ILE A 44 11.002 1.932 -6.151 1.00 0.00 H new ATOM 690 N ALA A 45 13.746 2.149 -0.352 1.00 0.00 N ATOM 691 CA ALA A 45 14.970 1.961 0.407 1.00 0.00 C ATOM 692 C ALA A 45 15.166 0.514 0.829 1.00 0.00 C ATOM 693 O ALA A 45 14.242 -0.307 0.822 1.00 0.00 O ATOM 694 CB ALA A 45 14.978 2.860 1.632 1.00 0.00 C ATOM 0 H ALA A 45 12.900 1.917 0.168 1.00 0.00 H new ATOM 0 HA ALA A 45 15.798 2.231 -0.249 1.00 0.00 H new ATOM 0 HB1 ALA A 45 15.902 2.707 2.190 1.00 0.00 H new ATOM 0 HB2 ALA A 45 14.912 3.902 1.319 1.00 0.00 H new ATOM 0 HB3 ALA A 45 14.126 2.617 2.267 1.00 0.00 H new ATOM 700 N GLY A 46 16.389 0.237 1.261 1.00 0.00 N ATOM 701 CA GLY A 46 16.843 -1.085 1.646 1.00 0.00 C ATOM 702 C GLY A 46 17.484 -1.768 0.427 1.00 0.00 C ATOM 703 O GLY A 46 17.686 -1.143 -0.619 1.00 0.00 O ATOM 0 H GLY A 46 17.112 0.951 1.355 1.00 0.00 H new ATOM 0 HA2 GLY A 46 17.564 -1.013 2.460 1.00 0.00 H new ATOM 0 HA3 GLY A 46 16.006 -1.679 2.013 1.00 0.00 H new ATOM 707 N GLU A 47 17.833 -3.049 0.547 1.00 0.00 N ATOM 708 CA GLU A 47 18.534 -3.781 -0.509 1.00 0.00 C ATOM 709 C GLU A 47 17.598 -4.576 -1.416 1.00 0.00 C ATOM 710 O GLU A 47 17.971 -4.848 -2.556 1.00 0.00 O ATOM 711 CB GLU A 47 19.593 -4.701 0.116 1.00 0.00 C ATOM 712 CG GLU A 47 20.803 -4.922 -0.802 1.00 0.00 C ATOM 713 CD GLU A 47 21.460 -6.271 -0.514 1.00 0.00 C ATOM 714 OE1 GLU A 47 20.918 -7.304 -0.974 1.00 0.00 O ATOM 715 OE2 GLU A 47 22.477 -6.312 0.224 1.00 0.00 O ATOM 0 H GLU A 47 17.638 -3.608 1.378 1.00 0.00 H new ATOM 0 HA GLU A 47 19.015 -3.040 -1.148 1.00 0.00 H new ATOM 0 HB2 GLU A 47 19.931 -4.271 1.059 1.00 0.00 H new ATOM 0 HB3 GLU A 47 19.139 -5.664 0.350 1.00 0.00 H new ATOM 0 HG2 GLU A 47 20.487 -4.881 -1.844 1.00 0.00 H new ATOM 0 HG3 GLU A 47 21.527 -4.121 -0.656 1.00 0.00 H new ATOM 722 N HIS A 48 16.389 -4.909 -0.964 1.00 0.00 N ATOM 723 CA HIS A 48 15.476 -5.779 -1.695 1.00 0.00 C ATOM 724 C HIS A 48 14.382 -5.017 -2.457 1.00 0.00 C ATOM 725 O HIS A 48 13.465 -5.636 -3.001 1.00 0.00 O ATOM 726 CB HIS A 48 14.892 -6.830 -0.737 1.00 0.00 C ATOM 727 CG HIS A 48 15.729 -8.080 -0.600 1.00 0.00 C ATOM 728 ND1 HIS A 48 16.196 -8.856 -1.640 1.00 0.00 N ATOM 729 CD2 HIS A 48 16.017 -8.737 0.567 1.00 0.00 C ATOM 730 CE1 HIS A 48 16.742 -9.963 -1.114 1.00 0.00 C ATOM 731 NE2 HIS A 48 16.659 -9.936 0.228 1.00 0.00 N ATOM 0 H HIS A 48 16.016 -4.579 -0.074 1.00 0.00 H new ATOM 0 HA HIS A 48 16.051 -6.284 -2.471 1.00 0.00 H new ATOM 0 HB2 HIS A 48 14.770 -6.379 0.248 1.00 0.00 H new ATOM 0 HB3 HIS A 48 13.898 -7.109 -1.085 1.00 0.00 H new ATOM 0 HD2 HIS A 48 15.791 -8.394 1.566 1.00 0.00 H new ATOM 0 HE1 HIS A 48 17.186 -10.763 -1.688 1.00 0.00 H new ATOM 0 HE2 HIS A 48 16.997 -10.649 0.874 1.00 0.00 H new ATOM 739 N ASN A 49 14.492 -3.687 -2.510 1.00 0.00 N ATOM 740 CA ASN A 49 13.579 -2.742 -3.146 1.00 0.00 C ATOM 741 C ASN A 49 12.189 -2.840 -2.532 1.00 0.00 C ATOM 742 O ASN A 49 11.231 -3.316 -3.139 1.00 0.00 O ATOM 743 CB ASN A 49 13.545 -2.896 -4.670 1.00 0.00 C ATOM 744 CG ASN A 49 14.922 -2.880 -5.296 1.00 0.00 C ATOM 745 OD1 ASN A 49 15.362 -3.848 -5.894 1.00 0.00 O ATOM 746 ND2 ASN A 49 15.654 -1.795 -5.156 1.00 0.00 N ATOM 0 H ASN A 49 15.282 -3.210 -2.076 1.00 0.00 H new ATOM 0 HA ASN A 49 13.961 -1.739 -2.954 1.00 0.00 H new ATOM 0 HB2 ASN A 49 13.047 -3.832 -4.924 1.00 0.00 H new ATOM 0 HB3 ASN A 49 12.948 -2.091 -5.098 1.00 0.00 H new ATOM 0 HD21 ASN A 49 16.595 -1.760 -5.549 1.00 0.00 H new ATOM 0 HD22 ASN A 49 15.280 -0.989 -4.655 1.00 0.00 H new ATOM 753 N ILE A 50 12.099 -2.347 -1.306 1.00 0.00 N ATOM 754 CA ILE A 50 10.933 -2.340 -0.445 1.00 0.00 C ATOM 755 C ILE A 50 10.400 -0.892 -0.416 1.00 0.00 C ATOM 756 O ILE A 50 10.976 -0.060 0.281 1.00 0.00 O ATOM 757 CB ILE A 50 11.256 -2.995 0.918 1.00 0.00 C ATOM 758 CG1 ILE A 50 11.676 -4.480 0.740 1.00 0.00 C ATOM 759 CG2 ILE A 50 9.996 -2.972 1.785 1.00 0.00 C ATOM 760 CD1 ILE A 50 12.150 -5.169 2.028 1.00 0.00 C ATOM 0 H ILE A 50 12.903 -1.909 -0.856 1.00 0.00 H new ATOM 0 HA ILE A 50 10.119 -2.961 -0.818 1.00 0.00 H new ATOM 0 HB ILE A 50 12.074 -2.440 1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 50 10.831 -5.037 0.335 1.00 0.00 H new ATOM 0 HG13 ILE A 50 12.475 -4.532 0.001 1.00 0.00 H new ATOM 0 HG21 ILE A 50 10.210 -3.431 2.750 1.00 0.00 H new ATOM 0 HG22 ILE A 50 9.677 -1.941 1.937 1.00 0.00 H new ATOM 0 HG23 ILE A 50 9.201 -3.528 1.287 1.00 0.00 H new ATOM 0 HD11 ILE A 50 12.423 -6.201 1.809 1.00 0.00 H new ATOM 0 HD12 ILE A 50 13.017 -4.641 2.425 1.00 0.00 H new ATOM 0 HD13 ILE A 50 11.347 -5.154 2.765 1.00 0.00 H new ATOM 772 N PRO A 51 9.512 -0.474 -1.338 1.00 0.00 N ATOM 773 CA PRO A 51 8.933 0.873 -1.358 1.00 0.00 C ATOM 774 C PRO A 51 8.139 1.183 -0.070 1.00 0.00 C ATOM 775 O PRO A 51 7.016 0.702 0.105 1.00 0.00 O ATOM 776 CB PRO A 51 8.085 0.901 -2.636 1.00 0.00 C ATOM 777 CG PRO A 51 7.677 -0.549 -2.852 1.00 0.00 C ATOM 778 CD PRO A 51 8.910 -1.301 -2.379 1.00 0.00 C ATOM 0 HA PRO A 51 9.688 1.659 -1.374 1.00 0.00 H new ATOM 0 HB2 PRO A 51 7.214 1.546 -2.521 1.00 0.00 H new ATOM 0 HB3 PRO A 51 8.655 1.284 -3.483 1.00 0.00 H new ATOM 0 HG2 PRO A 51 6.792 -0.814 -2.274 1.00 0.00 H new ATOM 0 HG3 PRO A 51 7.449 -0.757 -3.897 1.00 0.00 H new ATOM 0 HD2 PRO A 51 8.642 -2.284 -1.990 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.608 -1.462 -3.201 1.00 0.00 H new ATOM 786 N TRP A 52 8.702 1.968 0.855 1.00 0.00 N ATOM 787 CA TRP A 52 8.091 2.303 2.144 1.00 0.00 C ATOM 788 C TRP A 52 7.243 3.551 1.982 1.00 0.00 C ATOM 789 O TRP A 52 7.752 4.552 1.466 1.00 0.00 O ATOM 790 CB TRP A 52 9.162 2.595 3.202 1.00 0.00 C ATOM 791 CG TRP A 52 10.109 1.474 3.450 1.00 0.00 C ATOM 792 CD1 TRP A 52 11.262 1.260 2.788 1.00 0.00 C ATOM 793 CD2 TRP A 52 9.964 0.359 4.368 1.00 0.00 C ATOM 794 NE1 TRP A 52 11.815 0.062 3.198 1.00 0.00 N ATOM 795 CE2 TRP A 52 11.049 -0.543 4.175 1.00 0.00 C ATOM 796 CE3 TRP A 52 9.001 0.023 5.335 1.00 0.00 C ATOM 797 CZ2 TRP A 52 11.155 -1.738 4.908 1.00 0.00 C ATOM 798 CZ3 TRP A 52 9.083 -1.183 6.043 1.00 0.00 C ATOM 799 CH2 TRP A 52 10.156 -2.067 5.840 1.00 0.00 C ATOM 0 H TRP A 52 9.618 2.398 0.724 1.00 0.00 H new ATOM 0 HA TRP A 52 7.488 1.454 2.465 1.00 0.00 H new ATOM 0 HB2 TRP A 52 9.731 3.472 2.892 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.668 2.850 4.139 1.00 0.00 H new ATOM 0 HD1 TRP A 52 11.689 1.923 2.050 1.00 0.00 H new ATOM 0 HE1 TRP A 52 12.681 -0.327 2.825 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.187 0.704 5.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.997 -2.397 4.756 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 8.311 -1.437 6.754 1.00 0.00 H new ATOM 0 HH2 TRP A 52 10.213 -2.991 6.395 1.00 0.00 H new ATOM 810 N LEU A 53 5.986 3.531 2.438 1.00 0.00 N ATOM 811 CA LEU A 53 5.147 4.713 2.381 1.00 0.00 C ATOM 812 C LEU A 53 5.247 5.473 3.696 1.00 0.00 C ATOM 813 O LEU A 53 4.757 5.051 4.742 1.00 0.00 O ATOM 814 CB LEU A 53 3.692 4.382 2.044 1.00 0.00 C ATOM 815 CG LEU A 53 2.944 5.515 1.317 1.00 0.00 C ATOM 816 CD1 LEU A 53 1.495 5.595 1.819 1.00 0.00 C ATOM 817 CD2 LEU A 53 3.529 6.914 1.285 1.00 0.00 C ATOM 0 H LEU A 53 5.538 2.711 2.846 1.00 0.00 H new ATOM 0 HA LEU A 53 5.511 5.344 1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.668 3.487 1.422 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.162 4.143 2.966 1.00 0.00 H new ATOM 0 HG LEU A 53 3.040 5.196 0.279 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.974 6.399 1.299 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.990 4.649 1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 53 1.492 5.794 2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.863 7.574 0.729 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.641 7.285 2.304 1.00 0.00 H new ATOM 0 HD23 LEU A 53 4.504 6.890 0.799 1.00 0.00 H new ATOM 829 N LEU A 54 5.965 6.578 3.666 1.00 0.00 N ATOM 830 CA LEU A 54 6.225 7.436 4.793 1.00 0.00 C ATOM 831 C LEU A 54 5.023 8.331 5.056 1.00 0.00 C ATOM 832 O LEU A 54 4.425 8.876 4.122 1.00 0.00 O ATOM 833 CB LEU A 54 7.471 8.246 4.435 1.00 0.00 C ATOM 834 CG LEU A 54 8.748 7.514 4.782 1.00 0.00 C ATOM 835 CD1 LEU A 54 8.906 6.193 4.075 1.00 0.00 C ATOM 836 CD2 LEU A 54 9.959 8.439 4.592 1.00 0.00 C ATOM 0 H LEU A 54 6.403 6.914 2.808 1.00 0.00 H new ATOM 0 HA LEU A 54 6.394 6.869 5.709 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.462 8.471 3.369 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.446 9.200 4.962 1.00 0.00 H new ATOM 0 HG LEU A 54 8.685 7.245 5.836 1.00 0.00 H new ATOM 0 HD11 LEU A 54 9.845 5.729 4.376 1.00 0.00 H new ATOM 0 HD12 LEU A 54 8.077 5.537 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 54 8.910 6.355 2.997 1.00 0.00 H new ATOM 0 HD21 LEU A 54 10.872 7.900 4.845 1.00 0.00 H new ATOM 0 HD22 LEU A 54 10.007 8.767 3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 54 9.859 9.308 5.242 1.00 0.00 H new ATOM 848 N TYR A 55 4.667 8.503 6.328 1.00 0.00 N ATOM 849 CA TYR A 55 3.550 9.355 6.707 1.00 0.00 C ATOM 850 C TYR A 55 3.962 10.823 6.678 1.00 0.00 C ATOM 851 O TYR A 55 4.346 11.389 7.703 1.00 0.00 O ATOM 852 CB TYR A 55 2.960 8.922 8.049 1.00 0.00 C ATOM 853 CG TYR A 55 1.601 9.541 8.318 1.00 0.00 C ATOM 854 CD1 TYR A 55 0.483 9.144 7.559 1.00 0.00 C ATOM 855 CD2 TYR A 55 1.448 10.493 9.340 1.00 0.00 C ATOM 856 CE1 TYR A 55 -0.802 9.613 7.894 1.00 0.00 C ATOM 857 CE2 TYR A 55 0.175 11.010 9.637 1.00 0.00 C ATOM 858 CZ TYR A 55 -0.962 10.549 8.940 1.00 0.00 C ATOM 859 OH TYR A 55 -2.203 10.973 9.312 1.00 0.00 O ATOM 0 H TYR A 55 5.141 8.059 7.115 1.00 0.00 H new ATOM 0 HA TYR A 55 2.752 9.240 5.974 1.00 0.00 H new ATOM 0 HB2 TYR A 55 2.870 7.836 8.068 1.00 0.00 H new ATOM 0 HB3 TYR A 55 3.646 9.199 8.849 1.00 0.00 H new ATOM 0 HD1 TYR A 55 0.611 8.478 6.718 1.00 0.00 H new ATOM 0 HD2 TYR A 55 2.310 10.828 9.898 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -1.665 9.257 7.351 1.00 0.00 H new ATOM 0 HE2 TYR A 55 0.067 11.764 10.403 1.00 0.00 H new ATOM 0 HH TYR A 55 -2.122 11.615 10.048 1.00 0.00 H new ATOM 869 N LEU A 56 3.885 11.443 5.500 1.00 0.00 N ATOM 870 CA LEU A 56 4.004 12.886 5.332 1.00 0.00 C ATOM 871 C LEU A 56 2.976 13.351 4.300 1.00 0.00 C ATOM 872 O LEU A 56 3.298 13.393 3.113 1.00 0.00 O ATOM 873 CB LEU A 56 5.441 13.308 4.964 1.00 0.00 C ATOM 874 CG LEU A 56 5.939 14.467 5.853 1.00 0.00 C ATOM 875 CD1 LEU A 56 7.063 13.985 6.766 1.00 0.00 C ATOM 876 CD2 LEU A 56 6.410 15.652 5.015 1.00 0.00 C ATOM 0 H LEU A 56 3.736 10.945 4.622 1.00 0.00 H new ATOM 0 HA LEU A 56 3.792 13.377 6.282 1.00 0.00 H new ATOM 0 HB2 LEU A 56 6.110 12.454 5.070 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.475 13.611 3.918 1.00 0.00 H new ATOM 0 HG LEU A 56 5.101 14.803 6.464 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.406 14.812 7.388 1.00 0.00 H new ATOM 0 HD12 LEU A 56 6.695 13.180 7.402 1.00 0.00 H new ATOM 0 HD13 LEU A 56 7.892 13.619 6.160 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.754 16.450 5.674 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.229 15.337 4.368 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.584 16.017 4.404 1.00 0.00 H new ATOM 888 N PRO A 57 1.727 13.623 4.706 1.00 0.00 N ATOM 889 CA PRO A 57 0.733 14.111 3.770 1.00 0.00 C ATOM 890 C PRO A 57 1.169 15.478 3.246 1.00 0.00 C ATOM 891 O PRO A 57 1.721 16.296 3.988 1.00 0.00 O ATOM 892 CB PRO A 57 -0.576 14.170 4.556 1.00 0.00 C ATOM 893 CG PRO A 57 -0.128 14.342 6.007 1.00 0.00 C ATOM 894 CD PRO A 57 1.199 13.587 6.062 1.00 0.00 C ATOM 0 HA PRO A 57 0.611 13.472 2.895 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -1.200 15.002 4.230 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.162 13.260 4.424 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -0.003 15.393 6.267 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -0.856 13.926 6.704 1.00 0.00 H new ATOM 0 HD2 PRO A 57 1.888 14.057 6.764 1.00 0.00 H new ATOM 0 HD3 PRO A 57 1.052 12.561 6.398 1.00 0.00 H new ATOM 902 N GLY A 58 0.915 15.732 1.967 1.00 0.00 N ATOM 903 CA GLY A 58 1.234 16.990 1.320 1.00 0.00 C ATOM 904 C GLY A 58 2.719 17.136 0.962 1.00 0.00 C ATOM 905 O GLY A 58 3.157 18.243 0.638 1.00 0.00 O ATOM 0 H GLY A 58 0.474 15.055 1.344 1.00 0.00 H new ATOM 0 HA2 GLY A 58 0.639 17.083 0.412 1.00 0.00 H new ATOM 0 HA3 GLY A 58 0.944 17.811 1.976 1.00 0.00 H new ATOM 909 N LYS A 59 3.519 16.061 0.982 1.00 0.00 N ATOM 910 CA LYS A 59 4.874 16.043 0.430 1.00 0.00 C ATOM 911 C LYS A 59 4.941 14.894 -0.571 1.00 0.00 C ATOM 912 O LYS A 59 4.267 13.896 -0.367 1.00 0.00 O ATOM 913 CB LYS A 59 5.828 15.843 1.615 1.00 0.00 C ATOM 914 CG LYS A 59 7.306 15.725 1.243 1.00 0.00 C ATOM 915 CD LYS A 59 7.959 17.076 0.937 1.00 0.00 C ATOM 916 CE LYS A 59 8.561 17.715 2.192 1.00 0.00 C ATOM 917 NZ LYS A 59 9.477 18.814 1.825 1.00 0.00 N ATOM 0 H LYS A 59 3.236 15.169 1.388 1.00 0.00 H new ATOM 0 HA LYS A 59 5.148 16.961 -0.090 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.708 16.679 2.304 1.00 0.00 H new ATOM 0 HB3 LYS A 59 5.531 14.942 2.153 1.00 0.00 H new ATOM 0 HG2 LYS A 59 7.843 15.246 2.061 1.00 0.00 H new ATOM 0 HG3 LYS A 59 7.405 15.075 0.373 1.00 0.00 H new ATOM 0 HD2 LYS A 59 8.739 16.941 0.188 1.00 0.00 H new ATOM 0 HD3 LYS A 59 7.217 17.749 0.507 1.00 0.00 H new ATOM 0 HE2 LYS A 59 7.764 18.096 2.831 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.099 16.962 2.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 9.876 19.236 2.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.247 18.441 1.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 8.954 19.540 1.295 1.00 0.00 H new ATOM 931 N GLY A 60 5.774 14.957 -1.607 1.00 0.00 N ATOM 932 CA GLY A 60 5.852 13.881 -2.587 1.00 0.00 C ATOM 933 C GLY A 60 4.650 13.937 -3.518 1.00 0.00 C ATOM 934 O GLY A 60 4.286 15.028 -3.960 1.00 0.00 O ATOM 0 H GLY A 60 6.402 15.740 -1.788 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.773 13.969 -3.163 1.00 0.00 H new ATOM 0 HA3 GLY A 60 5.884 12.917 -2.079 1.00 0.00 H new ATOM 938 N HIS A 61 4.077 12.787 -3.884 1.00 0.00 N ATOM 939 CA HIS A 61 3.193 12.679 -5.047 1.00 0.00 C ATOM 940 C HIS A 61 1.995 11.771 -4.754 1.00 0.00 C ATOM 941 O HIS A 61 1.972 11.087 -3.729 1.00 0.00 O ATOM 942 CB HIS A 61 4.011 12.183 -6.249 1.00 0.00 C ATOM 943 CG HIS A 61 5.298 12.941 -6.461 1.00 0.00 C ATOM 944 ND1 HIS A 61 5.409 14.251 -6.862 1.00 0.00 N ATOM 945 CD2 HIS A 61 6.555 12.492 -6.163 1.00 0.00 C ATOM 946 CE1 HIS A 61 6.704 14.595 -6.792 1.00 0.00 C ATOM 947 NE2 HIS A 61 7.443 13.557 -6.359 1.00 0.00 N ATOM 0 H HIS A 61 4.212 11.908 -3.384 1.00 0.00 H new ATOM 0 HA HIS A 61 2.781 13.660 -5.283 1.00 0.00 H new ATOM 0 HB2 HIS A 61 4.241 11.127 -6.110 1.00 0.00 H new ATOM 0 HB3 HIS A 61 3.401 12.261 -7.149 1.00 0.00 H new ATOM 0 HD1 HIS A 61 4.643 14.855 -7.160 1.00 0.00 H new ATOM 0 HD2 HIS A 61 6.816 11.496 -5.836 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.098 15.568 -7.047 1.00 0.00 H new ATOM 955 N CYS A 62 0.977 11.787 -5.620 1.00 0.00 N ATOM 956 CA CYS A 62 -0.260 11.040 -5.403 1.00 0.00 C ATOM 957 C CYS A 62 -0.090 9.571 -5.738 1.00 0.00 C ATOM 958 O CYS A 62 -0.187 9.191 -6.898 1.00 0.00 O ATOM 959 CB CYS A 62 -1.419 11.628 -6.214 1.00 0.00 C ATOM 960 SG CYS A 62 -1.851 13.275 -5.587 1.00 0.00 S ATOM 0 H CYS A 62 0.990 12.319 -6.490 1.00 0.00 H new ATOM 0 HA CYS A 62 -0.498 11.127 -4.343 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -1.140 11.693 -7.266 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -2.285 10.969 -6.154 1.00 0.00 H new ATOM 0 HG CYS A 62 -2.379 13.164 -4.404 1.00 0.00 H new ATOM 966 N VAL A 63 0.124 8.756 -4.709 1.00 0.00 N ATOM 967 CA VAL A 63 0.246 7.320 -4.813 1.00 0.00 C ATOM 968 C VAL A 63 -1.071 6.758 -5.363 1.00 0.00 C ATOM 969 O VAL A 63 -2.079 6.733 -4.651 1.00 0.00 O ATOM 970 CB VAL A 63 0.665 6.722 -3.447 1.00 0.00 C ATOM 971 CG1 VAL A 63 1.213 5.308 -3.682 1.00 0.00 C ATOM 972 CG2 VAL A 63 1.723 7.555 -2.697 1.00 0.00 C ATOM 0 H VAL A 63 0.219 9.096 -3.752 1.00 0.00 H new ATOM 0 HA VAL A 63 1.034 7.037 -5.511 1.00 0.00 H new ATOM 0 HB VAL A 63 -0.224 6.716 -2.816 1.00 0.00 H new ATOM 0 HG11 VAL A 63 1.513 4.871 -2.730 1.00 0.00 H new ATOM 0 HG12 VAL A 63 0.440 4.689 -4.137 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.076 5.358 -4.346 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.963 7.071 -1.751 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.624 7.631 -3.305 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.330 8.553 -2.504 1.00 0.00 H new ATOM 982 N THR A 64 -1.107 6.366 -6.639 1.00 0.00 N ATOM 983 CA THR A 64 -2.301 5.768 -7.231 1.00 0.00 C ATOM 984 C THR A 64 -2.391 4.285 -6.867 1.00 0.00 C ATOM 985 O THR A 64 -1.376 3.589 -6.779 1.00 0.00 O ATOM 986 CB THR A 64 -2.367 6.024 -8.745 1.00 0.00 C ATOM 987 OG1 THR A 64 -1.175 5.709 -9.445 1.00 0.00 O ATOM 988 CG2 THR A 64 -2.682 7.491 -8.998 1.00 0.00 C ATOM 0 H THR A 64 -0.320 6.453 -7.282 1.00 0.00 H new ATOM 0 HA THR A 64 -3.182 6.252 -6.810 1.00 0.00 H new ATOM 0 HB THR A 64 -3.147 5.361 -9.120 1.00 0.00 H new ATOM 0 HG1 THR A 64 -1.297 5.897 -10.399 1.00 0.00 H new ATOM 0 HG21 THR A 64 -2.729 7.673 -10.072 1.00 0.00 H new ATOM 0 HG22 THR A 64 -3.642 7.740 -8.545 1.00 0.00 H new ATOM 0 HG23 THR A 64 -1.901 8.112 -8.558 1.00 0.00 H new ATOM 996 N GLY A 65 -3.613 3.794 -6.656 1.00 0.00 N ATOM 997 CA GLY A 65 -3.876 2.500 -6.056 1.00 0.00 C ATOM 998 C GLY A 65 -5.316 2.072 -6.319 1.00 0.00 C ATOM 999 O GLY A 65 -5.906 2.412 -7.349 1.00 0.00 O ATOM 0 H GLY A 65 -4.462 4.302 -6.906 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.190 1.758 -6.463 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -3.695 2.547 -4.982 1.00 0.00 H new ATOM 1003 N GLU A 66 -5.877 1.258 -5.431 1.00 0.00 N ATOM 1004 CA GLU A 66 -7.217 0.684 -5.552 1.00 0.00 C ATOM 1005 C GLU A 66 -7.850 0.580 -4.162 1.00 0.00 C ATOM 1006 O GLU A 66 -7.138 0.700 -3.158 1.00 0.00 O ATOM 1007 CB GLU A 66 -7.098 -0.681 -6.243 1.00 0.00 C ATOM 1008 CG GLU A 66 -8.359 -1.119 -6.985 1.00 0.00 C ATOM 1009 CD GLU A 66 -7.966 -1.901 -8.242 1.00 0.00 C ATOM 1010 OE1 GLU A 66 -7.387 -1.261 -9.157 1.00 0.00 O ATOM 1011 OE2 GLU A 66 -8.183 -3.126 -8.310 1.00 0.00 O ATOM 0 H GLU A 66 -5.398 0.969 -4.578 1.00 0.00 H new ATOM 0 HA GLU A 66 -7.867 1.317 -6.157 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -6.268 -0.647 -6.949 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -6.850 -1.434 -5.495 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -8.978 -1.739 -6.337 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.955 -0.248 -7.257 1.00 0.00 H new ATOM 1018 N ILE A 67 -9.167 0.392 -4.092 1.00 0.00 N ATOM 1019 CA ILE A 67 -9.924 0.349 -2.851 1.00 0.00 C ATOM 1020 C ILE A 67 -10.535 -1.045 -2.767 1.00 0.00 C ATOM 1021 O ILE A 67 -11.226 -1.500 -3.680 1.00 0.00 O ATOM 1022 CB ILE A 67 -10.981 1.475 -2.823 1.00 0.00 C ATOM 1023 CG1 ILE A 67 -10.278 2.850 -2.812 1.00 0.00 C ATOM 1024 CG2 ILE A 67 -11.908 1.306 -1.602 1.00 0.00 C ATOM 1025 CD1 ILE A 67 -11.248 4.032 -2.898 1.00 0.00 C ATOM 0 H ILE A 67 -9.748 0.263 -4.920 1.00 0.00 H new ATOM 0 HA ILE A 67 -9.293 0.523 -1.979 1.00 0.00 H new ATOM 0 HB ILE A 67 -11.599 1.416 -3.719 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -9.688 2.940 -1.900 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -9.582 2.900 -3.649 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -12.648 2.106 -1.594 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -12.415 0.343 -1.661 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -11.317 1.350 -0.687 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -10.686 4.966 -2.885 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -11.821 3.966 -3.823 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -11.929 4.007 -2.047 1.00 0.00 H new ATOM 1037 N TYR A 68 -10.286 -1.720 -1.649 1.00 0.00 N ATOM 1038 CA TYR A 68 -10.863 -3.016 -1.361 1.00 0.00 C ATOM 1039 C TYR A 68 -11.776 -2.874 -0.152 1.00 0.00 C ATOM 1040 O TYR A 68 -11.395 -2.281 0.865 1.00 0.00 O ATOM 1041 CB TYR A 68 -9.754 -4.071 -1.210 1.00 0.00 C ATOM 1042 CG TYR A 68 -8.942 -4.228 -2.488 1.00 0.00 C ATOM 1043 CD1 TYR A 68 -9.564 -4.786 -3.624 1.00 0.00 C ATOM 1044 CD2 TYR A 68 -7.620 -3.745 -2.585 1.00 0.00 C ATOM 1045 CE1 TYR A 68 -8.926 -4.775 -4.878 1.00 0.00 C ATOM 1046 CE2 TYR A 68 -6.962 -3.792 -3.825 1.00 0.00 C ATOM 1047 CZ TYR A 68 -7.615 -4.262 -4.985 1.00 0.00 C ATOM 1048 OH TYR A 68 -6.980 -4.186 -6.188 1.00 0.00 O ATOM 0 H TYR A 68 -9.670 -1.373 -0.913 1.00 0.00 H new ATOM 0 HA TYR A 68 -11.480 -3.375 -2.185 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -9.092 -3.787 -0.392 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -10.199 -5.029 -0.942 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -10.545 -5.228 -3.530 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -7.120 -3.344 -1.716 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -9.435 -5.156 -5.751 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -5.936 -3.462 -3.892 1.00 0.00 H new ATOM 0 HH TYR A 68 -7.639 -4.031 -6.896 1.00 0.00 H new ATOM 1058 N GLU A 69 -12.992 -3.407 -0.276 1.00 0.00 N ATOM 1059 CA GLU A 69 -13.710 -3.916 0.871 1.00 0.00 C ATOM 1060 C GLU A 69 -12.853 -5.077 1.352 1.00 0.00 C ATOM 1061 O GLU A 69 -12.554 -5.992 0.582 1.00 0.00 O ATOM 1062 CB GLU A 69 -15.118 -4.393 0.481 1.00 0.00 C ATOM 1063 CG GLU A 69 -15.870 -5.004 1.675 1.00 0.00 C ATOM 1064 CD GLU A 69 -17.180 -5.681 1.253 1.00 0.00 C ATOM 1065 OE1 GLU A 69 -18.190 -4.972 1.077 1.00 0.00 O ATOM 1066 OE2 GLU A 69 -17.252 -6.932 1.160 1.00 0.00 O ATOM 0 H GLU A 69 -13.491 -3.493 -1.161 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.861 -3.158 1.639 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.689 -3.553 0.084 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.043 -5.132 -0.317 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -15.229 -5.734 2.170 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -16.086 -4.223 2.404 1.00 0.00 H new ATOM 1073 N VAL A 70 -12.442 -5.031 2.609 1.00 0.00 N ATOM 1074 CA VAL A 70 -11.818 -6.164 3.257 1.00 0.00 C ATOM 1075 C VAL A 70 -12.642 -6.497 4.492 1.00 0.00 C ATOM 1076 O VAL A 70 -13.425 -5.664 4.971 1.00 0.00 O ATOM 1077 CB VAL A 70 -10.332 -5.873 3.540 1.00 0.00 C ATOM 1078 CG1 VAL A 70 -9.540 -5.661 2.242 1.00 0.00 C ATOM 1079 CG2 VAL A 70 -10.119 -4.672 4.465 1.00 0.00 C ATOM 0 H VAL A 70 -12.533 -4.208 3.204 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.808 -7.046 2.616 1.00 0.00 H new ATOM 0 HB VAL A 70 -9.958 -6.759 4.053 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -8.496 -5.458 2.482 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -9.603 -6.558 1.626 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -9.958 -4.816 1.695 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -9.051 -4.520 4.624 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -10.548 -3.780 4.008 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.606 -4.859 5.422 1.00 0.00 H new ATOM 1089 N ASP A 71 -12.476 -7.707 5.012 1.00 0.00 N ATOM 1090 CA ASP A 71 -13.090 -8.104 6.271 1.00 0.00 C ATOM 1091 C ASP A 71 -12.014 -8.117 7.342 1.00 0.00 C ATOM 1092 O ASP A 71 -10.820 -8.000 7.053 1.00 0.00 O ATOM 1093 CB ASP A 71 -13.774 -9.472 6.174 1.00 0.00 C ATOM 1094 CG ASP A 71 -15.165 -9.423 5.539 1.00 0.00 C ATOM 1095 OD1 ASP A 71 -15.442 -8.565 4.669 1.00 0.00 O ATOM 1096 OD2 ASP A 71 -16.026 -10.213 5.981 1.00 0.00 O ATOM 0 H ASP A 71 -11.914 -8.437 4.574 1.00 0.00 H new ATOM 0 HA ASP A 71 -13.871 -7.387 6.525 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.142 -10.143 5.592 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -13.856 -9.899 7.174 1.00 0.00 H new ATOM 1101 N GLU A 72 -12.440 -8.306 8.588 1.00 0.00 N ATOM 1102 CA GLU A 72 -11.547 -8.314 9.733 1.00 0.00 C ATOM 1103 C GLU A 72 -10.489 -9.399 9.591 1.00 0.00 C ATOM 1104 O GLU A 72 -9.346 -9.144 9.945 1.00 0.00 O ATOM 1105 CB GLU A 72 -12.349 -8.429 11.045 1.00 0.00 C ATOM 1106 CG GLU A 72 -12.276 -7.084 11.776 1.00 0.00 C ATOM 1107 CD GLU A 72 -13.270 -6.901 12.934 1.00 0.00 C ATOM 1108 OE1 GLU A 72 -13.875 -7.879 13.420 1.00 0.00 O ATOM 1109 OE2 GLU A 72 -13.383 -5.749 13.415 1.00 0.00 O ATOM 0 H GLU A 72 -13.420 -8.458 8.828 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.013 -7.365 9.771 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -13.386 -8.690 10.834 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -11.941 -9.223 11.670 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.266 -6.957 12.165 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.441 -6.287 11.050 1.00 0.00 H new ATOM 1116 N GLN A 73 -10.816 -10.564 9.022 1.00 0.00 N ATOM 1117 CA GLN A 73 -9.829 -11.612 8.784 1.00 0.00 C ATOM 1118 C GLN A 73 -8.676 -11.120 7.907 1.00 0.00 C ATOM 1119 O GLN A 73 -7.528 -11.398 8.221 1.00 0.00 O ATOM 1120 CB GLN A 73 -10.504 -12.859 8.197 1.00 0.00 C ATOM 1121 CG GLN A 73 -9.564 -14.074 8.041 1.00 0.00 C ATOM 1122 CD GLN A 73 -8.692 -14.330 9.269 1.00 0.00 C ATOM 1123 OE1 GLN A 73 -7.476 -14.434 9.181 1.00 0.00 O ATOM 1124 NE2 GLN A 73 -9.287 -14.383 10.443 1.00 0.00 N ATOM 0 H GLN A 73 -11.760 -10.801 8.718 1.00 0.00 H new ATOM 0 HA GLN A 73 -9.390 -11.887 9.743 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -11.340 -13.141 8.837 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -10.920 -12.608 7.221 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -10.162 -14.962 7.838 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.921 -13.917 7.175 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -10.301 -14.295 10.505 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -8.733 -14.512 11.290 1.00 0.00 H new ATOM 1133 N MET A 74 -8.968 -10.374 6.842 1.00 0.00 N ATOM 1134 CA MET A 74 -7.942 -9.868 5.941 1.00 0.00 C ATOM 1135 C MET A 74 -7.094 -8.839 6.670 1.00 0.00 C ATOM 1136 O MET A 74 -5.873 -8.944 6.645 1.00 0.00 O ATOM 1137 CB MET A 74 -8.627 -9.288 4.698 1.00 0.00 C ATOM 1138 CG MET A 74 -7.745 -8.480 3.739 1.00 0.00 C ATOM 1139 SD MET A 74 -6.410 -9.348 2.890 1.00 0.00 S ATOM 1140 CE MET A 74 -7.328 -10.741 2.196 1.00 0.00 C ATOM 0 H MET A 74 -9.918 -10.107 6.583 1.00 0.00 H new ATOM 0 HA MET A 74 -7.274 -10.666 5.617 1.00 0.00 H new ATOM 0 HB2 MET A 74 -9.071 -10.112 4.139 1.00 0.00 H new ATOM 0 HB3 MET A 74 -9.446 -8.648 5.028 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.392 -8.038 2.981 1.00 0.00 H new ATOM 0 HG3 MET A 74 -7.305 -7.657 4.302 1.00 0.00 H new ATOM 0 HE1 MET A 74 -6.712 -11.250 1.455 1.00 0.00 H new ATOM 0 HE2 MET A 74 -7.588 -11.438 2.992 1.00 0.00 H new ATOM 0 HE3 MET A 74 -8.239 -10.376 1.721 1.00 0.00 H new ATOM 1150 N LEU A 75 -7.711 -7.861 7.346 1.00 0.00 N ATOM 1151 CA LEU A 75 -6.922 -6.875 8.085 1.00 0.00 C ATOM 1152 C LEU A 75 -6.038 -7.539 9.139 1.00 0.00 C ATOM 1153 O LEU A 75 -4.896 -7.129 9.333 1.00 0.00 O ATOM 1154 CB LEU A 75 -7.837 -5.849 8.760 1.00 0.00 C ATOM 1155 CG LEU A 75 -7.075 -4.561 9.148 1.00 0.00 C ATOM 1156 CD1 LEU A 75 -6.587 -3.772 7.926 1.00 0.00 C ATOM 1157 CD2 LEU A 75 -7.971 -3.670 10.008 1.00 0.00 C ATOM 0 H LEU A 75 -8.722 -7.735 7.395 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.279 -6.370 7.364 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -8.657 -5.597 8.088 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -8.281 -6.291 9.652 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.193 -4.867 9.710 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -6.059 -2.878 8.257 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -5.913 -4.394 7.337 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -7.442 -3.483 7.315 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -7.430 -2.763 10.279 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -8.866 -3.404 9.446 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -8.257 -4.206 10.913 1.00 0.00 H new ATOM 1169 N ARG A 76 -6.578 -8.545 9.827 1.00 0.00 N ATOM 1170 CA ARG A 76 -5.877 -9.329 10.836 1.00 0.00 C ATOM 1171 C ARG A 76 -4.680 -10.002 10.198 1.00 0.00 C ATOM 1172 O ARG A 76 -3.559 -9.809 10.666 1.00 0.00 O ATOM 1173 CB ARG A 76 -6.813 -10.366 11.489 1.00 0.00 C ATOM 1174 CG ARG A 76 -7.611 -9.735 12.639 1.00 0.00 C ATOM 1175 CD ARG A 76 -8.080 -10.838 13.583 1.00 0.00 C ATOM 1176 NE ARG A 76 -9.234 -10.417 14.388 1.00 0.00 N ATOM 1177 CZ ARG A 76 -9.890 -11.233 15.221 1.00 0.00 C ATOM 1178 NH1 ARG A 76 -9.351 -12.390 15.591 1.00 0.00 N ATOM 1179 NH2 ARG A 76 -11.077 -10.891 15.701 1.00 0.00 N ATOM 0 H ARG A 76 -7.544 -8.843 9.691 1.00 0.00 H new ATOM 0 HA ARG A 76 -5.535 -8.664 11.629 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -7.498 -10.765 10.741 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -6.227 -11.205 11.865 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -6.992 -9.017 13.177 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -8.467 -9.186 12.246 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -8.345 -11.723 13.004 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -7.261 -11.123 14.244 1.00 0.00 H new ATOM 0 HE ARG A 76 -9.552 -9.451 14.308 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -8.432 -12.660 15.240 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.856 -13.008 16.226 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -11.497 -10.000 15.436 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -11.571 -11.519 16.336 1.00 0.00 H new ATOM 1193 N PHE A 77 -4.923 -10.779 9.150 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.914 -11.554 8.468 1.00 0.00 C ATOM 1195 C PHE A 77 -2.790 -10.661 7.957 1.00 0.00 C ATOM 1196 O PHE A 77 -1.617 -10.949 8.181 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.569 -12.301 7.303 1.00 0.00 C ATOM 1198 CG PHE A 77 -3.559 -12.964 6.394 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -2.981 -14.202 6.730 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -3.138 -12.283 5.238 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -2.043 -14.791 5.866 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -2.170 -12.853 4.400 1.00 0.00 C ATOM 1203 CZ PHE A 77 -1.649 -14.124 4.693 1.00 0.00 C ATOM 0 H PHE A 77 -5.854 -10.885 8.746 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.477 -12.266 9.168 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -5.248 -13.057 7.697 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -5.172 -11.603 6.722 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -3.257 -14.698 7.649 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -3.561 -11.319 4.996 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -1.624 -15.758 6.103 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.825 -12.315 3.529 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.946 -14.589 4.017 1.00 0.00 H new ATOM 1213 N LEU A 78 -3.129 -9.570 7.268 1.00 0.00 N ATOM 1214 CA LEU A 78 -2.123 -8.688 6.698 1.00 0.00 C ATOM 1215 C LEU A 78 -1.237 -8.085 7.786 1.00 0.00 C ATOM 1216 O LEU A 78 -0.117 -7.675 7.489 1.00 0.00 O ATOM 1217 CB LEU A 78 -2.760 -7.562 5.872 1.00 0.00 C ATOM 1218 CG LEU A 78 -3.471 -7.999 4.579 1.00 0.00 C ATOM 1219 CD1 LEU A 78 -4.180 -6.772 3.994 1.00 0.00 C ATOM 1220 CD2 LEU A 78 -2.525 -8.584 3.525 1.00 0.00 C ATOM 0 H LEU A 78 -4.092 -9.281 7.094 1.00 0.00 H new ATOM 0 HA LEU A 78 -1.508 -9.298 6.036 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -3.480 -7.039 6.501 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.983 -6.844 5.612 1.00 0.00 H new ATOM 0 HG LEU A 78 -4.170 -8.794 4.839 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -4.694 -7.053 3.075 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -4.905 -6.393 4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -3.445 -5.996 3.777 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.096 -8.870 2.642 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.781 -7.837 3.250 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -2.024 -9.462 3.933 1.00 0.00 H new ATOM 1232 N ASP A 79 -1.722 -7.957 9.025 1.00 0.00 N ATOM 1233 CA ASP A 79 -0.964 -7.370 10.138 1.00 0.00 C ATOM 1234 C ASP A 79 0.189 -8.285 10.559 1.00 0.00 C ATOM 1235 O ASP A 79 1.154 -7.829 11.171 1.00 0.00 O ATOM 1236 CB ASP A 79 -1.922 -7.108 11.310 1.00 0.00 C ATOM 1237 CG ASP A 79 -1.506 -5.982 12.253 1.00 0.00 C ATOM 1238 OD1 ASP A 79 -0.850 -5.006 11.835 1.00 0.00 O ATOM 1239 OD2 ASP A 79 -2.102 -5.914 13.357 1.00 0.00 O ATOM 0 H ASP A 79 -2.660 -8.260 9.287 1.00 0.00 H new ATOM 0 HA ASP A 79 -0.523 -6.426 9.818 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.908 -6.877 10.907 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -2.022 -8.026 11.889 1.00 0.00 H new ATOM 1244 N ASP A 80 0.092 -9.573 10.215 1.00 0.00 N ATOM 1245 CA ASP A 80 1.173 -10.547 10.294 1.00 0.00 C ATOM 1246 C ASP A 80 2.050 -10.467 9.044 1.00 0.00 C ATOM 1247 O ASP A 80 3.272 -10.395 9.153 1.00 0.00 O ATOM 1248 CB ASP A 80 0.591 -11.959 10.403 1.00 0.00 C ATOM 1249 CG ASP A 80 1.710 -12.994 10.434 1.00 0.00 C ATOM 1250 OD1 ASP A 80 2.250 -13.248 11.529 1.00 0.00 O ATOM 1251 OD2 ASP A 80 1.991 -13.611 9.374 1.00 0.00 O ATOM 0 H ASP A 80 -0.776 -9.976 9.861 1.00 0.00 H new ATOM 0 HA ASP A 80 1.776 -10.325 11.174 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.014 -12.041 11.306 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -0.069 -12.153 9.558 1.00 0.00 H new ATOM 1256 N PHE A 81 1.432 -10.501 7.856 1.00 0.00 N ATOM 1257 CA PHE A 81 2.137 -10.573 6.575 1.00 0.00 C ATOM 1258 C PHE A 81 3.082 -9.389 6.381 1.00 0.00 C ATOM 1259 O PHE A 81 4.160 -9.551 5.814 1.00 0.00 O ATOM 1260 CB PHE A 81 1.120 -10.597 5.423 1.00 0.00 C ATOM 1261 CG PHE A 81 1.691 -10.534 4.011 1.00 0.00 C ATOM 1262 CD1 PHE A 81 2.770 -11.353 3.617 1.00 0.00 C ATOM 1263 CD2 PHE A 81 1.133 -9.640 3.076 1.00 0.00 C ATOM 1264 CE1 PHE A 81 3.250 -11.305 2.295 1.00 0.00 C ATOM 1265 CE2 PHE A 81 1.618 -9.583 1.759 1.00 0.00 C ATOM 1266 CZ PHE A 81 2.667 -10.430 1.362 1.00 0.00 C ATOM 0 H PHE A 81 0.417 -10.479 7.759 1.00 0.00 H new ATOM 0 HA PHE A 81 2.730 -11.488 6.577 1.00 0.00 H new ATOM 0 HB2 PHE A 81 0.526 -11.507 5.511 1.00 0.00 H new ATOM 0 HB3 PHE A 81 0.437 -9.757 5.553 1.00 0.00 H new ATOM 0 HD1 PHE A 81 3.229 -12.019 4.332 1.00 0.00 H new ATOM 0 HD2 PHE A 81 0.323 -8.991 3.375 1.00 0.00 H new ATOM 0 HE1 PHE A 81 4.069 -11.943 1.996 1.00 0.00 H new ATOM 0 HE2 PHE A 81 1.186 -8.890 1.053 1.00 0.00 H new ATOM 0 HZ PHE A 81 3.024 -10.409 0.343 1.00 0.00 H new ATOM 1276 N GLU A 82 2.683 -8.194 6.811 1.00 0.00 N ATOM 1277 CA GLU A 82 3.457 -6.970 6.607 1.00 0.00 C ATOM 1278 C GLU A 82 4.306 -6.692 7.855 1.00 0.00 C ATOM 1279 O GLU A 82 4.811 -5.591 8.038 1.00 0.00 O ATOM 1280 CB GLU A 82 2.543 -5.802 6.178 1.00 0.00 C ATOM 1281 CG GLU A 82 1.522 -6.220 5.093 1.00 0.00 C ATOM 1282 CD GLU A 82 1.641 -5.431 3.795 1.00 0.00 C ATOM 1283 OE1 GLU A 82 2.727 -5.455 3.182 1.00 0.00 O ATOM 1284 OE2 GLU A 82 0.617 -4.901 3.301 1.00 0.00 O ATOM 0 H GLU A 82 1.808 -8.046 7.314 1.00 0.00 H new ATOM 0 HA GLU A 82 4.154 -7.094 5.779 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.009 -5.423 7.049 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.156 -4.984 5.800 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.652 -7.280 4.875 1.00 0.00 H new ATOM 0 HG3 GLU A 82 0.514 -6.097 5.490 1.00 0.00 H new ATOM 1291 N ASP A 83 4.460 -7.700 8.718 1.00 0.00 N ATOM 1292 CA ASP A 83 5.326 -7.757 9.900 1.00 0.00 C ATOM 1293 C ASP A 83 5.180 -6.517 10.780 1.00 0.00 C ATOM 1294 O ASP A 83 6.129 -6.045 11.394 1.00 0.00 O ATOM 1295 CB ASP A 83 6.789 -8.079 9.525 1.00 0.00 C ATOM 1296 CG ASP A 83 6.953 -9.557 9.149 1.00 0.00 C ATOM 1297 OD1 ASP A 83 6.844 -10.400 10.072 1.00 0.00 O ATOM 1298 OD2 ASP A 83 7.150 -9.876 7.953 1.00 0.00 O ATOM 0 H ASP A 83 3.939 -8.569 8.598 1.00 0.00 H new ATOM 0 HA ASP A 83 4.987 -8.591 10.514 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.099 -7.452 8.689 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.443 -7.840 10.363 1.00 0.00 H new ATOM 1303 N CYS A 84 3.980 -5.968 10.886 1.00 0.00 N ATOM 1304 CA CYS A 84 3.669 -4.846 11.758 1.00 0.00 C ATOM 1305 C CYS A 84 3.628 -5.323 13.222 1.00 0.00 C ATOM 1306 O CYS A 84 3.494 -6.524 13.464 1.00 0.00 O ATOM 1307 CB CYS A 84 2.312 -4.315 11.319 1.00 0.00 C ATOM 1308 SG CYS A 84 2.382 -3.847 9.580 1.00 0.00 S ATOM 0 H CYS A 84 3.175 -6.299 10.354 1.00 0.00 H new ATOM 0 HA CYS A 84 4.423 -4.062 11.691 1.00 0.00 H new ATOM 0 HB2 CYS A 84 1.546 -5.075 11.471 1.00 0.00 H new ATOM 0 HB3 CYS A 84 2.033 -3.455 11.927 1.00 0.00 H new ATOM 0 HG CYS A 84 1.175 -3.772 9.102 1.00 0.00 H new ATOM 1314 N PRO A 85 3.716 -4.421 14.220 1.00 0.00 N ATOM 1315 CA PRO A 85 4.034 -3.000 14.104 1.00 0.00 C ATOM 1316 C PRO A 85 5.508 -2.723 13.748 1.00 0.00 C ATOM 1317 O PRO A 85 5.855 -1.556 13.561 1.00 0.00 O ATOM 1318 CB PRO A 85 3.662 -2.404 15.464 1.00 0.00 C ATOM 1319 CG PRO A 85 3.924 -3.550 16.436 1.00 0.00 C ATOM 1320 CD PRO A 85 3.527 -4.777 15.620 1.00 0.00 C ATOM 0 HA PRO A 85 3.480 -2.549 13.281 1.00 0.00 H new ATOM 0 HB2 PRO A 85 4.270 -1.530 15.700 1.00 0.00 H new ATOM 0 HB3 PRO A 85 2.620 -2.084 15.491 1.00 0.00 H new ATOM 0 HG2 PRO A 85 4.969 -3.589 16.744 1.00 0.00 H new ATOM 0 HG3 PRO A 85 3.327 -3.456 17.343 1.00 0.00 H new ATOM 0 HD2 PRO A 85 4.141 -5.637 15.888 1.00 0.00 H new ATOM 0 HD3 PRO A 85 2.490 -5.053 15.814 1.00 0.00 H new ATOM 1328 N SER A 86 6.371 -3.746 13.671 1.00 0.00 N ATOM 1329 CA SER A 86 7.783 -3.604 13.352 1.00 0.00 C ATOM 1330 C SER A 86 7.983 -2.887 12.025 1.00 0.00 C ATOM 1331 O SER A 86 8.470 -1.752 12.004 1.00 0.00 O ATOM 1332 CB SER A 86 8.434 -4.987 13.264 1.00 0.00 C ATOM 1333 OG SER A 86 8.630 -5.585 14.525 1.00 0.00 O ATOM 0 H SER A 86 6.092 -4.713 13.834 1.00 0.00 H new ATOM 0 HA SER A 86 8.245 -3.014 14.144 1.00 0.00 H new ATOM 0 HB2 SER A 86 7.809 -5.638 12.652 1.00 0.00 H new ATOM 0 HB3 SER A 86 9.395 -4.899 12.757 1.00 0.00 H new ATOM 0 HG SER A 86 9.046 -6.465 14.409 1.00 0.00 H new ATOM 1339 N MET A 87 7.681 -3.569 10.914 1.00 0.00 N ATOM 1340 CA MET A 87 8.114 -3.051 9.632 1.00 0.00 C ATOM 1341 C MET A 87 7.240 -1.859 9.277 1.00 0.00 C ATOM 1342 O MET A 87 7.784 -0.798 8.954 1.00 0.00 O ATOM 1343 CB MET A 87 8.097 -4.115 8.538 1.00 0.00 C ATOM 1344 CG MET A 87 9.103 -5.241 8.754 1.00 0.00 C ATOM 1345 SD MET A 87 9.545 -6.186 7.262 1.00 0.00 S ATOM 1346 CE MET A 87 8.072 -5.987 6.217 1.00 0.00 C ATOM 0 H MET A 87 7.159 -4.445 10.883 1.00 0.00 H new ATOM 0 HA MET A 87 9.154 -2.733 9.709 1.00 0.00 H new ATOM 0 HB2 MET A 87 7.096 -4.542 8.476 1.00 0.00 H new ATOM 0 HB3 MET A 87 8.300 -3.639 7.579 1.00 0.00 H new ATOM 0 HG2 MET A 87 10.013 -4.817 9.178 1.00 0.00 H new ATOM 0 HG3 MET A 87 8.698 -5.931 9.494 1.00 0.00 H new ATOM 0 HE1 MET A 87 8.080 -6.741 5.430 1.00 0.00 H new ATOM 0 HE2 MET A 87 7.175 -6.106 6.825 1.00 0.00 H new ATOM 0 HE3 MET A 87 8.076 -4.994 5.768 1.00 0.00 H new ATOM 1356 N TYR A 88 5.915 -2.010 9.394 1.00 0.00 N ATOM 1357 CA TYR A 88 4.990 -0.926 9.090 1.00 0.00 C ATOM 1358 C TYR A 88 4.146 -0.633 10.316 1.00 0.00 C ATOM 1359 O TYR A 88 4.050 -1.446 11.235 1.00 0.00 O ATOM 1360 CB TYR A 88 4.113 -1.249 7.874 1.00 0.00 C ATOM 1361 CG TYR A 88 4.881 -1.426 6.593 1.00 0.00 C ATOM 1362 CD1 TYR A 88 5.188 -0.336 5.759 1.00 0.00 C ATOM 1363 CD2 TYR A 88 5.299 -2.715 6.249 1.00 0.00 C ATOM 1364 CE1 TYR A 88 5.912 -0.550 4.571 1.00 0.00 C ATOM 1365 CE2 TYR A 88 6.039 -2.931 5.088 1.00 0.00 C ATOM 1366 CZ TYR A 88 6.357 -1.851 4.237 1.00 0.00 C ATOM 1367 OH TYR A 88 7.102 -2.064 3.118 1.00 0.00 O ATOM 0 H TYR A 88 5.466 -2.874 9.697 1.00 0.00 H new ATOM 0 HA TYR A 88 5.565 -0.038 8.829 1.00 0.00 H new ATOM 0 HB2 TYR A 88 3.551 -2.160 8.077 1.00 0.00 H new ATOM 0 HB3 TYR A 88 3.385 -0.448 7.741 1.00 0.00 H new ATOM 0 HD1 TYR A 88 4.870 0.660 6.029 1.00 0.00 H new ATOM 0 HD2 TYR A 88 5.047 -3.549 6.887 1.00 0.00 H new ATOM 0 HE1 TYR A 88 6.128 0.279 3.914 1.00 0.00 H new ATOM 0 HE2 TYR A 88 6.370 -3.928 4.839 1.00 0.00 H new ATOM 0 HH TYR A 88 7.320 -3.017 3.047 1.00 0.00 H new ATOM 1377 N GLN A 89 3.504 0.528 10.312 1.00 0.00 N ATOM 1378 CA GLN A 89 2.523 0.947 11.285 1.00 0.00 C ATOM 1379 C GLN A 89 1.266 1.259 10.488 1.00 0.00 C ATOM 1380 O GLN A 89 1.266 2.132 9.620 1.00 0.00 O ATOM 1381 CB GLN A 89 3.038 2.147 12.092 1.00 0.00 C ATOM 1382 CG GLN A 89 4.282 1.795 12.931 1.00 0.00 C ATOM 1383 CD GLN A 89 5.605 2.223 12.286 1.00 0.00 C ATOM 1384 OE1 GLN A 89 5.897 3.416 12.165 1.00 0.00 O ATOM 1385 NE2 GLN A 89 6.441 1.273 11.897 1.00 0.00 N ATOM 0 H GLN A 89 3.666 1.232 9.592 1.00 0.00 H new ATOM 0 HA GLN A 89 2.315 0.177 12.028 1.00 0.00 H new ATOM 0 HB2 GLN A 89 3.280 2.963 11.411 1.00 0.00 H new ATOM 0 HB3 GLN A 89 2.247 2.506 12.751 1.00 0.00 H new ATOM 0 HG2 GLN A 89 4.195 2.269 13.909 1.00 0.00 H new ATOM 0 HG3 GLN A 89 4.302 0.718 13.099 1.00 0.00 H new ATOM 0 HE21 GLN A 89 6.184 0.292 12.004 1.00 0.00 H new ATOM 0 HE22 GLN A 89 7.342 1.522 11.490 1.00 0.00 H new ATOM 1394 N ARG A 90 0.203 0.490 10.718 1.00 0.00 N ATOM 1395 CA ARG A 90 -1.106 0.791 10.152 1.00 0.00 C ATOM 1396 C ARG A 90 -1.549 2.126 10.726 1.00 0.00 C ATOM 1397 O ARG A 90 -1.529 2.298 11.948 1.00 0.00 O ATOM 1398 CB ARG A 90 -2.077 -0.358 10.458 1.00 0.00 C ATOM 1399 CG ARG A 90 -3.529 -0.117 10.003 1.00 0.00 C ATOM 1400 CD ARG A 90 -4.413 0.628 11.015 1.00 0.00 C ATOM 1401 NE ARG A 90 -4.520 -0.098 12.289 1.00 0.00 N ATOM 1402 CZ ARG A 90 -5.385 0.156 13.274 1.00 0.00 C ATOM 1403 NH1 ARG A 90 -6.130 1.252 13.263 1.00 0.00 N ATOM 1404 NH2 ARG A 90 -5.491 -0.710 14.270 1.00 0.00 N ATOM 0 H ARG A 90 0.226 -0.350 11.296 1.00 0.00 H new ATOM 0 HA ARG A 90 -1.077 0.877 9.066 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.707 -1.265 9.979 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.074 -0.541 11.533 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.512 0.450 9.072 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -3.989 -1.080 9.782 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.000 1.620 11.196 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -5.408 0.769 10.593 1.00 0.00 H new ATOM 0 HE ARG A 90 -3.870 -0.871 12.435 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.048 1.917 12.494 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.786 1.431 14.024 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -4.917 -1.553 14.276 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -6.146 -0.534 15.032 1.00 0.00 H new ATOM 1418 N THR A 91 -1.979 3.037 9.865 1.00 0.00 N ATOM 1419 CA THR A 91 -2.369 4.402 10.179 1.00 0.00 C ATOM 1420 C THR A 91 -3.709 4.660 9.485 1.00 0.00 C ATOM 1421 O THR A 91 -4.087 3.940 8.554 1.00 0.00 O ATOM 1422 CB THR A 91 -1.248 5.333 9.673 1.00 0.00 C ATOM 1423 OG1 THR A 91 -0.003 4.883 10.175 1.00 0.00 O ATOM 1424 CG2 THR A 91 -1.343 6.810 10.048 1.00 0.00 C ATOM 0 H THR A 91 -2.070 2.830 8.870 1.00 0.00 H new ATOM 0 HA THR A 91 -2.497 4.581 11.247 1.00 0.00 H new ATOM 0 HB THR A 91 -1.354 5.279 8.589 1.00 0.00 H new ATOM 0 HG1 THR A 91 0.185 3.986 9.827 1.00 0.00 H new ATOM 0 HG21 THR A 91 -0.493 7.347 9.628 1.00 0.00 H new ATOM 0 HG22 THR A 91 -2.268 7.227 9.651 1.00 0.00 H new ATOM 0 HG23 THR A 91 -1.336 6.911 11.133 1.00 0.00 H new ATOM 1432 N ALA A 92 -4.428 5.689 9.926 1.00 0.00 N ATOM 1433 CA ALA A 92 -5.659 6.146 9.314 1.00 0.00 C ATOM 1434 C ALA A 92 -5.376 7.463 8.602 1.00 0.00 C ATOM 1435 O ALA A 92 -4.828 8.393 9.204 1.00 0.00 O ATOM 1436 CB ALA A 92 -6.728 6.310 10.381 1.00 0.00 C ATOM 0 H ALA A 92 -4.158 6.239 10.742 1.00 0.00 H new ATOM 0 HA ALA A 92 -6.026 5.420 8.588 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.653 6.654 9.919 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.902 5.353 10.872 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.397 7.041 11.118 1.00 0.00 H new ATOM 1442 N LEU A 93 -5.728 7.509 7.321 1.00 0.00 N ATOM 1443 CA LEU A 93 -5.334 8.537 6.362 1.00 0.00 C ATOM 1444 C LEU A 93 -6.500 8.836 5.412 1.00 0.00 C ATOM 1445 O LEU A 93 -7.625 8.403 5.689 1.00 0.00 O ATOM 1446 CB LEU A 93 -4.057 8.093 5.628 1.00 0.00 C ATOM 1447 CG LEU A 93 -4.152 7.099 4.485 1.00 0.00 C ATOM 1448 CD1 LEU A 93 -2.734 6.951 3.948 1.00 0.00 C ATOM 1449 CD2 LEU A 93 -5.138 5.946 4.742 1.00 0.00 C ATOM 0 H LEU A 93 -6.325 6.796 6.902 1.00 0.00 H new ATOM 0 HA LEU A 93 -5.100 9.469 6.876 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -3.576 8.991 5.239 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -3.384 7.669 6.373 1.00 0.00 H new ATOM 0 HG LEU A 93 -4.705 7.399 3.595 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -2.731 6.245 3.118 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -2.373 7.919 3.602 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -2.082 6.583 4.740 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -5.150 5.278 3.880 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -4.826 5.391 5.627 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -6.138 6.351 4.901 1.00 0.00 H new ATOM 1461 N GLN A 94 -6.242 9.544 4.308 1.00 0.00 N ATOM 1462 CA GLN A 94 -7.250 9.949 3.344 1.00 0.00 C ATOM 1463 C GLN A 94 -6.889 9.492 1.933 1.00 0.00 C ATOM 1464 O GLN A 94 -5.734 9.604 1.517 1.00 0.00 O ATOM 1465 CB GLN A 94 -7.404 11.477 3.412 1.00 0.00 C ATOM 1466 CG GLN A 94 -8.574 12.076 2.618 1.00 0.00 C ATOM 1467 CD GLN A 94 -9.823 12.270 3.474 1.00 0.00 C ATOM 1468 OE1 GLN A 94 -10.925 11.619 3.149 1.00 0.00 O flip ATOM 1469 NE2 GLN A 94 -9.814 13.018 4.451 1.00 0.00 N flip ATOM 0 H GLN A 94 -5.302 9.855 4.061 1.00 0.00 H new ATOM 0 HA GLN A 94 -8.199 9.474 3.591 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -7.517 11.764 4.458 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -6.480 11.931 3.055 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -8.271 13.036 2.200 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -8.811 11.423 1.778 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -8.962 13.520 4.701 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.658 13.136 5.011 1.00 0.00 H new ATOM 1478 N VAL A 95 -7.887 9.008 1.186 1.00 0.00 N ATOM 1479 CA VAL A 95 -7.710 8.571 -0.206 1.00 0.00 C ATOM 1480 C VAL A 95 -8.885 9.118 -1.010 1.00 0.00 C ATOM 1481 O VAL A 95 -10.012 9.093 -0.526 1.00 0.00 O ATOM 1482 CB VAL A 95 -7.641 7.033 -0.207 1.00 0.00 C ATOM 1483 CG1 VAL A 95 -7.758 6.357 -1.576 1.00 0.00 C ATOM 1484 CG2 VAL A 95 -6.340 6.559 0.472 1.00 0.00 C ATOM 0 H VAL A 95 -8.842 8.907 1.529 1.00 0.00 H new ATOM 0 HA VAL A 95 -6.792 8.943 -0.661 1.00 0.00 H new ATOM 0 HB VAL A 95 -8.527 6.726 0.349 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.696 5.276 -1.454 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.714 6.617 -2.030 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.947 6.696 -2.220 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.302 5.470 0.465 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -5.481 6.955 -0.070 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.316 6.917 1.501 1.00 0.00 H new ATOM 1494 N GLN A 96 -8.647 9.585 -2.232 1.00 0.00 N ATOM 1495 CA GLN A 96 -9.661 9.954 -3.172 1.00 0.00 C ATOM 1496 C GLN A 96 -10.203 8.690 -3.763 1.00 0.00 C ATOM 1497 O GLN A 96 -9.475 7.817 -4.237 1.00 0.00 O ATOM 1498 CB GLN A 96 -9.138 10.923 -4.245 1.00 0.00 C ATOM 1499 CG GLN A 96 -10.132 11.203 -5.404 1.00 0.00 C ATOM 1500 CD GLN A 96 -9.561 11.818 -6.677 1.00 0.00 C ATOM 1501 OE1 GLN A 96 -9.619 11.217 -7.754 1.00 0.00 O ATOM 1502 NE2 GLN A 96 -9.069 13.038 -6.613 1.00 0.00 N ATOM 0 H GLN A 96 -7.702 9.716 -2.593 1.00 0.00 H new ATOM 0 HA GLN A 96 -10.457 10.501 -2.667 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -8.882 11.869 -3.768 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -8.217 10.517 -4.664 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -10.615 10.263 -5.670 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -10.911 11.866 -5.028 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -9.026 13.524 -5.717 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -8.731 13.496 -7.459 1.00 0.00 H new ATOM 1511 N VAL A 97 -11.515 8.653 -3.776 1.00 0.00 N ATOM 1512 CA VAL A 97 -12.276 7.644 -4.468 1.00 0.00 C ATOM 1513 C VAL A 97 -12.403 8.100 -5.911 1.00 0.00 C ATOM 1514 O VAL A 97 -13.039 9.104 -6.236 1.00 0.00 O ATOM 1515 CB VAL A 97 -13.545 7.351 -3.672 1.00 0.00 C ATOM 1516 CG1 VAL A 97 -14.420 8.443 -3.194 1.00 0.00 C ATOM 1517 CG2 VAL A 97 -14.351 6.133 -4.118 1.00 0.00 C ATOM 0 H VAL A 97 -12.094 9.340 -3.294 1.00 0.00 H new ATOM 0 HA VAL A 97 -11.806 6.662 -4.531 1.00 0.00 H new ATOM 0 HB VAL A 97 -13.007 7.103 -2.757 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -15.266 8.021 -2.651 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -13.855 9.099 -2.532 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -14.786 9.016 -4.046 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -15.229 6.024 -3.481 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -14.668 6.265 -5.153 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -13.733 5.239 -4.039 1.00 0.00 H new ATOM 1527 N LEU A 98 -11.624 7.429 -6.754 1.00 0.00 N ATOM 1528 CA LEU A 98 -11.590 7.657 -8.189 1.00 0.00 C ATOM 1529 C LEU A 98 -12.788 6.993 -8.869 1.00 0.00 C ATOM 1530 O LEU A 98 -13.125 7.350 -9.997 1.00 0.00 O ATOM 1531 CB LEU A 98 -10.297 7.060 -8.777 1.00 0.00 C ATOM 1532 CG LEU A 98 -9.254 8.144 -9.063 1.00 0.00 C ATOM 1533 CD1 LEU A 98 -8.426 8.484 -7.832 1.00 0.00 C ATOM 1534 CD2 LEU A 98 -8.283 7.667 -10.131 1.00 0.00 C ATOM 0 H LEU A 98 -10.985 6.695 -6.448 1.00 0.00 H new ATOM 0 HA LEU A 98 -11.626 8.732 -8.366 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.883 6.331 -8.081 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.529 6.525 -9.698 1.00 0.00 H new ATOM 0 HG LEU A 98 -9.808 9.025 -9.387 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.700 9.257 -8.084 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -9.082 8.846 -7.041 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.902 7.592 -7.489 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.546 8.446 -10.326 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.776 6.766 -9.786 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.830 7.447 -11.048 1.00 0.00 H new ATOM 1546 N GLU A 99 -13.358 5.982 -8.216 1.00 0.00 N ATOM 1547 CA GLU A 99 -14.491 5.192 -8.664 1.00 0.00 C ATOM 1548 C GLU A 99 -15.009 4.534 -7.400 1.00 0.00 C ATOM 1549 O GLU A 99 -14.194 4.084 -6.587 1.00 0.00 O ATOM 1550 CB GLU A 99 -13.979 4.158 -9.672 1.00 0.00 C ATOM 1551 CG GLU A 99 -14.998 3.197 -10.288 1.00 0.00 C ATOM 1552 CD GLU A 99 -14.292 2.341 -11.352 1.00 0.00 C ATOM 1553 OE1 GLU A 99 -13.881 2.876 -12.407 1.00 0.00 O ATOM 1554 OE2 GLU A 99 -14.028 1.145 -11.100 1.00 0.00 O ATOM 0 H GLU A 99 -13.016 5.678 -7.304 1.00 0.00 H new ATOM 0 HA GLU A 99 -15.276 5.766 -9.156 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -13.492 4.696 -10.485 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -13.211 3.561 -9.179 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -15.430 2.560 -9.516 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -15.820 3.755 -10.737 1.00 0.00 H new ATOM 1561 N TRP A 100 -16.324 4.465 -7.237 1.00 0.00 N ATOM 1562 CA TRP A 100 -16.985 3.775 -6.142 1.00 0.00 C ATOM 1563 C TRP A 100 -17.892 2.720 -6.751 1.00 0.00 C ATOM 1564 O TRP A 100 -18.688 3.004 -7.650 1.00 0.00 O ATOM 1565 CB TRP A 100 -17.787 4.741 -5.258 1.00 0.00 C ATOM 1566 CG TRP A 100 -18.372 4.112 -4.019 1.00 0.00 C ATOM 1567 CD1 TRP A 100 -19.683 3.881 -3.766 1.00 0.00 C ATOM 1568 CD2 TRP A 100 -17.663 3.583 -2.854 1.00 0.00 C ATOM 1569 NE1 TRP A 100 -19.825 3.268 -2.539 1.00 0.00 N ATOM 1570 CE2 TRP A 100 -18.611 3.060 -1.928 1.00 0.00 C ATOM 1571 CE3 TRP A 100 -16.305 3.456 -2.498 1.00 0.00 C ATOM 1572 CZ2 TRP A 100 -18.236 2.478 -0.706 1.00 0.00 C ATOM 1573 CZ3 TRP A 100 -15.915 2.883 -1.276 1.00 0.00 C ATOM 1574 CH2 TRP A 100 -16.876 2.398 -0.372 1.00 0.00 C ATOM 0 H TRP A 100 -16.979 4.902 -7.885 1.00 0.00 H new ATOM 0 HA TRP A 100 -16.239 3.316 -5.493 1.00 0.00 H new ATOM 0 HB2 TRP A 100 -17.139 5.565 -4.961 1.00 0.00 H new ATOM 0 HB3 TRP A 100 -18.596 5.169 -5.850 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -20.497 4.139 -4.428 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -20.722 3.001 -2.134 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -15.546 3.808 -3.181 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -18.987 2.096 -0.030 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -14.866 2.814 -1.029 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -16.570 1.968 0.570 1.00 0.00 H new ATOM 1585 N GLU A 101 -17.766 1.494 -6.257 1.00 0.00 N ATOM 1586 CA GLU A 101 -18.641 0.395 -6.615 1.00 0.00 C ATOM 1587 C GLU A 101 -19.624 0.146 -5.480 1.00 0.00 C ATOM 1588 O GLU A 101 -19.214 -0.166 -4.366 1.00 0.00 O ATOM 1589 CB GLU A 101 -17.810 -0.867 -6.898 1.00 0.00 C ATOM 1590 CG GLU A 101 -17.002 -0.787 -8.200 1.00 0.00 C ATOM 1591 CD GLU A 101 -17.881 -1.012 -9.435 1.00 0.00 C ATOM 1592 OE1 GLU A 101 -18.809 -0.210 -9.689 1.00 0.00 O ATOM 1593 OE2 GLU A 101 -17.703 -2.059 -10.101 1.00 0.00 O ATOM 0 H GLU A 101 -17.041 1.236 -5.587 1.00 0.00 H new ATOM 0 HA GLU A 101 -19.197 0.648 -7.518 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -17.127 -1.037 -6.066 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -18.476 -1.728 -6.945 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -16.522 0.189 -8.270 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -16.207 -1.532 -8.180 1.00 0.00 H new ATOM 1600 N GLY A 102 -20.919 0.231 -5.772 1.00 0.00 N ATOM 1601 CA GLY A 102 -21.993 -0.172 -4.872 1.00 0.00 C ATOM 1602 C GLY A 102 -22.572 1.025 -4.142 1.00 0.00 C ATOM 1603 O GLY A 102 -22.131 2.155 -4.348 1.00 0.00 O ATOM 0 H GLY A 102 -21.258 0.591 -6.664 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -22.779 -0.671 -5.439 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -21.614 -0.894 -4.149 1.00 0.00 H new ATOM 1607 N ASP A 103 -23.589 0.804 -3.308 1.00 0.00 N ATOM 1608 CA ASP A 103 -24.161 1.909 -2.549 1.00 0.00 C ATOM 1609 C ASP A 103 -23.423 2.106 -1.232 1.00 0.00 C ATOM 1610 O ASP A 103 -22.933 1.157 -0.603 1.00 0.00 O ATOM 1611 CB ASP A 103 -25.651 1.717 -2.259 1.00 0.00 C ATOM 1612 CG ASP A 103 -26.329 3.073 -2.027 1.00 0.00 C ATOM 1613 OD1 ASP A 103 -26.078 4.031 -2.798 1.00 0.00 O ATOM 1614 OD2 ASP A 103 -27.137 3.204 -1.082 1.00 0.00 O ATOM 0 H ASP A 103 -24.022 -0.105 -3.145 1.00 0.00 H new ATOM 0 HA ASP A 103 -24.048 2.794 -3.175 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -26.127 1.203 -3.094 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -25.779 1.084 -1.381 1.00 0.00 H new ATOM 1619 N GLY A 104 -23.413 3.353 -0.774 1.00 0.00 N ATOM 1620 CA GLY A 104 -22.740 3.807 0.420 1.00 0.00 C ATOM 1621 C GLY A 104 -21.600 4.738 0.050 1.00 0.00 C ATOM 1622 O GLY A 104 -20.469 4.477 0.432 1.00 0.00 O ATOM 0 H GLY A 104 -23.902 4.107 -1.256 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -23.445 4.323 1.071 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -22.357 2.953 0.979 1.00 0.00 H new ATOM 1626 N ASP A 105 -21.928 5.865 -0.569 1.00 0.00 N ATOM 1627 CA ASP A 105 -21.128 6.763 -1.399 1.00 0.00 C ATOM 1628 C ASP A 105 -20.698 8.018 -0.616 1.00 0.00 C ATOM 1629 O ASP A 105 -21.492 8.967 -0.511 1.00 0.00 O ATOM 1630 CB ASP A 105 -21.932 7.153 -2.644 1.00 0.00 C ATOM 1631 CG ASP A 105 -21.342 8.362 -3.373 1.00 0.00 C ATOM 1632 OD1 ASP A 105 -20.112 8.604 -3.317 1.00 0.00 O ATOM 1633 OD2 ASP A 105 -22.152 9.103 -3.969 1.00 0.00 O ATOM 0 H ASP A 105 -22.882 6.217 -0.492 1.00 0.00 H new ATOM 0 HA ASP A 105 -20.220 6.242 -1.701 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -21.970 6.305 -3.327 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -22.959 7.375 -2.354 1.00 0.00 H new ATOM 1638 N PRO A 106 -19.545 7.981 0.083 1.00 0.00 N ATOM 1639 CA PRO A 106 -19.038 9.070 0.921 1.00 0.00 C ATOM 1640 C PRO A 106 -18.628 10.363 0.184 1.00 0.00 C ATOM 1641 O PRO A 106 -18.148 11.300 0.829 1.00 0.00 O ATOM 1642 CB PRO A 106 -17.826 8.470 1.640 1.00 0.00 C ATOM 1643 CG PRO A 106 -17.291 7.498 0.606 1.00 0.00 C ATOM 1644 CD PRO A 106 -18.552 6.917 0.011 1.00 0.00 C ATOM 0 HA PRO A 106 -19.841 9.406 1.577 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -17.091 9.230 1.903 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -18.109 7.967 2.565 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -16.683 8.001 -0.146 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -16.666 6.729 1.059 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -18.390 6.601 -1.020 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -18.879 6.038 0.566 1.00 0.00 H new ATOM 1652 N GLY A 107 -18.788 10.465 -1.138 1.00 0.00 N ATOM 1653 CA GLY A 107 -18.117 11.488 -1.931 1.00 0.00 C ATOM 1654 C GLY A 107 -16.642 11.132 -2.084 1.00 0.00 C ATOM 1655 O GLY A 107 -16.164 10.140 -1.546 1.00 0.00 O ATOM 0 H GLY A 107 -19.384 9.842 -1.683 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -18.586 11.568 -2.912 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -18.219 12.460 -1.449 1.00 0.00 H new ATOM 1659 N ASP A 108 -15.926 11.951 -2.857 1.00 0.00 N ATOM 1660 CA ASP A 108 -14.669 11.666 -3.567 1.00 0.00 C ATOM 1661 C ASP A 108 -13.428 11.590 -2.723 1.00 0.00 C ATOM 1662 O ASP A 108 -12.377 11.351 -3.304 1.00 0.00 O ATOM 1663 CB ASP A 108 -14.348 12.769 -4.614 1.00 0.00 C ATOM 1664 CG ASP A 108 -15.483 13.551 -5.253 1.00 0.00 C ATOM 1665 OD1 ASP A 108 -16.257 14.212 -4.508 1.00 0.00 O ATOM 1666 OD2 ASP A 108 -15.604 13.563 -6.500 1.00 0.00 O ATOM 0 H ASP A 108 -16.232 12.910 -3.018 1.00 0.00 H new ATOM 0 HA ASP A 108 -14.874 10.684 -3.994 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -13.685 13.489 -4.136 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -13.782 12.300 -5.419 1.00 0.00 H new ATOM 1671 N SER A 109 -13.461 11.691 -1.409 1.00 0.00 N ATOM 1672 CA SER A 109 -12.388 11.100 -0.638 1.00 0.00 C ATOM 1673 C SER A 109 -12.894 10.493 0.662 1.00 0.00 C ATOM 1674 O SER A 109 -13.905 10.887 1.240 1.00 0.00 O ATOM 1675 CB SER A 109 -11.279 12.127 -0.417 1.00 0.00 C ATOM 1676 OG SER A 109 -10.550 12.472 -1.563 1.00 0.00 O ATOM 0 H SER A 109 -14.190 12.158 -0.870 1.00 0.00 H new ATOM 0 HA SER A 109 -11.965 10.271 -1.205 1.00 0.00 H new ATOM 0 HB2 SER A 109 -11.721 13.032 -0.001 1.00 0.00 H new ATOM 0 HB3 SER A 109 -10.588 11.737 0.330 1.00 0.00 H new ATOM 0 HG SER A 109 -11.095 12.304 -2.360 1.00 0.00 H new ATOM 1682 N VAL A 110 -12.163 9.485 1.127 1.00 0.00 N ATOM 1683 CA VAL A 110 -12.597 8.525 2.130 1.00 0.00 C ATOM 1684 C VAL A 110 -11.493 8.359 3.175 1.00 0.00 C ATOM 1685 O VAL A 110 -10.312 8.600 2.896 1.00 0.00 O ATOM 1686 CB VAL A 110 -13.001 7.186 1.454 1.00 0.00 C ATOM 1687 CG1 VAL A 110 -13.936 7.419 0.275 1.00 0.00 C ATOM 1688 CG2 VAL A 110 -11.806 6.358 0.955 1.00 0.00 C ATOM 0 H VAL A 110 -11.213 9.309 0.800 1.00 0.00 H new ATOM 0 HA VAL A 110 -13.486 8.888 2.646 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.503 6.622 2.240 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -14.199 6.462 -0.175 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -14.841 7.918 0.621 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -13.438 8.044 -0.466 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -12.167 5.438 0.495 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -11.245 6.935 0.220 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -11.157 6.113 1.796 1.00 0.00 H new ATOM 1698 N GLN A 111 -11.896 7.934 4.370 1.00 0.00 N ATOM 1699 CA GLN A 111 -11.033 7.509 5.461 1.00 0.00 C ATOM 1700 C GLN A 111 -10.870 6.003 5.311 1.00 0.00 C ATOM 1701 O GLN A 111 -11.835 5.243 5.435 1.00 0.00 O ATOM 1702 CB GLN A 111 -11.625 7.910 6.825 1.00 0.00 C ATOM 1703 CG GLN A 111 -10.685 7.661 8.018 1.00 0.00 C ATOM 1704 CD GLN A 111 -10.823 6.256 8.608 1.00 0.00 C ATOM 1705 OE1 GLN A 111 -11.740 5.971 9.373 1.00 0.00 O ATOM 1706 NE2 GLN A 111 -9.910 5.351 8.303 1.00 0.00 N ATOM 0 H GLN A 111 -12.885 7.875 4.612 1.00 0.00 H new ATOM 0 HA GLN A 111 -10.059 7.997 5.420 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -11.887 8.968 6.798 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -12.550 7.356 6.984 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -9.654 7.815 7.699 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -10.891 8.397 8.795 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -9.149 5.589 7.667 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -9.967 4.414 8.703 1.00 0.00 H new ATOM 1715 N CYS A 112 -9.637 5.586 5.051 1.00 0.00 N ATOM 1716 CA CYS A 112 -9.205 4.198 4.975 1.00 0.00 C ATOM 1717 C CYS A 112 -8.103 3.980 5.997 1.00 0.00 C ATOM 1718 O CYS A 112 -7.572 4.941 6.570 1.00 0.00 O ATOM 1719 CB CYS A 112 -8.756 3.859 3.537 1.00 0.00 C ATOM 1720 SG CYS A 112 -8.242 5.334 2.648 1.00 0.00 S ATOM 0 H CYS A 112 -8.874 6.241 4.879 1.00 0.00 H new ATOM 0 HA CYS A 112 -10.028 3.523 5.211 1.00 0.00 H new ATOM 0 HB2 CYS A 112 -7.932 3.146 3.570 1.00 0.00 H new ATOM 0 HB3 CYS A 112 -9.574 3.376 3.003 1.00 0.00 H new ATOM 0 HG CYS A 112 -9.184 6.228 2.710 1.00 0.00 H new ATOM 1726 N PHE A 113 -7.746 2.719 6.206 1.00 0.00 N ATOM 1727 CA PHE A 113 -6.458 2.373 6.770 1.00 0.00 C ATOM 1728 C PHE A 113 -5.477 2.182 5.621 1.00 0.00 C ATOM 1729 O PHE A 113 -5.858 1.690 4.550 1.00 0.00 O ATOM 1730 CB PHE A 113 -6.588 1.144 7.678 1.00 0.00 C ATOM 1731 CG PHE A 113 -7.492 1.376 8.878 1.00 0.00 C ATOM 1732 CD1 PHE A 113 -7.221 2.424 9.783 1.00 0.00 C ATOM 1733 CD2 PHE A 113 -8.640 0.581 9.064 1.00 0.00 C ATOM 1734 CE1 PHE A 113 -8.105 2.693 10.843 1.00 0.00 C ATOM 1735 CE2 PHE A 113 -9.522 0.850 10.126 1.00 0.00 C ATOM 1736 CZ PHE A 113 -9.263 1.915 11.005 1.00 0.00 C ATOM 0 H PHE A 113 -8.339 1.918 5.990 1.00 0.00 H new ATOM 0 HA PHE A 113 -6.076 3.169 7.409 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -6.977 0.309 7.095 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -5.598 0.854 8.029 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.330 3.022 9.661 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.843 -0.237 8.389 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -7.894 3.497 11.532 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.400 0.237 10.266 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.954 2.135 11.805 1.00 0.00 H new ATOM 1746 N VAL A 114 -4.239 2.610 5.862 1.00 0.00 N ATOM 1747 CA VAL A 114 -3.055 2.438 5.036 1.00 0.00 C ATOM 1748 C VAL A 114 -1.888 2.081 5.960 1.00 0.00 C ATOM 1749 O VAL A 114 -1.741 2.648 7.048 1.00 0.00 O ATOM 1750 CB VAL A 114 -2.814 3.688 4.142 1.00 0.00 C ATOM 1751 CG1 VAL A 114 -1.392 3.734 3.577 1.00 0.00 C ATOM 1752 CG2 VAL A 114 -3.725 3.628 2.918 1.00 0.00 C ATOM 0 H VAL A 114 -4.025 3.129 6.713 1.00 0.00 H new ATOM 0 HA VAL A 114 -3.177 1.620 4.326 1.00 0.00 H new ATOM 0 HB VAL A 114 -3.003 4.554 4.777 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -1.274 4.625 2.960 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -0.675 3.763 4.398 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -1.213 2.846 2.970 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.554 4.505 2.294 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.506 2.727 2.345 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.766 3.609 3.240 1.00 0.00 H new ATOM 1762 N TYR A 115 -1.043 1.139 5.534 1.00 0.00 N ATOM 1763 CA TYR A 115 0.241 0.869 6.162 1.00 0.00 C ATOM 1764 C TYR A 115 1.200 1.991 5.817 1.00 0.00 C ATOM 1765 O TYR A 115 1.473 2.234 4.636 1.00 0.00 O ATOM 1766 CB TYR A 115 0.828 -0.448 5.654 1.00 0.00 C ATOM 1767 CG TYR A 115 0.154 -1.678 6.206 1.00 0.00 C ATOM 1768 CD1 TYR A 115 0.155 -1.915 7.594 1.00 0.00 C ATOM 1769 CD2 TYR A 115 -0.415 -2.614 5.328 1.00 0.00 C ATOM 1770 CE1 TYR A 115 -0.379 -3.108 8.100 1.00 0.00 C ATOM 1771 CE2 TYR A 115 -0.926 -3.817 5.826 1.00 0.00 C ATOM 1772 CZ TYR A 115 -0.854 -4.080 7.204 1.00 0.00 C ATOM 1773 OH TYR A 115 -1.320 -5.243 7.689 1.00 0.00 O ATOM 0 H TYR A 115 -1.239 0.538 4.733 1.00 0.00 H new ATOM 0 HA TYR A 115 0.095 0.799 7.240 1.00 0.00 H new ATOM 0 HB2 TYR A 115 0.760 -0.467 4.566 1.00 0.00 H new ATOM 0 HB3 TYR A 115 1.887 -0.483 5.908 1.00 0.00 H new ATOM 0 HD1 TYR A 115 0.567 -1.178 8.268 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -0.458 -2.405 4.269 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -0.425 -3.278 9.166 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -1.372 -4.538 5.157 1.00 0.00 H new ATOM 0 HH TYR A 115 -0.624 -5.929 7.619 1.00 0.00 H new ATOM 1783 N THR A 116 1.742 2.646 6.834 1.00 0.00 N ATOM 1784 CA THR A 116 2.770 3.652 6.671 1.00 0.00 C ATOM 1785 C THR A 116 3.985 3.235 7.496 1.00 0.00 C ATOM 1786 O THR A 116 4.025 2.143 8.069 1.00 0.00 O ATOM 1787 CB THR A 116 2.214 5.052 7.024 1.00 0.00 C ATOM 1788 OG1 THR A 116 2.109 5.270 8.422 1.00 0.00 O ATOM 1789 CG2 THR A 116 0.848 5.334 6.386 1.00 0.00 C ATOM 0 H THR A 116 1.474 2.488 7.805 1.00 0.00 H new ATOM 0 HA THR A 116 3.093 3.727 5.632 1.00 0.00 H new ATOM 0 HB THR A 116 2.949 5.741 6.609 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.200 5.057 8.719 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.512 6.331 6.671 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.934 5.277 5.301 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.125 4.595 6.732 1.00 0.00 H new ATOM 1797 N THR A 117 4.978 4.104 7.594 1.00 0.00 N ATOM 1798 CA THR A 117 5.911 4.088 8.698 1.00 0.00 C ATOM 1799 C THR A 117 6.091 5.543 9.134 1.00 0.00 C ATOM 1800 O THR A 117 6.008 6.473 8.320 1.00 0.00 O ATOM 1801 CB THR A 117 7.191 3.301 8.335 1.00 0.00 C ATOM 1802 OG1 THR A 117 8.202 3.553 9.293 1.00 0.00 O ATOM 1803 CG2 THR A 117 7.733 3.568 6.921 1.00 0.00 C ATOM 0 H THR A 117 5.156 4.838 6.909 1.00 0.00 H new ATOM 0 HA THR A 117 5.546 3.537 9.565 1.00 0.00 H new ATOM 0 HB THR A 117 6.900 2.251 8.345 1.00 0.00 H new ATOM 0 HG1 THR A 117 9.009 3.050 9.057 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.631 2.973 6.757 1.00 0.00 H new ATOM 0 HG22 THR A 117 6.977 3.295 6.184 1.00 0.00 H new ATOM 0 HG23 THR A 117 7.975 4.626 6.818 1.00 0.00 H new ATOM 1811 N ALA A 118 6.284 5.726 10.440 1.00 0.00 N ATOM 1812 CA ALA A 118 6.645 6.977 11.091 1.00 0.00 C ATOM 1813 C ALA A 118 8.120 6.965 11.512 1.00 0.00 C ATOM 1814 O ALA A 118 8.700 8.019 11.778 1.00 0.00 O ATOM 1815 CB ALA A 118 5.746 7.153 12.314 1.00 0.00 C ATOM 0 H ALA A 118 6.186 4.960 11.106 1.00 0.00 H new ATOM 0 HA ALA A 118 6.507 7.807 10.398 1.00 0.00 H new ATOM 0 HB1 ALA A 118 5.998 8.085 12.820 1.00 0.00 H new ATOM 0 HB2 ALA A 118 4.703 7.182 11.998 1.00 0.00 H new ATOM 0 HB3 ALA A 118 5.895 6.318 12.998 1.00 0.00 H new ATOM 1821 N THR A 119 8.738 5.784 11.557 1.00 0.00 N ATOM 1822 CA THR A 119 10.097 5.562 12.016 1.00 0.00 C ATOM 1823 C THR A 119 10.844 4.904 10.858 1.00 0.00 C ATOM 1824 O THR A 119 11.135 3.710 10.838 1.00 0.00 O ATOM 1825 CB THR A 119 10.093 4.850 13.383 1.00 0.00 C ATOM 1826 OG1 THR A 119 11.393 4.444 13.751 1.00 0.00 O ATOM 1827 CG2 THR A 119 9.103 3.686 13.494 1.00 0.00 C ATOM 0 H THR A 119 8.279 4.923 11.260 1.00 0.00 H new ATOM 0 HA THR A 119 10.650 6.472 12.247 1.00 0.00 H new ATOM 0 HB THR A 119 9.738 5.599 14.091 1.00 0.00 H new ATOM 0 HG1 THR A 119 11.362 3.997 14.622 1.00 0.00 H new ATOM 0 HG21 THR A 119 9.169 3.245 14.489 1.00 0.00 H new ATOM 0 HG22 THR A 119 8.090 4.052 13.326 1.00 0.00 H new ATOM 0 HG23 THR A 119 9.344 2.931 12.746 1.00 0.00 H new ATOM 1835 N TYR A 120 11.096 5.718 9.844 1.00 0.00 N ATOM 1836 CA TYR A 120 11.795 5.357 8.622 1.00 0.00 C ATOM 1837 C TYR A 120 13.306 5.538 8.742 1.00 0.00 C ATOM 1838 O TYR A 120 14.026 5.027 7.888 1.00 0.00 O ATOM 1839 CB TYR A 120 11.204 6.167 7.457 1.00 0.00 C ATOM 1840 CG TYR A 120 10.547 7.486 7.836 1.00 0.00 C ATOM 1841 CD1 TYR A 120 9.180 7.475 8.185 1.00 0.00 C ATOM 1842 CD2 TYR A 120 11.262 8.692 7.840 1.00 0.00 C ATOM 1843 CE1 TYR A 120 8.505 8.674 8.445 1.00 0.00 C ATOM 1844 CE2 TYR A 120 10.596 9.899 8.140 1.00 0.00 C ATOM 1845 CZ TYR A 120 9.209 9.892 8.417 1.00 0.00 C ATOM 1846 OH TYR A 120 8.544 11.055 8.644 1.00 0.00 O ATOM 0 H TYR A 120 10.804 6.695 9.852 1.00 0.00 H new ATOM 0 HA TYR A 120 11.647 4.294 8.430 1.00 0.00 H new ATOM 0 HB2 TYR A 120 12.000 6.371 6.740 1.00 0.00 H new ATOM 0 HB3 TYR A 120 10.466 5.548 6.946 1.00 0.00 H new ATOM 0 HD1 TYR A 120 8.651 6.536 8.252 1.00 0.00 H new ATOM 0 HD2 TYR A 120 12.318 8.697 7.614 1.00 0.00 H new ATOM 0 HE1 TYR A 120 7.448 8.664 8.666 1.00 0.00 H new ATOM 0 HE2 TYR A 120 11.145 10.829 8.158 1.00 0.00 H new ATOM 0 HH TYR A 120 9.171 11.806 8.591 1.00 0.00 H new ATOM 1856 N ALA A 121 13.790 6.203 9.803 1.00 0.00 N ATOM 1857 CA ALA A 121 15.169 6.650 9.987 1.00 0.00 C ATOM 1858 C ALA A 121 15.523 7.775 8.991 1.00 0.00 C ATOM 1859 O ALA A 121 14.832 7.954 7.983 1.00 0.00 O ATOM 1860 CB ALA A 121 16.127 5.448 9.953 1.00 0.00 C ATOM 0 H ALA A 121 13.195 6.453 10.593 1.00 0.00 H new ATOM 0 HA ALA A 121 15.283 7.097 10.975 1.00 0.00 H new ATOM 0 HB1 ALA A 121 17.151 5.795 10.091 1.00 0.00 H new ATOM 0 HB2 ALA A 121 15.868 4.754 10.752 1.00 0.00 H new ATOM 0 HB3 ALA A 121 16.042 4.942 8.991 1.00 0.00 H new ATOM 1866 N PRO A 122 16.551 8.600 9.268 1.00 0.00 N ATOM 1867 CA PRO A 122 16.792 9.800 8.479 1.00 0.00 C ATOM 1868 C PRO A 122 17.269 9.506 7.064 1.00 0.00 C ATOM 1869 O PRO A 122 17.045 10.311 6.167 1.00 0.00 O ATOM 1870 CB PRO A 122 17.835 10.607 9.251 1.00 0.00 C ATOM 1871 CG PRO A 122 18.556 9.570 10.104 1.00 0.00 C ATOM 1872 CD PRO A 122 17.444 8.574 10.420 1.00 0.00 C ATOM 0 HA PRO A 122 15.860 10.349 8.347 1.00 0.00 H new ATOM 0 HB2 PRO A 122 18.524 11.116 8.576 1.00 0.00 H new ATOM 0 HB3 PRO A 122 17.368 11.374 9.868 1.00 0.00 H new ATOM 0 HG2 PRO A 122 19.379 9.102 9.564 1.00 0.00 H new ATOM 0 HG3 PRO A 122 18.977 10.010 11.008 1.00 0.00 H new ATOM 0 HD2 PRO A 122 17.848 7.574 10.580 1.00 0.00 H new ATOM 0 HD3 PRO A 122 16.915 8.854 11.331 1.00 0.00 H new ATOM 1880 N GLU A 123 17.928 8.373 6.845 1.00 0.00 N ATOM 1881 CA GLU A 123 18.456 8.014 5.539 1.00 0.00 C ATOM 1882 C GLU A 123 17.400 8.005 4.433 1.00 0.00 C ATOM 1883 O GLU A 123 17.688 8.437 3.317 1.00 0.00 O ATOM 1884 CB GLU A 123 19.208 6.688 5.613 1.00 0.00 C ATOM 1885 CG GLU A 123 18.434 5.541 6.284 1.00 0.00 C ATOM 1886 CD GLU A 123 18.955 5.253 7.689 1.00 0.00 C ATOM 1887 OE1 GLU A 123 18.963 6.199 8.514 1.00 0.00 O ATOM 1888 OE2 GLU A 123 19.357 4.084 7.910 1.00 0.00 O ATOM 0 H GLU A 123 18.110 7.679 7.570 1.00 0.00 H new ATOM 0 HA GLU A 123 19.158 8.799 5.259 1.00 0.00 H new ATOM 0 HB2 GLU A 123 19.477 6.383 4.602 1.00 0.00 H new ATOM 0 HB3 GLU A 123 20.140 6.845 6.157 1.00 0.00 H new ATOM 0 HG2 GLU A 123 17.376 5.797 6.334 1.00 0.00 H new ATOM 0 HG3 GLU A 123 18.516 4.641 5.674 1.00 0.00 H new ATOM 1895 N TRP A 124 16.181 7.554 4.722 1.00 0.00 N ATOM 1896 CA TRP A 124 15.112 7.412 3.766 1.00 0.00 C ATOM 1897 C TRP A 124 14.554 8.778 3.340 1.00 0.00 C ATOM 1898 O TRP A 124 13.860 8.885 2.331 1.00 0.00 O ATOM 1899 CB TRP A 124 14.101 6.419 4.340 1.00 0.00 C ATOM 1900 CG TRP A 124 14.654 5.029 4.563 1.00 0.00 C ATOM 1901 CD1 TRP A 124 15.917 4.606 4.301 1.00 0.00 C ATOM 1902 CD2 TRP A 124 13.960 3.841 5.050 1.00 0.00 C ATOM 1903 NE1 TRP A 124 16.053 3.273 4.610 1.00 0.00 N ATOM 1904 CE2 TRP A 124 14.872 2.744 5.059 1.00 0.00 C ATOM 1905 CE3 TRP A 124 12.634 3.569 5.441 1.00 0.00 C ATOM 1906 CZ2 TRP A 124 14.496 1.444 5.411 1.00 0.00 C ATOM 1907 CZ3 TRP A 124 12.255 2.284 5.862 1.00 0.00 C ATOM 1908 CH2 TRP A 124 13.183 1.223 5.849 1.00 0.00 C ATOM 0 H TRP A 124 15.913 7.271 5.664 1.00 0.00 H new ATOM 0 HA TRP A 124 15.462 6.993 2.823 1.00 0.00 H new ATOM 0 HB2 TRP A 124 13.727 6.806 5.288 1.00 0.00 H new ATOM 0 HB3 TRP A 124 13.248 6.354 3.664 1.00 0.00 H new ATOM 0 HD1 TRP A 124 16.705 5.229 3.905 1.00 0.00 H new ATOM 0 HE1 TRP A 124 16.921 2.746 4.517 1.00 0.00 H new ATOM 0 HE3 TRP A 124 11.899 4.360 5.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 124 15.201 0.629 5.347 1.00 0.00 H new ATOM 0 HZ3 TRP A 124 11.244 2.107 6.199 1.00 0.00 H new ATOM 0 HH2 TRP A 124 12.882 0.239 6.177 1.00 0.00 H new ATOM 1919 N LEU A 125 14.938 9.860 4.026 1.00 0.00 N ATOM 1920 CA LEU A 125 14.629 11.229 3.634 1.00 0.00 C ATOM 1921 C LEU A 125 15.573 11.749 2.540 1.00 0.00 C ATOM 1922 O LEU A 125 15.422 12.905 2.145 1.00 0.00 O ATOM 1923 CB LEU A 125 14.631 12.154 4.866 1.00 0.00 C ATOM 1924 CG LEU A 125 13.543 11.791 5.899 1.00 0.00 C ATOM 1925 CD1 LEU A 125 13.863 12.441 7.247 1.00 0.00 C ATOM 1926 CD2 LEU A 125 12.152 12.237 5.418 1.00 0.00 C ATOM 0 H LEU A 125 15.483 9.801 4.886 1.00 0.00 H new ATOM 0 HA LEU A 125 13.628 11.230 3.203 1.00 0.00 H new ATOM 0 HB2 LEU A 125 15.609 12.108 5.346 1.00 0.00 H new ATOM 0 HB3 LEU A 125 14.484 13.184 4.540 1.00 0.00 H new ATOM 0 HG LEU A 125 13.532 10.707 6.014 1.00 0.00 H new ATOM 0 HD11 LEU A 125 13.090 12.179 7.970 1.00 0.00 H new ATOM 0 HD12 LEU A 125 14.829 12.083 7.603 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.898 13.524 7.129 1.00 0.00 H new ATOM 0 HD21 LEU A 125 11.405 11.969 6.165 1.00 0.00 H new ATOM 0 HD22 LEU A 125 12.147 13.317 5.271 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.917 11.742 4.476 1.00 0.00 H new ATOM 1938 N PHE A 126 16.479 10.936 1.989 1.00 0.00 N ATOM 1939 CA PHE A 126 17.321 11.298 0.836 1.00 0.00 C ATOM 1940 C PHE A 126 16.907 10.596 -0.457 1.00 0.00 C ATOM 1941 O PHE A 126 17.525 10.775 -1.512 1.00 0.00 O ATOM 1942 CB PHE A 126 18.774 10.976 1.180 1.00 0.00 C ATOM 1943 CG PHE A 126 19.241 11.770 2.388 1.00 0.00 C ATOM 1944 CD1 PHE A 126 19.141 13.176 2.418 1.00 0.00 C ATOM 1945 CD2 PHE A 126 19.585 11.080 3.560 1.00 0.00 C ATOM 1946 CE1 PHE A 126 19.348 13.874 3.623 1.00 0.00 C ATOM 1947 CE2 PHE A 126 19.761 11.768 4.768 1.00 0.00 C ATOM 1948 CZ PHE A 126 19.642 13.168 4.804 1.00 0.00 C ATOM 0 H PHE A 126 16.654 9.992 2.334 1.00 0.00 H new ATOM 0 HA PHE A 126 17.194 12.364 0.647 1.00 0.00 H new ATOM 0 HB2 PHE A 126 18.875 9.910 1.381 1.00 0.00 H new ATOM 0 HB3 PHE A 126 19.411 11.201 0.325 1.00 0.00 H new ATOM 0 HD1 PHE A 126 18.905 13.719 1.515 1.00 0.00 H new ATOM 0 HD2 PHE A 126 19.715 10.008 3.531 1.00 0.00 H new ATOM 0 HE1 PHE A 126 19.281 14.952 3.641 1.00 0.00 H new ATOM 0 HE2 PHE A 126 19.988 11.222 5.672 1.00 0.00 H new ATOM 0 HZ PHE A 126 19.776 13.700 5.734 1.00 0.00 H new ATOM 1958 N LEU A 127 15.891 9.745 -0.375 1.00 0.00 N ATOM 1959 CA LEU A 127 15.458 8.896 -1.463 1.00 0.00 C ATOM 1960 C LEU A 127 14.632 9.746 -2.429 1.00 0.00 C ATOM 1961 O LEU A 127 13.928 10.660 -1.975 1.00 0.00 O ATOM 1962 CB LEU A 127 14.592 7.788 -0.855 1.00 0.00 C ATOM 1963 CG LEU A 127 15.328 6.650 -0.120 1.00 0.00 C ATOM 1964 CD1 LEU A 127 15.841 5.632 -1.130 1.00 0.00 C ATOM 1965 CD2 LEU A 127 16.542 7.060 0.662 1.00 0.00 C ATOM 0 H LEU A 127 15.336 9.628 0.473 1.00 0.00 H new ATOM 0 HA LEU A 127 16.298 8.459 -2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 127 13.895 8.248 -0.155 1.00 0.00 H new ATOM 0 HB3 LEU A 127 13.997 7.346 -1.654 1.00 0.00 H new ATOM 0 HG LEU A 127 14.580 6.266 0.573 1.00 0.00 H new ATOM 0 HD11 LEU A 127 16.360 4.830 -0.606 1.00 0.00 H new ATOM 0 HD12 LEU A 127 15.001 5.217 -1.687 1.00 0.00 H new ATOM 0 HD13 LEU A 127 16.529 6.120 -1.820 1.00 0.00 H new ATOM 0 HD21 LEU A 127 16.981 6.183 1.138 1.00 0.00 H new ATOM 0 HD22 LEU A 127 17.272 7.512 -0.010 1.00 0.00 H new ATOM 0 HD23 LEU A 127 16.256 7.782 1.426 1.00 0.00 H new ATOM 1977 N PRO A 128 14.660 9.447 -3.737 1.00 0.00 N ATOM 1978 CA PRO A 128 13.730 10.053 -4.672 1.00 0.00 C ATOM 1979 C PRO A 128 12.312 9.593 -4.332 1.00 0.00 C ATOM 1980 O PRO A 128 12.112 8.473 -3.847 1.00 0.00 O ATOM 1981 CB PRO A 128 14.177 9.591 -6.058 1.00 0.00 C ATOM 1982 CG PRO A 128 14.850 8.248 -5.785 1.00 0.00 C ATOM 1983 CD PRO A 128 15.462 8.427 -4.396 1.00 0.00 C ATOM 0 HA PRO A 128 13.724 11.142 -4.629 1.00 0.00 H new ATOM 0 HB2 PRO A 128 13.332 9.486 -6.738 1.00 0.00 H new ATOM 0 HB3 PRO A 128 14.867 10.301 -6.515 1.00 0.00 H new ATOM 0 HG2 PRO A 128 14.131 7.429 -5.804 1.00 0.00 H new ATOM 0 HG3 PRO A 128 15.611 8.022 -6.532 1.00 0.00 H new ATOM 0 HD2 PRO A 128 15.442 7.492 -3.836 1.00 0.00 H new ATOM 0 HD3 PRO A 128 16.505 8.734 -4.465 1.00 0.00 H new ATOM 1991 N TYR A 129 11.339 10.473 -4.560 1.00 0.00 N ATOM 1992 CA TYR A 129 9.933 10.139 -4.417 1.00 0.00 C ATOM 1993 C TYR A 129 9.406 9.568 -5.726 1.00 0.00 C ATOM 1994 O TYR A 129 9.943 9.831 -6.804 1.00 0.00 O ATOM 1995 CB TYR A 129 9.122 11.369 -3.984 1.00 0.00 C ATOM 1996 CG TYR A 129 9.539 12.023 -2.676 1.00 0.00 C ATOM 1997 CD1 TYR A 129 10.124 11.257 -1.652 1.00 0.00 C ATOM 1998 CD2 TYR A 129 9.314 13.398 -2.467 1.00 0.00 C ATOM 1999 CE1 TYR A 129 10.494 11.854 -0.439 1.00 0.00 C ATOM 2000 CE2 TYR A 129 9.654 14.000 -1.241 1.00 0.00 C ATOM 2001 CZ TYR A 129 10.262 13.230 -0.225 1.00 0.00 C ATOM 2002 OH TYR A 129 10.645 13.790 0.957 1.00 0.00 O ATOM 0 H TYR A 129 11.508 11.436 -4.849 1.00 0.00 H new ATOM 0 HA TYR A 129 9.825 9.384 -3.638 1.00 0.00 H new ATOM 0 HB2 TYR A 129 9.184 12.116 -4.775 1.00 0.00 H new ATOM 0 HB3 TYR A 129 8.075 11.077 -3.902 1.00 0.00 H new ATOM 0 HD1 TYR A 129 10.290 10.200 -1.801 1.00 0.00 H new ATOM 0 HD2 TYR A 129 8.877 13.995 -3.254 1.00 0.00 H new ATOM 0 HE1 TYR A 129 10.958 11.260 0.334 1.00 0.00 H new ATOM 0 HE2 TYR A 129 9.450 15.048 -1.078 1.00 0.00 H new ATOM 0 HH TYR A 129 10.420 14.744 0.955 1.00 0.00 H new ATOM 2012 N HIS A 130 8.325 8.799 -5.630 1.00 0.00 N ATOM 2013 CA HIS A 130 7.647 8.193 -6.767 1.00 0.00 C ATOM 2014 C HIS A 130 6.157 8.545 -6.710 1.00 0.00 C ATOM 2015 O HIS A 130 5.676 9.014 -5.674 1.00 0.00 O ATOM 2016 CB HIS A 130 7.920 6.676 -6.763 1.00 0.00 C ATOM 2017 CG HIS A 130 9.388 6.342 -6.969 1.00 0.00 C ATOM 2018 ND1 HIS A 130 9.949 5.873 -8.140 1.00 0.00 N ATOM 2019 CD2 HIS A 130 10.409 6.491 -6.060 1.00 0.00 C ATOM 2020 CE1 HIS A 130 11.274 5.769 -7.948 1.00 0.00 C ATOM 2021 NE2 HIS A 130 11.608 6.144 -6.702 1.00 0.00 N ATOM 0 H HIS A 130 7.887 8.576 -4.736 1.00 0.00 H new ATOM 0 HA HIS A 130 8.027 8.582 -7.712 1.00 0.00 H new ATOM 0 HB2 HIS A 130 7.585 6.254 -5.816 1.00 0.00 H new ATOM 0 HB3 HIS A 130 7.331 6.203 -7.549 1.00 0.00 H new ATOM 0 HD1 HIS A 130 9.447 5.646 -8.998 1.00 0.00 H new ATOM 0 HD2 HIS A 130 10.307 6.817 -5.035 1.00 0.00 H new ATOM 0 HE1 HIS A 130 11.977 5.430 -8.695 1.00 0.00 H new ATOM 2029 N GLU A 131 5.422 8.327 -7.804 1.00 0.00 N ATOM 2030 CA GLU A 131 3.980 8.612 -7.917 1.00 0.00 C ATOM 2031 C GLU A 131 3.155 7.328 -8.011 1.00 0.00 C ATOM 2032 O GLU A 131 1.967 7.326 -7.707 1.00 0.00 O ATOM 2033 CB GLU A 131 3.749 9.455 -9.175 1.00 0.00 C ATOM 2034 CG GLU A 131 2.436 10.281 -9.206 1.00 0.00 C ATOM 2035 CD GLU A 131 1.853 10.469 -10.624 1.00 0.00 C ATOM 2036 OE1 GLU A 131 2.556 10.163 -11.624 1.00 0.00 O ATOM 2037 OE2 GLU A 131 0.722 10.998 -10.758 1.00 0.00 O ATOM 0 H GLU A 131 5.819 7.938 -8.659 1.00 0.00 H new ATOM 0 HA GLU A 131 3.661 9.147 -7.023 1.00 0.00 H new ATOM 0 HB2 GLU A 131 4.589 10.140 -9.289 1.00 0.00 H new ATOM 0 HB3 GLU A 131 3.759 8.792 -10.040 1.00 0.00 H new ATOM 0 HG2 GLU A 131 1.692 9.788 -8.580 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.623 11.261 -8.767 1.00 0.00 H new ATOM 2044 N SER A 132 3.775 6.212 -8.374 1.00 0.00 N ATOM 2045 CA SER A 132 3.130 4.911 -8.288 1.00 0.00 C ATOM 2046 C SER A 132 4.190 3.824 -8.183 1.00 0.00 C ATOM 2047 O SER A 132 5.294 3.984 -8.720 1.00 0.00 O ATOM 2048 CB SER A 132 2.186 4.716 -9.486 1.00 0.00 C ATOM 2049 OG SER A 132 2.792 5.036 -10.728 1.00 0.00 O ATOM 0 H SER A 132 4.729 6.184 -8.733 1.00 0.00 H new ATOM 0 HA SER A 132 2.516 4.849 -7.390 1.00 0.00 H new ATOM 0 HB2 SER A 132 1.847 3.680 -9.510 1.00 0.00 H new ATOM 0 HB3 SER A 132 1.301 5.338 -9.349 1.00 0.00 H new ATOM 0 HG SER A 132 2.148 4.892 -11.453 1.00 0.00 H new ATOM 2055 N TYR A 133 3.858 2.730 -7.496 1.00 0.00 N ATOM 2056 CA TYR A 133 4.667 1.527 -7.439 1.00 0.00 C ATOM 2057 C TYR A 133 4.111 0.538 -8.459 1.00 0.00 C ATOM 2058 O TYR A 133 2.899 0.317 -8.531 1.00 0.00 O ATOM 2059 CB TYR A 133 4.681 0.950 -6.014 1.00 0.00 C ATOM 2060 CG TYR A 133 5.286 -0.443 -5.909 1.00 0.00 C ATOM 2061 CD1 TYR A 133 6.547 -0.701 -6.476 1.00 0.00 C ATOM 2062 CD2 TYR A 133 4.591 -1.486 -5.266 1.00 0.00 C ATOM 2063 CE1 TYR A 133 7.118 -1.982 -6.411 1.00 0.00 C ATOM 2064 CE2 TYR A 133 5.165 -2.769 -5.182 1.00 0.00 C ATOM 2065 CZ TYR A 133 6.433 -3.021 -5.752 1.00 0.00 C ATOM 2066 OH TYR A 133 7.014 -4.248 -5.668 1.00 0.00 O ATOM 0 H TYR A 133 2.997 2.661 -6.953 1.00 0.00 H new ATOM 0 HA TYR A 133 5.705 1.748 -7.688 1.00 0.00 H new ATOM 0 HB2 TYR A 133 5.239 1.626 -5.366 1.00 0.00 H new ATOM 0 HB3 TYR A 133 3.659 0.919 -5.637 1.00 0.00 H new ATOM 0 HD1 TYR A 133 7.083 0.097 -6.968 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.617 -1.301 -4.837 1.00 0.00 H new ATOM 0 HE1 TYR A 133 8.080 -2.170 -6.865 1.00 0.00 H new ATOM 0 HE2 TYR A 133 4.634 -3.564 -4.680 1.00 0.00 H new ATOM 0 HH TYR A 133 6.420 -4.859 -5.184 1.00 0.00 H new ATOM 2076 N ASP A 134 5.013 -0.052 -9.237 1.00 0.00 N ATOM 2077 CA ASP A 134 4.763 -1.079 -10.238 1.00 0.00 C ATOM 2078 C ASP A 134 5.914 -2.067 -10.146 1.00 0.00 C ATOM 2079 O ASP A 134 7.005 -1.697 -9.705 1.00 0.00 O ATOM 2080 CB ASP A 134 4.710 -0.473 -11.647 1.00 0.00 C ATOM 2081 CG ASP A 134 3.347 0.157 -11.891 1.00 0.00 C ATOM 2082 OD1 ASP A 134 3.150 1.334 -11.494 1.00 0.00 O ATOM 2083 OD2 ASP A 134 2.467 -0.566 -12.386 1.00 0.00 O ATOM 0 H ASP A 134 6.002 0.192 -9.180 1.00 0.00 H new ATOM 0 HA ASP A 134 3.803 -1.562 -10.056 1.00 0.00 H new ATOM 0 HB2 ASP A 134 5.492 0.278 -11.759 1.00 0.00 H new ATOM 0 HB3 ASP A 134 4.901 -1.246 -12.392 1.00 0.00 H new ATOM 2088 N SER A 135 5.692 -3.302 -10.584 1.00 0.00 N ATOM 2089 CA SER A 135 6.685 -4.368 -10.646 1.00 0.00 C ATOM 2090 C SER A 135 7.588 -4.251 -11.879 1.00 0.00 C ATOM 2091 O SER A 135 8.727 -4.707 -11.860 1.00 0.00 O ATOM 2092 CB SER A 135 5.958 -5.713 -10.664 1.00 0.00 C ATOM 2093 OG SER A 135 4.664 -5.642 -11.248 1.00 0.00 O ATOM 0 H SER A 135 4.776 -3.600 -10.920 1.00 0.00 H new ATOM 0 HA SER A 135 7.328 -4.286 -9.769 1.00 0.00 H new ATOM 0 HB2 SER A 135 6.559 -6.436 -11.215 1.00 0.00 H new ATOM 0 HB3 SER A 135 5.869 -6.084 -9.643 1.00 0.00 H new ATOM 0 HG SER A 135 4.249 -6.530 -11.233 1.00 0.00 H new ATOM 2099 N GLU A 136 7.120 -3.567 -12.920 1.00 0.00 N ATOM 2100 CA GLU A 136 7.811 -3.328 -14.161 1.00 0.00 C ATOM 2101 C GLU A 136 7.732 -1.825 -14.329 1.00 0.00 C ATOM 2102 O GLU A 136 6.746 -1.253 -14.807 1.00 0.00 O ATOM 2103 CB GLU A 136 7.211 -4.103 -15.338 1.00 0.00 C ATOM 2104 CG GLU A 136 7.345 -5.626 -15.175 1.00 0.00 C ATOM 2105 CD GLU A 136 7.535 -6.280 -16.541 1.00 0.00 C ATOM 2106 OE1 GLU A 136 6.628 -6.175 -17.393 1.00 0.00 O ATOM 2107 OE2 GLU A 136 8.645 -6.780 -16.841 1.00 0.00 O ATOM 0 H GLU A 136 6.192 -3.144 -12.908 1.00 0.00 H new ATOM 0 HA GLU A 136 8.841 -3.685 -14.141 1.00 0.00 H new ATOM 0 HB2 GLU A 136 6.157 -3.844 -15.439 1.00 0.00 H new ATOM 0 HB3 GLU A 136 7.705 -3.795 -16.260 1.00 0.00 H new ATOM 0 HG2 GLU A 136 8.192 -5.858 -14.530 1.00 0.00 H new ATOM 0 HG3 GLU A 136 6.456 -6.028 -14.690 1.00 0.00 H new ATOM 2114 N GLY A 137 8.746 -1.172 -13.791 1.00 0.00 N ATOM 2115 CA GLY A 137 9.114 0.176 -14.181 1.00 0.00 C ATOM 2116 C GLY A 137 10.608 0.266 -14.476 1.00 0.00 C ATOM 2117 O GLY A 137 11.393 -0.487 -13.889 1.00 0.00 O ATOM 0 H GLY A 137 9.343 -1.567 -13.064 1.00 0.00 H new ATOM 0 HA2 GLY A 137 8.546 0.472 -15.063 1.00 0.00 H new ATOM 0 HA3 GLY A 137 8.853 0.874 -13.385 1.00 0.00 H new ATOM 2121 N PRO A 138 11.033 1.229 -15.313 1.00 0.00 N ATOM 2122 CA PRO A 138 12.334 1.200 -15.977 1.00 0.00 C ATOM 2123 C PRO A 138 13.525 1.294 -15.026 1.00 0.00 C ATOM 2124 O PRO A 138 14.621 0.855 -15.374 1.00 0.00 O ATOM 2125 CB PRO A 138 12.311 2.366 -16.974 1.00 0.00 C ATOM 2126 CG PRO A 138 11.217 3.295 -16.454 1.00 0.00 C ATOM 2127 CD PRO A 138 10.221 2.314 -15.845 1.00 0.00 C ATOM 0 HA PRO A 138 12.478 0.237 -16.466 1.00 0.00 H new ATOM 0 HB2 PRO A 138 13.275 2.873 -17.014 1.00 0.00 H new ATOM 0 HB3 PRO A 138 12.090 2.020 -17.984 1.00 0.00 H new ATOM 0 HG2 PRO A 138 11.599 3.999 -15.714 1.00 0.00 H new ATOM 0 HG3 PRO A 138 10.770 3.885 -17.254 1.00 0.00 H new ATOM 0 HD2 PRO A 138 9.632 2.787 -15.059 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.518 1.950 -16.594 1.00 0.00 H new ATOM 2135 N HIS A 139 13.325 1.843 -13.829 1.00 0.00 N ATOM 2136 CA HIS A 139 14.334 1.977 -12.786 1.00 0.00 C ATOM 2137 C HIS A 139 14.861 0.625 -12.268 1.00 0.00 C ATOM 2138 O HIS A 139 15.895 0.594 -11.610 1.00 0.00 O ATOM 2139 CB HIS A 139 13.712 2.712 -11.599 1.00 0.00 C ATOM 2140 CG HIS A 139 13.013 4.023 -11.854 1.00 0.00 C ATOM 2141 ND1 HIS A 139 13.495 5.270 -11.525 1.00 0.00 N ATOM 2142 CD2 HIS A 139 11.685 4.166 -12.157 1.00 0.00 C ATOM 2143 CE1 HIS A 139 12.479 6.143 -11.620 1.00 0.00 C ATOM 2144 NE2 HIS A 139 11.353 5.514 -12.000 1.00 0.00 N ATOM 0 H HIS A 139 12.419 2.221 -13.551 1.00 0.00 H new ATOM 0 HA HIS A 139 15.172 2.518 -13.226 1.00 0.00 H new ATOM 0 HB2 HIS A 139 12.994 2.039 -11.131 1.00 0.00 H new ATOM 0 HB3 HIS A 139 14.502 2.893 -10.870 1.00 0.00 H new ATOM 0 HD2 HIS A 139 11.014 3.377 -12.463 1.00 0.00 H new ATOM 0 HE1 HIS A 139 12.556 7.201 -11.419 1.00 0.00 H new ATOM 0 HE2 HIS A 139 10.437 5.938 -12.145 1.00 0.00 H new ATOM 2152 N GLY A 140 14.145 -0.487 -12.470 1.00 0.00 N ATOM 2153 CA GLY A 140 14.596 -1.814 -12.047 1.00 0.00 C ATOM 2154 C GLY A 140 14.427 -2.090 -10.549 1.00 0.00 C ATOM 2155 O GLY A 140 14.160 -3.231 -10.181 1.00 0.00 O ATOM 0 H GLY A 140 13.236 -0.490 -12.932 1.00 0.00 H new ATOM 0 HA2 GLY A 140 14.044 -2.568 -12.608 1.00 0.00 H new ATOM 0 HA3 GLY A 140 15.648 -1.928 -12.309 1.00 0.00 H new ATOM 2159 N LEU A 141 14.479 -1.068 -9.688 1.00 0.00 N ATOM 2160 CA LEU A 141 14.267 -1.179 -8.241 1.00 0.00 C ATOM 2161 C LEU A 141 12.827 -1.593 -7.895 1.00 0.00 C ATOM 2162 O LEU A 141 11.974 -0.753 -7.609 1.00 0.00 O ATOM 2163 CB LEU A 141 14.734 0.086 -7.472 1.00 0.00 C ATOM 2164 CG LEU A 141 14.614 1.466 -8.143 1.00 0.00 C ATOM 2165 CD1 LEU A 141 13.170 1.819 -8.481 1.00 0.00 C ATOM 2166 CD2 LEU A 141 15.167 2.551 -7.216 1.00 0.00 C ATOM 0 H LEU A 141 14.675 -0.113 -9.988 1.00 0.00 H new ATOM 0 HA LEU A 141 14.908 -1.990 -7.894 1.00 0.00 H new ATOM 0 HB2 LEU A 141 14.173 0.127 -6.538 1.00 0.00 H new ATOM 0 HB3 LEU A 141 15.782 -0.060 -7.209 1.00 0.00 H new ATOM 0 HG LEU A 141 15.187 1.416 -9.069 1.00 0.00 H new ATOM 0 HD11 LEU A 141 13.136 2.801 -8.952 1.00 0.00 H new ATOM 0 HD12 LEU A 141 12.764 1.074 -9.165 1.00 0.00 H new ATOM 0 HD13 LEU A 141 12.576 1.835 -7.567 1.00 0.00 H new ATOM 0 HD21 LEU A 141 15.077 3.523 -7.700 1.00 0.00 H new ATOM 0 HD22 LEU A 141 14.602 2.556 -6.284 1.00 0.00 H new ATOM 0 HD23 LEU A 141 16.216 2.347 -7.003 1.00 0.00 H new ATOM 2178 N ARG A 142 12.530 -2.890 -7.924 1.00 0.00 N ATOM 2179 CA ARG A 142 11.250 -3.527 -7.641 1.00 0.00 C ATOM 2180 C ARG A 142 11.459 -4.766 -6.789 1.00 0.00 C ATOM 2181 O ARG A 142 12.542 -5.342 -6.805 1.00 0.00 O ATOM 2182 CB ARG A 142 10.529 -3.891 -8.948 1.00 0.00 C ATOM 2183 CG ARG A 142 10.003 -2.611 -9.591 1.00 0.00 C ATOM 2184 CD ARG A 142 10.897 -1.960 -10.641 1.00 0.00 C ATOM 2185 NE ARG A 142 11.001 -0.494 -10.474 1.00 0.00 N ATOM 2186 CZ ARG A 142 10.030 0.433 -10.528 1.00 0.00 C ATOM 2187 NH1 ARG A 142 8.772 0.110 -10.776 1.00 0.00 N ATOM 2188 NH2 ARG A 142 10.316 1.711 -10.301 1.00 0.00 N ATOM 0 H ARG A 142 13.241 -3.580 -8.167 1.00 0.00 H new ATOM 0 HA ARG A 142 10.626 -2.824 -7.089 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.212 -4.401 -9.627 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.707 -4.578 -8.747 1.00 0.00 H new ATOM 0 HG2 ARG A 142 9.040 -2.832 -10.052 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.819 -1.883 -8.801 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.893 -2.399 -10.587 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.505 -2.181 -11.634 1.00 0.00 H new ATOM 0 HE ARG A 142 11.939 -0.138 -10.293 1.00 0.00 H new ATOM 0 HH11 ARG A 142 8.517 -0.865 -10.932 1.00 0.00 H new ATOM 0 HH12 ARG A 142 8.056 0.836 -10.811 1.00 0.00 H new ATOM 0 HH21 ARG A 142 11.273 1.989 -10.086 1.00 0.00 H new ATOM 0 HH22 ARG A 142 9.578 2.414 -10.342 1.00 0.00 H new ATOM 2202 N TYR A 143 10.432 -5.128 -6.021 1.00 0.00 N ATOM 2203 CA TYR A 143 10.565 -6.076 -4.930 1.00 0.00 C ATOM 2204 C TYR A 143 11.046 -7.423 -5.464 1.00 0.00 C ATOM 2205 O TYR A 143 10.504 -7.949 -6.444 1.00 0.00 O ATOM 2206 CB TYR A 143 9.231 -6.189 -4.184 1.00 0.00 C ATOM 2207 CG TYR A 143 9.264 -7.113 -2.980 1.00 0.00 C ATOM 2208 CD1 TYR A 143 10.100 -6.826 -1.888 1.00 0.00 C ATOM 2209 CD2 TYR A 143 8.445 -8.254 -2.947 1.00 0.00 C ATOM 2210 CE1 TYR A 143 10.144 -7.696 -0.785 1.00 0.00 C ATOM 2211 CE2 TYR A 143 8.507 -9.153 -1.869 1.00 0.00 C ATOM 2212 CZ TYR A 143 9.383 -8.891 -0.786 1.00 0.00 C ATOM 2213 OH TYR A 143 9.434 -9.746 0.274 1.00 0.00 O ATOM 0 H TYR A 143 9.485 -4.768 -6.143 1.00 0.00 H new ATOM 0 HA TYR A 143 11.313 -5.726 -4.219 1.00 0.00 H new ATOM 0 HB2 TYR A 143 8.926 -5.195 -3.856 1.00 0.00 H new ATOM 0 HB3 TYR A 143 8.469 -6.543 -4.878 1.00 0.00 H new ATOM 0 HD1 TYR A 143 10.710 -5.935 -1.896 1.00 0.00 H new ATOM 0 HD2 TYR A 143 7.760 -8.442 -3.760 1.00 0.00 H new ATOM 0 HE1 TYR A 143 10.761 -7.452 0.067 1.00 0.00 H new ATOM 0 HE2 TYR A 143 7.890 -10.039 -1.866 1.00 0.00 H new ATOM 0 HH TYR A 143 8.849 -10.513 0.104 1.00 0.00 H new ATOM 2223 N ASN A 144 12.042 -8.002 -4.791 1.00 0.00 N ATOM 2224 CA ASN A 144 12.738 -9.194 -5.255 1.00 0.00 C ATOM 2225 C ASN A 144 12.614 -10.312 -4.221 1.00 0.00 C ATOM 2226 O ASN A 144 13.561 -10.575 -3.478 1.00 0.00 O ATOM 2227 CB ASN A 144 14.199 -8.844 -5.610 1.00 0.00 C ATOM 2228 CG ASN A 144 14.341 -8.184 -6.984 1.00 0.00 C ATOM 2229 OD1 ASN A 144 13.648 -8.535 -7.937 1.00 0.00 O ATOM 2230 ND2 ASN A 144 15.284 -7.278 -7.153 1.00 0.00 N ATOM 0 H ASN A 144 12.389 -7.649 -3.899 1.00 0.00 H new ATOM 0 HA ASN A 144 12.276 -9.568 -6.168 1.00 0.00 H new ATOM 0 HB2 ASN A 144 14.601 -8.175 -4.849 1.00 0.00 H new ATOM 0 HB3 ASN A 144 14.800 -9.753 -5.586 1.00 0.00 H new ATOM 0 HD21 ASN A 144 15.438 -6.868 -8.074 1.00 0.00 H new ATOM 0 HD22 ASN A 144 15.859 -6.987 -6.362 1.00 0.00 H new ATOM 2237 N PRO A 145 11.455 -10.991 -4.135 1.00 0.00 N ATOM 2238 CA PRO A 145 11.262 -12.123 -3.228 1.00 0.00 C ATOM 2239 C PRO A 145 11.893 -13.419 -3.749 1.00 0.00 C ATOM 2240 O PRO A 145 12.239 -14.304 -2.966 1.00 0.00 O ATOM 2241 CB PRO A 145 9.744 -12.292 -3.136 1.00 0.00 C ATOM 2242 CG PRO A 145 9.241 -11.784 -4.491 1.00 0.00 C ATOM 2243 CD PRO A 145 10.219 -10.672 -4.837 1.00 0.00 C ATOM 0 HA PRO A 145 11.740 -11.928 -2.268 1.00 0.00 H new ATOM 0 HB2 PRO A 145 9.466 -13.333 -2.970 1.00 0.00 H new ATOM 0 HB3 PRO A 145 9.326 -11.715 -2.311 1.00 0.00 H new ATOM 0 HG2 PRO A 145 9.247 -12.573 -5.243 1.00 0.00 H new ATOM 0 HG3 PRO A 145 8.218 -11.413 -4.426 1.00 0.00 H new ATOM 0 HD2 PRO A 145 10.384 -10.619 -5.913 1.00 0.00 H new ATOM 0 HD3 PRO A 145 9.833 -9.702 -4.525 1.00 0.00 H new ATOM 2251 N ARG A 146 11.940 -13.601 -5.071 1.00 0.00 N ATOM 2252 CA ARG A 146 12.283 -14.871 -5.701 1.00 0.00 C ATOM 2253 C ARG A 146 13.189 -14.718 -6.910 1.00 0.00 C ATOM 2254 O ARG A 146 13.463 -15.679 -7.622 1.00 0.00 O ATOM 2255 CB ARG A 146 10.978 -15.559 -6.139 1.00 0.00 C ATOM 2256 CG ARG A 146 11.141 -17.074 -6.021 1.00 0.00 C ATOM 2257 CD ARG A 146 10.483 -17.584 -4.729 1.00 0.00 C ATOM 2258 NE ARG A 146 10.963 -16.918 -3.501 1.00 0.00 N ATOM 2259 CZ ARG A 146 10.294 -16.859 -2.341 1.00 0.00 C ATOM 2260 NH1 ARG A 146 9.236 -17.628 -2.111 1.00 0.00 N ATOM 2261 NH2 ARG A 146 10.682 -15.981 -1.426 1.00 0.00 N ATOM 0 H ARG A 146 11.738 -12.858 -5.740 1.00 0.00 H new ATOM 0 HA ARG A 146 12.832 -15.463 -4.969 1.00 0.00 H new ATOM 0 HB2 ARG A 146 10.149 -15.221 -5.517 1.00 0.00 H new ATOM 0 HB3 ARG A 146 10.737 -15.287 -7.167 1.00 0.00 H new ATOM 0 HG2 ARG A 146 10.690 -17.563 -6.884 1.00 0.00 H new ATOM 0 HG3 ARG A 146 12.200 -17.334 -6.025 1.00 0.00 H new ATOM 0 HD2 ARG A 146 9.404 -17.447 -4.805 1.00 0.00 H new ATOM 0 HD3 ARG A 146 10.663 -18.656 -4.642 1.00 0.00 H new ATOM 0 HE ARG A 146 11.877 -16.467 -3.539 1.00 0.00 H new ATOM 0 HH11 ARG A 146 8.916 -18.282 -2.825 1.00 0.00 H new ATOM 0 HH12 ARG A 146 8.744 -17.565 -1.220 1.00 0.00 H new ATOM 0 HH21 ARG A 146 11.475 -15.367 -1.612 1.00 0.00 H new ATOM 0 HH22 ARG A 146 10.187 -15.919 -0.536 1.00 0.00 H new ATOM 2275 N GLU A 147 13.583 -13.494 -7.192 1.00 0.00 N ATOM 2276 CA GLU A 147 13.846 -13.059 -8.549 1.00 0.00 C ATOM 2277 C GLU A 147 15.249 -13.449 -8.989 1.00 0.00 C ATOM 2278 O GLU A 147 15.490 -13.697 -10.172 1.00 0.00 O ATOM 2279 CB GLU A 147 13.602 -11.554 -8.569 1.00 0.00 C ATOM 2280 CG GLU A 147 12.103 -11.275 -8.388 1.00 0.00 C ATOM 2281 CD GLU A 147 11.364 -11.532 -9.685 1.00 0.00 C ATOM 2282 OE1 GLU A 147 10.993 -12.698 -9.942 1.00 0.00 O ATOM 2283 OE2 GLU A 147 11.196 -10.525 -10.414 1.00 0.00 O ATOM 0 H GLU A 147 13.730 -12.772 -6.487 1.00 0.00 H new ATOM 0 HA GLU A 147 13.188 -13.547 -9.268 1.00 0.00 H new ATOM 0 HB2 GLU A 147 14.171 -11.072 -7.774 1.00 0.00 H new ATOM 0 HB3 GLU A 147 13.950 -11.131 -9.511 1.00 0.00 H new ATOM 0 HG2 GLU A 147 11.700 -11.910 -7.599 1.00 0.00 H new ATOM 0 HG3 GLU A 147 11.953 -10.242 -8.074 1.00 0.00 H new ATOM 2290 N ASN A 148 16.129 -13.618 -8.013 1.00 0.00 N ATOM 2291 CA ASN A 148 17.431 -14.251 -8.083 1.00 0.00 C ATOM 2292 C ASN A 148 17.424 -15.410 -7.081 1.00 0.00 C ATOM 2293 O ASN A 148 18.482 -15.797 -6.591 1.00 0.00 O ATOM 2294 CB ASN A 148 18.531 -13.213 -7.784 1.00 0.00 C ATOM 2295 CG ASN A 148 18.362 -12.519 -6.441 1.00 0.00 C ATOM 2296 OD1 ASN A 148 19.041 -12.814 -5.466 1.00 0.00 O ATOM 2297 ND2 ASN A 148 17.489 -11.531 -6.378 1.00 0.00 N ATOM 0 H ASN A 148 15.929 -13.285 -7.070 1.00 0.00 H new ATOM 0 HA ASN A 148 17.641 -14.643 -9.078 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.502 -13.707 -7.809 1.00 0.00 H new ATOM 0 HB3 ASN A 148 18.535 -12.462 -8.574 1.00 0.00 H new ATOM 0 HD21 ASN A 148 17.375 -11.005 -5.511 1.00 0.00 H new ATOM 0 HD22 ASN A 148 16.928 -11.293 -7.196 1.00 0.00 H new ATOM 2304 N ARG A 149 16.240 -15.947 -6.735 1.00 0.00 N ATOM 2305 CA ARG A 149 15.883 -16.206 -5.352 1.00 0.00 C ATOM 2306 C ARG A 149 16.229 -14.985 -4.519 1.00 0.00 C ATOM 2307 O ARG A 149 16.905 -15.138 -3.476 1.00 0.00 O ATOM 2308 CB ARG A 149 16.450 -17.556 -4.893 1.00 0.00 C ATOM 2309 CG ARG A 149 15.846 -18.741 -5.652 1.00 0.00 C ATOM 2310 CD ARG A 149 14.365 -18.854 -5.313 1.00 0.00 C ATOM 2311 NE ARG A 149 14.040 -20.105 -4.631 1.00 0.00 N ATOM 2312 CZ ARG A 149 13.678 -21.245 -5.221 1.00 0.00 C ATOM 2313 NH1 ARG A 149 13.694 -21.373 -6.545 1.00 0.00 N ATOM 2314 NH2 ARG A 149 13.272 -22.253 -4.459 1.00 0.00 N ATOM 0 H ARG A 149 15.519 -16.207 -7.408 1.00 0.00 H new ATOM 0 HA ARG A 149 14.809 -16.337 -5.218 1.00 0.00 H new ATOM 0 HB2 ARG A 149 17.531 -17.556 -5.029 1.00 0.00 H new ATOM 0 HB3 ARG A 149 16.263 -17.680 -3.826 1.00 0.00 H new ATOM 0 HG2 ARG A 149 15.976 -18.604 -6.726 1.00 0.00 H new ATOM 0 HG3 ARG A 149 16.364 -19.662 -5.383 1.00 0.00 H new ATOM 0 HD2 ARG A 149 14.075 -18.014 -4.682 1.00 0.00 H new ATOM 0 HD3 ARG A 149 13.779 -18.781 -6.229 1.00 0.00 H new ATOM 0 HE ARG A 149 14.095 -20.106 -3.612 1.00 0.00 H new ATOM 0 HH11 ARG A 149 13.987 -20.590 -7.130 1.00 0.00 H new ATOM 0 HH12 ARG A 149 13.413 -22.254 -6.976 1.00 0.00 H new ATOM 0 HH21 ARG A 149 13.242 -22.146 -3.445 1.00 0.00 H new ATOM 0 HH22 ARG A 149 12.990 -23.135 -4.887 1.00 0.00 H new TER 2328 ARG A 149