USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 845 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 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 103 LYS NZ :NH3+ 146:sc= -0.32 (180deg=-1.49!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN :FLIP amide:sc= -0.377 F(o=-1.3,f=-0.38) USER MOD Single : A 16 SER OG : rot 180:sc= 0.0183 USER MOD Single : A 18 SER OG : rot 50:sc= 0.996 USER MOD Single : A 19 TYR OH : rot 52:sc= -2.31! USER MOD Single : A 23 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.117) USER MOD Single : A 27 SER OG : rot 135:sc= -0.134 USER MOD Single : A 28 SER OG : rot -57:sc=0.000654 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN :FLIP amide:sc= -0.677! F(o=-1.6,f=-0.68!) USER MOD Single : A 36 GLN : amide:sc= -0.0927 X(o=-0.093,f=-0.069) USER MOD Single : A 39 GLN : amide:sc= -0.76 K(o=-0.76,f=-2.6!) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -1.57! C(o=-1.6!,f=-6.3!) USER MOD Single : A 59 THR OG1 : rot 85:sc= 0.736 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 LYS NZ :NH3+ 149:sc= -0.485 (180deg=-1.36!) USER MOD Single : A 81 TYR OH : rot 9:sc= -4.03! USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.798 USER MOD Single : A 94 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.189) USER MOD Single : A 98 THR OG1 : rot -48:sc= -3.78! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 130:sc= -1.39 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN :FLIP amide:sc= -0.139 F(o=-1.1,f=-0.14) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 ASN : amide:sc= 0.0461 K(o=0.046,f=-4.1!) USER MOD Single : A 123 TYR OH : rot -144:sc= 0.537 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 ASN : amide:sc= -0.456 K(o=-0.46,f=-2!) USER MOD ----------------------------------------------------------------- ATOM 50 N LEU A 5 -6.358 17.328 -7.075 1.00 0.00 N ATOM 51 CA LEU A 5 -7.446 16.392 -6.838 1.00 0.00 C ATOM 52 C LEU A 5 -7.793 15.678 -8.146 1.00 0.00 C ATOM 53 O LEU A 5 -8.267 16.304 -9.092 1.00 0.00 O ATOM 54 CB LEU A 5 -8.635 17.106 -6.193 1.00 0.00 C ATOM 55 CG LEU A 5 -8.881 16.798 -4.715 1.00 0.00 C ATOM 56 CD1 LEU A 5 -9.548 17.983 -4.012 1.00 0.00 C ATOM 57 CD2 LEU A 5 -9.684 15.507 -4.550 1.00 0.00 C ATOM 0 HA LEU A 5 -7.140 15.624 -6.127 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -8.490 18.181 -6.300 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -9.535 16.849 -6.752 1.00 0.00 H new ATOM 0 HG LEU A 5 -7.916 16.640 -4.234 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -9.712 17.738 -2.963 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -8.903 18.859 -4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -10.505 18.197 -4.488 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -9.845 15.311 -3.490 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.647 15.611 -5.050 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -9.133 14.677 -4.993 1.00 0.00 H new ATOM 68 N PHE A 6 -7.543 14.377 -8.156 1.00 0.00 N ATOM 69 CA PHE A 6 -7.823 13.570 -9.332 1.00 0.00 C ATOM 70 C PHE A 6 -9.279 13.732 -9.773 1.00 0.00 C ATOM 71 O PHE A 6 -9.625 13.418 -10.911 1.00 0.00 O ATOM 72 CB PHE A 6 -7.579 12.111 -8.942 1.00 0.00 C ATOM 73 CG PHE A 6 -7.617 11.137 -10.121 1.00 0.00 C ATOM 74 CD1 PHE A 6 -6.991 11.455 -11.286 1.00 0.00 C ATOM 75 CD2 PHE A 6 -8.277 9.955 -10.006 1.00 0.00 C ATOM 76 CE1 PHE A 6 -7.026 10.551 -12.381 1.00 0.00 C ATOM 77 CE2 PHE A 6 -8.313 9.050 -11.100 1.00 0.00 C ATOM 78 CZ PHE A 6 -7.686 9.368 -12.265 1.00 0.00 C ATOM 0 H PHE A 6 -7.150 13.861 -7.369 1.00 0.00 H new ATOM 0 HA PHE A 6 -7.184 13.882 -10.158 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -6.609 12.034 -8.452 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -8.330 11.810 -8.211 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -6.467 12.395 -11.378 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -8.775 9.703 -9.081 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -6.528 10.803 -13.306 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -8.837 8.110 -11.007 1.00 0.00 H new ATOM 0 HZ PHE A 6 -7.713 8.681 -13.098 1.00 0.00 H new ATOM 87 N LYS A 7 -10.093 14.220 -8.849 1.00 0.00 N ATOM 88 CA LYS A 7 -11.504 14.427 -9.128 1.00 0.00 C ATOM 89 C LYS A 7 -11.666 14.937 -10.561 1.00 0.00 C ATOM 90 O LYS A 7 -12.179 14.225 -11.424 1.00 0.00 O ATOM 91 CB LYS A 7 -12.130 15.342 -8.075 1.00 0.00 C ATOM 92 CG LYS A 7 -12.825 14.527 -6.982 1.00 0.00 C ATOM 93 CD LYS A 7 -14.101 13.873 -7.515 1.00 0.00 C ATOM 94 CE LYS A 7 -13.917 12.363 -7.679 1.00 0.00 C ATOM 95 NZ LYS A 7 -15.155 11.645 -7.302 1.00 0.00 N ATOM 0 H LYS A 7 -9.802 14.478 -7.906 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.048 13.485 -9.061 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -11.359 15.971 -7.630 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -12.850 16.009 -8.549 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -12.147 13.759 -6.609 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.068 15.174 -6.139 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.927 14.070 -6.832 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.368 14.317 -8.474 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -13.657 12.133 -8.712 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -13.089 12.022 -7.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -15.012 10.622 -7.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -15.387 11.851 -6.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.937 11.958 -7.912 1.00 0.00 H new ATOM 105 N GLN A 8 -11.220 16.168 -10.772 1.00 0.00 N ATOM 106 CA GLN A 8 -11.310 16.782 -12.086 1.00 0.00 C ATOM 107 C GLN A 8 -10.654 15.884 -13.137 1.00 0.00 C ATOM 108 O GLN A 8 -11.287 15.515 -14.125 1.00 0.00 O ATOM 109 CB GLN A 8 -10.680 18.175 -12.083 1.00 0.00 C ATOM 110 CG GLN A 8 -9.226 18.119 -11.609 1.00 0.00 C ATOM 111 CD GLN A 8 -8.749 19.493 -11.136 1.00 0.00 C ATOM 112 OE1 GLN A 8 -8.582 19.748 -9.954 1.00 0.00 O ATOM 113 NE2 GLN A 8 -8.541 20.362 -12.120 1.00 0.00 N ATOM 0 H GLN A 8 -10.796 16.756 -10.055 1.00 0.00 H new ATOM 0 HA GLN A 8 -12.363 16.897 -12.342 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -10.723 18.599 -13.086 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -11.253 18.836 -11.432 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -9.132 17.398 -10.797 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -8.589 17.769 -12.421 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -8.700 20.084 -13.088 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.222 21.307 -11.907 1.00 0.00 H new ATOM 120 N LEU A 9 -9.394 15.560 -12.888 1.00 0.00 N ATOM 121 CA LEU A 9 -8.645 14.712 -13.801 1.00 0.00 C ATOM 122 C LEU A 9 -9.563 13.614 -14.340 1.00 0.00 C ATOM 123 O LEU A 9 -9.559 13.327 -15.536 1.00 0.00 O ATOM 124 CB LEU A 9 -7.382 14.179 -13.122 1.00 0.00 C ATOM 125 CG LEU A 9 -6.259 15.194 -12.903 1.00 0.00 C ATOM 126 CD1 LEU A 9 -6.363 16.351 -13.900 1.00 0.00 C ATOM 127 CD2 LEU A 9 -6.238 15.686 -11.455 1.00 0.00 C ATOM 0 H LEU A 9 -8.872 15.869 -12.068 1.00 0.00 H new ATOM 0 HA LEU A 9 -8.299 15.288 -14.659 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -7.662 13.762 -12.154 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -6.990 13.357 -13.722 1.00 0.00 H new ATOM 0 HG LEU A 9 -5.308 14.695 -13.087 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -5.553 17.058 -13.722 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -6.290 15.963 -14.916 1.00 0.00 H new ATOM 0 HD13 LEU A 9 -7.320 16.856 -13.772 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -5.430 16.406 -11.327 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -7.190 16.162 -11.219 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -6.079 14.840 -10.786 1.00 0.00 H new ATOM 138 N ASP A 10 -10.331 13.029 -13.432 1.00 0.00 N ATOM 139 CA ASP A 10 -11.253 11.969 -13.801 1.00 0.00 C ATOM 140 C ASP A 10 -12.537 12.587 -14.357 1.00 0.00 C ATOM 141 O ASP A 10 -12.877 12.381 -15.522 1.00 0.00 O ATOM 142 CB ASP A 10 -11.626 11.115 -12.587 1.00 0.00 C ATOM 143 CG ASP A 10 -11.811 9.625 -12.878 1.00 0.00 C ATOM 144 OD1 ASP A 10 -11.363 9.116 -13.917 1.00 0.00 O ATOM 145 OD2 ASP A 10 -12.453 8.969 -11.972 1.00 0.00 O ATOM 0 H ASP A 10 -10.333 13.270 -12.441 1.00 0.00 H new ATOM 0 HA ASP A 10 -10.764 11.341 -14.546 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -10.850 11.228 -11.830 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -12.550 11.504 -12.158 1.00 0.00 H new ATOM 150 N ALA A 11 -13.218 13.333 -13.499 1.00 0.00 N ATOM 151 CA ALA A 11 -14.458 13.982 -13.890 1.00 0.00 C ATOM 152 C ALA A 11 -15.566 12.933 -13.997 1.00 0.00 C ATOM 153 O ALA A 11 -16.662 13.126 -13.474 1.00 0.00 O ATOM 154 CB ALA A 11 -14.244 14.742 -15.200 1.00 0.00 C ATOM 0 H ALA A 11 -12.934 13.502 -12.534 1.00 0.00 H new ATOM 0 HA ALA A 11 -14.765 14.709 -13.138 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -15.174 15.229 -15.494 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -13.468 15.495 -15.061 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.938 14.044 -15.979 1.00 0.00 H new ATOM 160 N ASN A 12 -15.241 11.844 -14.679 1.00 0.00 N ATOM 161 CA ASN A 12 -16.196 10.764 -14.861 1.00 0.00 C ATOM 162 C ASN A 12 -17.011 10.586 -13.579 1.00 0.00 C ATOM 163 O ASN A 12 -18.181 10.210 -13.630 1.00 0.00 O ATOM 164 CB ASN A 12 -15.483 9.442 -15.155 1.00 0.00 C ATOM 165 CG ASN A 12 -14.330 9.648 -16.139 1.00 0.00 C ATOM 166 OD1 ASN A 12 -14.590 10.530 -17.100 1.00 0.00 O flip ATOM 167 ND2 ASN A 12 -13.275 9.045 -16.033 1.00 0.00 N flip ATOM 0 H ASN A 12 -14.331 11.687 -15.112 1.00 0.00 H new ATOM 0 HA ASN A 12 -16.840 11.022 -15.702 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -15.102 9.016 -14.227 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -16.194 8.725 -15.567 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -13.142 8.381 -15.270 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -12.526 9.205 -16.707 1.00 0.00 H new ATOM 173 N GLY A 13 -16.362 10.867 -12.459 1.00 0.00 N ATOM 174 CA GLY A 13 -17.012 10.744 -11.165 1.00 0.00 C ATOM 175 C GLY A 13 -17.350 9.284 -10.859 1.00 0.00 C ATOM 176 O GLY A 13 -18.193 9.004 -10.008 1.00 0.00 O ATOM 0 H GLY A 13 -15.392 11.180 -12.421 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -16.360 11.141 -10.387 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -17.923 11.342 -11.153 1.00 0.00 H new ATOM 180 N ASP A 14 -16.677 8.391 -11.570 1.00 0.00 N ATOM 181 CA ASP A 14 -16.896 6.967 -11.385 1.00 0.00 C ATOM 182 C ASP A 14 -16.111 6.490 -10.162 1.00 0.00 C ATOM 183 O ASP A 14 -16.318 5.375 -9.683 1.00 0.00 O ATOM 184 CB ASP A 14 -16.408 6.172 -12.599 1.00 0.00 C ATOM 185 CG ASP A 14 -15.072 6.638 -13.182 1.00 0.00 C ATOM 186 OD1 ASP A 14 -14.168 7.061 -12.447 1.00 0.00 O ATOM 187 OD2 ASP A 14 -14.978 6.551 -14.466 1.00 0.00 O ATOM 0 H ASP A 14 -15.979 8.627 -12.276 1.00 0.00 H new ATOM 0 HA ASP A 14 -17.966 6.805 -11.254 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -16.318 5.123 -12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -17.167 6.227 -13.379 1.00 0.00 H new ATOM 192 N GLY A 15 -15.229 7.357 -9.689 1.00 0.00 N ATOM 193 CA GLY A 15 -14.413 7.038 -8.529 1.00 0.00 C ATOM 194 C GLY A 15 -13.258 6.110 -8.910 1.00 0.00 C ATOM 195 O GLY A 15 -12.101 6.396 -8.605 1.00 0.00 O ATOM 0 H GLY A 15 -15.061 8.281 -10.088 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -14.018 7.956 -8.094 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -15.029 6.563 -7.766 1.00 0.00 H new ATOM 199 N SER A 16 -13.612 5.019 -9.574 1.00 0.00 N ATOM 200 CA SER A 16 -12.618 4.047 -10.000 1.00 0.00 C ATOM 201 C SER A 16 -12.186 4.338 -11.438 1.00 0.00 C ATOM 202 O SER A 16 -12.926 4.959 -12.200 1.00 0.00 O ATOM 203 CB SER A 16 -13.160 2.621 -9.886 1.00 0.00 C ATOM 204 OG SER A 16 -14.530 2.538 -10.268 1.00 0.00 O ATOM 0 H SER A 16 -14.572 4.787 -9.827 1.00 0.00 H new ATOM 0 HA SER A 16 -11.752 4.131 -9.343 1.00 0.00 H new ATOM 0 HB2 SER A 16 -12.567 1.957 -10.515 1.00 0.00 H new ATOM 0 HB3 SER A 16 -13.048 2.272 -8.860 1.00 0.00 H new ATOM 0 HG SER A 16 -14.838 1.611 -10.183 1.00 0.00 H new ATOM 209 N VAL A 17 -10.988 3.875 -11.768 1.00 0.00 N ATOM 210 CA VAL A 17 -10.448 4.078 -13.102 1.00 0.00 C ATOM 211 C VAL A 17 -9.060 3.442 -13.186 1.00 0.00 C ATOM 212 O VAL A 17 -8.603 2.811 -12.235 1.00 0.00 O ATOM 213 CB VAL A 17 -10.445 5.570 -13.443 1.00 0.00 C ATOM 214 CG1 VAL A 17 -9.075 6.192 -13.169 1.00 0.00 C ATOM 215 CG2 VAL A 17 -10.871 5.800 -14.894 1.00 0.00 C ATOM 0 H VAL A 17 -10.377 3.360 -11.134 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.075 3.589 -13.848 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.172 6.063 -12.798 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -9.100 7.252 -13.420 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.826 6.074 -12.114 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.321 5.693 -13.777 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -10.861 6.868 -15.111 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.179 5.287 -15.562 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.877 5.409 -15.044 1.00 0.00 H new ATOM 225 N SER A 18 -8.427 3.630 -14.336 1.00 0.00 N ATOM 226 CA SER A 18 -7.100 3.083 -14.557 1.00 0.00 C ATOM 227 C SER A 18 -6.039 4.066 -14.061 1.00 0.00 C ATOM 228 O SER A 18 -5.668 4.997 -14.775 1.00 0.00 O ATOM 229 CB SER A 18 -6.877 2.763 -16.036 1.00 0.00 C ATOM 230 OG SER A 18 -6.618 3.935 -16.804 1.00 0.00 O ATOM 0 H SER A 18 -8.809 4.153 -15.124 1.00 0.00 H new ATOM 0 HA SER A 18 -7.015 2.153 -13.994 1.00 0.00 H new ATOM 0 HB2 SER A 18 -6.039 2.073 -16.135 1.00 0.00 H new ATOM 0 HB3 SER A 18 -7.756 2.256 -16.434 1.00 0.00 H new ATOM 0 HG SER A 18 -5.915 4.462 -16.370 1.00 0.00 H new ATOM 235 N TYR A 19 -5.580 3.827 -12.841 1.00 0.00 N ATOM 236 CA TYR A 19 -4.568 4.680 -12.241 1.00 0.00 C ATOM 237 C TYR A 19 -3.556 5.150 -13.288 1.00 0.00 C ATOM 238 O TYR A 19 -2.988 6.234 -13.165 1.00 0.00 O ATOM 239 CB TYR A 19 -3.847 3.815 -11.205 1.00 0.00 C ATOM 240 CG TYR A 19 -4.494 3.836 -9.819 1.00 0.00 C ATOM 241 CD1 TYR A 19 -5.756 4.371 -9.654 1.00 0.00 C ATOM 242 CD2 TYR A 19 -3.816 3.321 -8.733 1.00 0.00 C ATOM 243 CE1 TYR A 19 -6.366 4.392 -8.350 1.00 0.00 C ATOM 244 CE2 TYR A 19 -4.426 3.341 -7.428 1.00 0.00 C ATOM 245 CZ TYR A 19 -5.670 3.875 -7.301 1.00 0.00 C ATOM 246 OH TYR A 19 -6.245 3.895 -6.068 1.00 0.00 O ATOM 0 H TYR A 19 -5.891 3.055 -12.252 1.00 0.00 H new ATOM 0 HA TYR A 19 -5.025 5.566 -11.801 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -3.815 2.786 -11.564 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -2.815 4.154 -11.118 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.286 4.774 -10.504 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -2.828 2.903 -8.861 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -7.352 4.808 -8.208 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -3.907 2.941 -6.570 1.00 0.00 H new ATOM 0 HH TYR A 19 -7.142 3.503 -6.119 1.00 0.00 H new ATOM 255 N GLU A 20 -3.362 4.311 -14.295 1.00 0.00 N ATOM 256 CA GLU A 20 -2.428 4.627 -15.362 1.00 0.00 C ATOM 257 C GLU A 20 -2.603 6.080 -15.809 1.00 0.00 C ATOM 258 O GLU A 20 -1.624 6.773 -16.078 1.00 0.00 O ATOM 259 CB GLU A 20 -2.598 3.667 -16.542 1.00 0.00 C ATOM 260 CG GLU A 20 -1.459 3.830 -17.550 1.00 0.00 C ATOM 261 CD GLU A 20 -1.989 4.314 -18.902 1.00 0.00 C ATOM 262 OE1 GLU A 20 -1.966 5.523 -19.179 1.00 0.00 O ATOM 263 OE2 GLU A 20 -2.434 3.385 -19.677 1.00 0.00 O ATOM 0 H GLU A 20 -3.836 3.413 -14.394 1.00 0.00 H new ATOM 0 HA GLU A 20 -1.415 4.505 -14.979 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -2.623 2.640 -16.179 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -3.553 3.854 -17.033 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -0.728 4.541 -17.166 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -0.942 2.879 -17.677 1.00 0.00 H new ATOM 269 N GLU A 21 -3.859 6.499 -15.872 1.00 0.00 N ATOM 270 CA GLU A 21 -4.175 7.857 -16.280 1.00 0.00 C ATOM 271 C GLU A 21 -3.733 8.851 -15.205 1.00 0.00 C ATOM 272 O GLU A 21 -3.332 9.971 -15.517 1.00 0.00 O ATOM 273 CB GLU A 21 -5.668 8.005 -16.584 1.00 0.00 C ATOM 274 CG GLU A 21 -6.473 8.189 -15.296 1.00 0.00 C ATOM 275 CD GLU A 21 -7.965 7.960 -15.545 1.00 0.00 C ATOM 276 OE1 GLU A 21 -8.774 8.879 -15.350 1.00 0.00 O ATOM 277 OE2 GLU A 21 -8.275 6.777 -15.957 1.00 0.00 O ATOM 0 H GLU A 21 -4.669 5.922 -15.647 1.00 0.00 H new ATOM 0 HA GLU A 21 -3.628 8.077 -17.197 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.826 8.860 -17.241 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.024 7.123 -17.117 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -6.116 7.493 -14.537 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.316 9.194 -14.905 1.00 0.00 H new ATOM 283 N VAL A 22 -3.821 8.406 -13.960 1.00 0.00 N ATOM 284 CA VAL A 22 -3.435 9.242 -12.837 1.00 0.00 C ATOM 285 C VAL A 22 -1.914 9.207 -12.680 1.00 0.00 C ATOM 286 O VAL A 22 -1.315 10.167 -12.198 1.00 0.00 O ATOM 287 CB VAL A 22 -4.177 8.799 -11.575 1.00 0.00 C ATOM 288 CG1 VAL A 22 -3.297 7.892 -10.712 1.00 0.00 C ATOM 289 CG2 VAL A 22 -4.671 10.005 -10.775 1.00 0.00 C ATOM 0 H VAL A 22 -4.154 7.476 -13.705 1.00 0.00 H new ATOM 0 HA VAL A 22 -3.719 10.279 -13.017 1.00 0.00 H new ATOM 0 HB VAL A 22 -5.050 8.224 -11.885 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -3.848 7.591 -9.821 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.018 7.006 -11.282 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -2.397 8.432 -10.417 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -5.195 9.660 -9.883 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -3.820 10.620 -10.481 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.351 10.596 -11.389 1.00 0.00 H new ATOM 299 N LYS A 23 -1.334 8.092 -13.096 1.00 0.00 N ATOM 300 CA LYS A 23 0.107 7.919 -13.007 1.00 0.00 C ATOM 301 C LYS A 23 0.794 8.920 -13.938 1.00 0.00 C ATOM 302 O LYS A 23 1.822 9.496 -13.586 1.00 0.00 O ATOM 303 CB LYS A 23 0.489 6.463 -13.279 1.00 0.00 C ATOM 304 CG LYS A 23 0.587 5.669 -11.974 1.00 0.00 C ATOM 305 CD LYS A 23 1.615 6.294 -11.028 1.00 0.00 C ATOM 306 CE LYS A 23 0.941 6.837 -9.766 1.00 0.00 C ATOM 307 NZ LYS A 23 1.446 8.191 -9.450 1.00 0.00 N ATOM 0 H LYS A 23 -1.835 7.299 -13.496 1.00 0.00 H new ATOM 0 HA LYS A 23 0.455 8.132 -11.996 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -0.253 6.005 -13.933 1.00 0.00 H new ATOM 0 HB3 LYS A 23 1.443 6.426 -13.804 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -0.388 5.639 -11.488 1.00 0.00 H new ATOM 0 HG3 LYS A 23 0.867 4.638 -12.191 1.00 0.00 H new ATOM 0 HD2 LYS A 23 2.362 5.549 -10.754 1.00 0.00 H new ATOM 0 HD3 LYS A 23 2.141 7.100 -11.539 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -0.139 6.870 -9.909 1.00 0.00 H new ATOM 0 HE3 LYS A 23 1.132 6.167 -8.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 1.303 8.388 -8.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 2.461 8.244 -9.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 0.930 8.895 -10.016 1.00 0.00 H new ATOM 317 N ALA A 24 0.198 9.095 -15.109 1.00 0.00 N ATOM 318 CA ALA A 24 0.740 10.017 -16.093 1.00 0.00 C ATOM 319 C ALA A 24 0.398 11.451 -15.687 1.00 0.00 C ATOM 320 O ALA A 24 1.254 12.334 -15.730 1.00 0.00 O ATOM 321 CB ALA A 24 0.200 9.658 -17.479 1.00 0.00 C ATOM 0 H ALA A 24 -0.654 8.614 -15.398 1.00 0.00 H new ATOM 0 HA ALA A 24 1.826 9.938 -16.135 1.00 0.00 H new ATOM 0 HB1 ALA A 24 0.606 10.349 -18.218 1.00 0.00 H new ATOM 0 HB2 ALA A 24 0.497 8.640 -17.733 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -0.888 9.729 -17.475 1.00 0.00 H new ATOM 327 N PHE A 25 -0.856 11.639 -15.301 1.00 0.00 N ATOM 328 CA PHE A 25 -1.322 12.952 -14.887 1.00 0.00 C ATOM 329 C PHE A 25 -0.388 13.560 -13.839 1.00 0.00 C ATOM 330 O PHE A 25 -0.062 14.744 -13.905 1.00 0.00 O ATOM 331 CB PHE A 25 -2.707 12.759 -14.268 1.00 0.00 C ATOM 332 CG PHE A 25 -2.886 13.452 -12.915 1.00 0.00 C ATOM 333 CD1 PHE A 25 -2.936 14.810 -12.848 1.00 0.00 C ATOM 334 CD2 PHE A 25 -2.996 12.711 -11.781 1.00 0.00 C ATOM 335 CE1 PHE A 25 -3.101 15.453 -11.593 1.00 0.00 C ATOM 336 CE2 PHE A 25 -3.161 13.354 -10.525 1.00 0.00 C ATOM 337 CZ PHE A 25 -3.211 14.711 -10.458 1.00 0.00 C ATOM 0 H PHE A 25 -1.563 10.905 -15.266 1.00 0.00 H new ATOM 0 HA PHE A 25 -1.349 13.625 -15.744 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -3.459 13.137 -14.961 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -2.894 11.692 -14.146 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -2.850 15.399 -13.749 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -2.958 11.633 -11.835 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -3.139 16.531 -11.539 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -3.247 12.765 -9.624 1.00 0.00 H new ATOM 0 HZ PHE A 25 -3.338 15.200 -9.504 1.00 0.00 H new ATOM 346 N VAL A 26 0.016 12.722 -12.895 1.00 0.00 N ATOM 347 CA VAL A 26 0.906 13.162 -11.835 1.00 0.00 C ATOM 348 C VAL A 26 2.340 13.216 -12.367 1.00 0.00 C ATOM 349 O VAL A 26 3.098 14.124 -12.030 1.00 0.00 O ATOM 350 CB VAL A 26 0.756 12.252 -10.614 1.00 0.00 C ATOM 351 CG1 VAL A 26 2.008 12.301 -9.736 1.00 0.00 C ATOM 352 CG2 VAL A 26 -0.493 12.618 -9.809 1.00 0.00 C ATOM 0 H VAL A 26 -0.257 11.741 -12.843 1.00 0.00 H new ATOM 0 HA VAL A 26 0.642 14.168 -11.509 1.00 0.00 H new ATOM 0 HB VAL A 26 0.638 11.229 -10.971 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.875 11.645 -8.875 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.871 11.970 -10.314 1.00 0.00 H new ATOM 0 HG13 VAL A 26 2.172 13.322 -9.392 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.577 11.957 -8.947 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.417 13.651 -9.468 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.376 12.508 -10.438 1.00 0.00 H new ATOM 362 N SER A 27 2.669 12.230 -13.190 1.00 0.00 N ATOM 363 CA SER A 27 3.999 12.153 -13.772 1.00 0.00 C ATOM 364 C SER A 27 4.327 13.459 -14.498 1.00 0.00 C ATOM 365 O SER A 27 5.496 13.816 -14.640 1.00 0.00 O ATOM 366 CB SER A 27 4.111 10.968 -14.733 1.00 0.00 C ATOM 367 OG SER A 27 5.422 10.844 -15.277 1.00 0.00 O ATOM 0 H SER A 27 2.038 11.478 -13.467 1.00 0.00 H new ATOM 0 HA SER A 27 4.718 12.002 -12.967 1.00 0.00 H new ATOM 0 HB2 SER A 27 3.848 10.050 -14.208 1.00 0.00 H new ATOM 0 HB3 SER A 27 3.392 11.089 -15.543 1.00 0.00 H new ATOM 0 HG SER A 27 5.699 9.904 -15.252 1.00 0.00 H new ATOM 372 N SER A 28 3.276 14.134 -14.940 1.00 0.00 N ATOM 373 CA SER A 28 3.440 15.393 -15.649 1.00 0.00 C ATOM 374 C SER A 28 3.260 16.564 -14.682 1.00 0.00 C ATOM 375 O SER A 28 2.643 17.570 -15.028 1.00 0.00 O ATOM 376 CB SER A 28 2.447 15.503 -16.808 1.00 0.00 C ATOM 377 OG SER A 28 2.880 16.440 -17.793 1.00 0.00 O ATOM 0 H SER A 28 2.308 13.834 -14.821 1.00 0.00 H new ATOM 0 HA SER A 28 4.447 15.425 -16.064 1.00 0.00 H new ATOM 0 HB2 SER A 28 2.318 14.524 -17.270 1.00 0.00 H new ATOM 0 HB3 SER A 28 1.473 15.805 -16.424 1.00 0.00 H new ATOM 0 HG SER A 28 3.025 17.313 -17.372 1.00 0.00 H new ATOM 382 N LYS A 29 3.812 16.395 -13.489 1.00 0.00 N ATOM 383 CA LYS A 29 3.720 17.427 -12.470 1.00 0.00 C ATOM 384 C LYS A 29 5.069 17.555 -11.758 1.00 0.00 C ATOM 385 O LYS A 29 5.966 18.246 -12.239 1.00 0.00 O ATOM 386 CB LYS A 29 2.550 17.144 -11.525 1.00 0.00 C ATOM 387 CG LYS A 29 1.370 18.072 -11.820 1.00 0.00 C ATOM 388 CD LYS A 29 1.402 19.305 -10.914 1.00 0.00 C ATOM 389 CE LYS A 29 0.688 20.488 -11.571 1.00 0.00 C ATOM 390 NZ LYS A 29 1.506 21.716 -11.455 1.00 0.00 N ATOM 0 H LYS A 29 4.324 15.560 -13.206 1.00 0.00 H new ATOM 0 HA LYS A 29 3.505 18.394 -12.925 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.236 16.106 -11.630 1.00 0.00 H new ATOM 0 HB3 LYS A 29 2.872 17.276 -10.492 1.00 0.00 H new ATOM 0 HG2 LYS A 29 1.399 18.383 -12.864 1.00 0.00 H new ATOM 0 HG3 LYS A 29 0.434 17.533 -11.674 1.00 0.00 H new ATOM 0 HD2 LYS A 29 0.927 19.073 -9.961 1.00 0.00 H new ATOM 0 HD3 LYS A 29 2.436 19.575 -10.697 1.00 0.00 H new ATOM 0 HE2 LYS A 29 0.498 20.268 -12.622 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.282 20.644 -11.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 1.007 22.509 -11.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 1.665 21.933 -10.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 2.421 21.569 -11.927 1.00 0.00 H new ATOM 400 N ARG A 30 5.170 16.878 -10.623 1.00 0.00 N ATOM 401 CA ARG A 30 6.393 16.908 -9.841 1.00 0.00 C ATOM 402 C ARG A 30 7.407 15.910 -10.403 1.00 0.00 C ATOM 403 O ARG A 30 8.538 16.278 -10.717 1.00 0.00 O ATOM 404 CB ARG A 30 6.116 16.572 -8.374 1.00 0.00 C ATOM 405 CG ARG A 30 6.198 17.826 -7.500 1.00 0.00 C ATOM 406 CD ARG A 30 7.483 17.834 -6.671 1.00 0.00 C ATOM 407 NE ARG A 30 7.467 16.718 -5.700 1.00 0.00 N ATOM 408 CZ ARG A 30 8.302 16.617 -4.657 1.00 0.00 C ATOM 409 NH1 ARG A 30 9.225 17.564 -4.444 1.00 0.00 N ATOM 410 NH2 ARG A 30 8.214 15.568 -3.828 1.00 0.00 N ATOM 0 H ARG A 30 4.424 16.306 -10.227 1.00 0.00 H new ATOM 0 HA ARG A 30 6.801 17.917 -9.901 1.00 0.00 H new ATOM 0 HB2 ARG A 30 5.127 16.123 -8.280 1.00 0.00 H new ATOM 0 HB3 ARG A 30 6.836 15.833 -8.024 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.162 18.715 -8.129 1.00 0.00 H new ATOM 0 HG3 ARG A 30 5.333 17.869 -6.838 1.00 0.00 H new ATOM 0 HD2 ARG A 30 8.349 17.744 -7.327 1.00 0.00 H new ATOM 0 HD3 ARG A 30 7.580 18.783 -6.144 1.00 0.00 H new ATOM 0 HE ARG A 30 6.777 15.979 -5.833 1.00 0.00 H new ATOM 0 HH11 ARG A 30 9.292 18.362 -5.076 1.00 0.00 H new ATOM 0 HH12 ARG A 30 9.861 17.487 -3.650 1.00 0.00 H new ATOM 0 HH21 ARG A 30 7.512 14.847 -3.991 1.00 0.00 H new ATOM 0 HH22 ARG A 30 8.850 15.491 -3.034 1.00 0.00 H new ATOM 421 N PRO A 31 6.954 14.632 -10.515 1.00 0.00 N ATOM 422 CA PRO A 31 7.810 13.578 -11.033 1.00 0.00 C ATOM 423 C PRO A 31 7.963 13.693 -12.551 1.00 0.00 C ATOM 424 O PRO A 31 7.696 14.747 -13.127 1.00 0.00 O ATOM 425 CB PRO A 31 7.143 12.282 -10.600 1.00 0.00 C ATOM 426 CG PRO A 31 5.706 12.645 -10.261 1.00 0.00 C ATOM 427 CD PRO A 31 5.622 14.159 -10.151 1.00 0.00 C ATOM 0 HA PRO A 31 8.828 13.635 -10.648 1.00 0.00 H new ATOM 0 HB2 PRO A 31 7.180 11.539 -11.396 1.00 0.00 H new ATOM 0 HB3 PRO A 31 7.651 11.851 -9.737 1.00 0.00 H new ATOM 0 HG2 PRO A 31 5.028 12.280 -11.032 1.00 0.00 H new ATOM 0 HG3 PRO A 31 5.405 12.177 -9.324 1.00 0.00 H new ATOM 0 HD2 PRO A 31 4.862 14.563 -10.820 1.00 0.00 H new ATOM 0 HD3 PRO A 31 5.354 14.468 -9.141 1.00 0.00 H new ATOM 432 N ILE A 32 8.390 12.594 -13.156 1.00 0.00 N ATOM 433 CA ILE A 32 8.582 12.559 -14.596 1.00 0.00 C ATOM 434 C ILE A 32 8.710 11.104 -15.053 1.00 0.00 C ATOM 435 O ILE A 32 8.129 10.714 -16.065 1.00 0.00 O ATOM 436 CB ILE A 32 9.768 13.437 -15.000 1.00 0.00 C ATOM 437 CG1 ILE A 32 9.525 14.092 -16.361 1.00 0.00 C ATOM 438 CG2 ILE A 32 11.074 12.641 -14.971 1.00 0.00 C ATOM 439 CD1 ILE A 32 9.860 13.129 -17.501 1.00 0.00 C ATOM 0 H ILE A 32 8.608 11.721 -12.675 1.00 0.00 H new ATOM 0 HA ILE A 32 7.716 12.980 -15.107 1.00 0.00 H new ATOM 0 HB ILE A 32 9.865 14.240 -14.269 1.00 0.00 H new ATOM 0 HG12 ILE A 32 8.483 14.403 -16.438 1.00 0.00 H new ATOM 0 HG13 ILE A 32 10.134 14.992 -16.449 1.00 0.00 H new ATOM 0 HG21 ILE A 32 11.901 13.288 -15.262 1.00 0.00 H new ATOM 0 HG22 ILE A 32 11.247 12.262 -13.964 1.00 0.00 H new ATOM 0 HG23 ILE A 32 11.006 11.804 -15.666 1.00 0.00 H new ATOM 0 HD11 ILE A 32 9.678 13.620 -18.457 1.00 0.00 H new ATOM 0 HD12 ILE A 32 10.909 12.839 -17.436 1.00 0.00 H new ATOM 0 HD13 ILE A 32 9.232 12.241 -17.424 1.00 0.00 H new ATOM 450 N LYS A 33 9.473 10.340 -14.285 1.00 0.00 N ATOM 451 CA LYS A 33 9.685 8.938 -14.599 1.00 0.00 C ATOM 452 C LYS A 33 9.367 8.091 -13.365 1.00 0.00 C ATOM 453 O LYS A 33 9.971 8.273 -12.310 1.00 0.00 O ATOM 454 CB LYS A 33 11.095 8.718 -15.149 1.00 0.00 C ATOM 455 CG LYS A 33 11.156 9.038 -16.644 1.00 0.00 C ATOM 456 CD LYS A 33 12.185 8.153 -17.352 1.00 0.00 C ATOM 457 CE LYS A 33 11.573 7.479 -18.582 1.00 0.00 C ATOM 458 NZ LYS A 33 12.560 7.418 -19.684 1.00 0.00 N ATOM 0 H LYS A 33 9.952 10.666 -13.446 1.00 0.00 H new ATOM 0 HA LYS A 33 9.007 8.618 -15.390 1.00 0.00 H new ATOM 0 HB2 LYS A 33 11.802 9.348 -14.609 1.00 0.00 H new ATOM 0 HB3 LYS A 33 11.397 7.684 -14.982 1.00 0.00 H new ATOM 0 HG2 LYS A 33 10.173 8.889 -17.092 1.00 0.00 H new ATOM 0 HG3 LYS A 33 11.415 10.087 -16.785 1.00 0.00 H new ATOM 0 HD2 LYS A 33 13.043 8.755 -17.652 1.00 0.00 H new ATOM 0 HD3 LYS A 33 12.553 7.394 -16.662 1.00 0.00 H new ATOM 0 HE2 LYS A 33 11.242 6.472 -18.326 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.691 8.032 -18.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 12.129 6.958 -20.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 12.856 8.382 -19.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 13.390 6.871 -19.377 1.00 0.00 H new ATOM 468 N ASN A 34 8.418 7.181 -13.539 1.00 0.00 N ATOM 469 CA ASN A 34 8.013 6.306 -12.454 1.00 0.00 C ATOM 470 C ASN A 34 6.610 5.765 -12.737 1.00 0.00 C ATOM 471 O ASN A 34 6.239 4.701 -12.241 1.00 0.00 O ATOM 472 CB ASN A 34 7.969 7.060 -11.124 1.00 0.00 C ATOM 473 CG ASN A 34 9.126 6.640 -10.215 1.00 0.00 C ATOM 474 OD1 ASN A 34 8.939 5.470 -9.609 1.00 0.00 O flip ATOM 475 ND2 ASN A 34 10.122 7.330 -10.075 1.00 0.00 N flip ATOM 0 H ASN A 34 7.919 7.032 -14.416 1.00 0.00 H new ATOM 0 HA ASN A 34 8.740 5.497 -12.385 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.019 8.133 -11.309 1.00 0.00 H new ATOM 0 HB3 ASN A 34 7.020 6.866 -10.624 1.00 0.00 H new ATOM 0 HD21 ASN A 34 10.201 8.218 -10.570 1.00 0.00 H new ATOM 0 HD22 ASN A 34 10.876 7.019 -9.463 1.00 0.00 H new ATOM 481 N GLU A 35 5.868 6.521 -13.533 1.00 0.00 N ATOM 482 CA GLU A 35 4.515 6.131 -13.887 1.00 0.00 C ATOM 483 C GLU A 35 4.493 4.687 -14.394 1.00 0.00 C ATOM 484 O GLU A 35 3.466 4.016 -14.324 1.00 0.00 O ATOM 485 CB GLU A 35 3.924 7.085 -14.927 1.00 0.00 C ATOM 486 CG GLU A 35 4.704 7.016 -16.242 1.00 0.00 C ATOM 487 CD GLU A 35 4.919 8.413 -16.827 1.00 0.00 C ATOM 488 OE1 GLU A 35 4.012 8.961 -17.472 1.00 0.00 O ATOM 489 OE2 GLU A 35 6.075 8.932 -16.590 1.00 0.00 O ATOM 0 H GLU A 35 6.179 7.402 -13.943 1.00 0.00 H new ATOM 0 HA GLU A 35 3.895 6.191 -12.992 1.00 0.00 H new ATOM 0 HB2 GLU A 35 2.879 6.831 -15.106 1.00 0.00 H new ATOM 0 HB3 GLU A 35 3.943 8.105 -14.542 1.00 0.00 H new ATOM 0 HG2 GLU A 35 5.668 6.537 -16.072 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.163 6.398 -16.958 1.00 0.00 H new ATOM 495 N GLN A 36 5.641 4.252 -14.894 1.00 0.00 N ATOM 496 CA GLN A 36 5.768 2.902 -15.412 1.00 0.00 C ATOM 497 C GLN A 36 5.814 1.894 -14.261 1.00 0.00 C ATOM 498 O GLN A 36 4.871 1.129 -14.064 1.00 0.00 O ATOM 499 CB GLN A 36 7.003 2.769 -16.306 1.00 0.00 C ATOM 500 CG GLN A 36 6.961 1.470 -17.111 1.00 0.00 C ATOM 501 CD GLN A 36 6.056 1.612 -18.336 1.00 0.00 C ATOM 502 OE1 GLN A 36 6.251 2.462 -19.190 1.00 0.00 O ATOM 503 NE2 GLN A 36 5.056 0.736 -18.375 1.00 0.00 N ATOM 0 H GLN A 36 6.492 4.812 -14.951 1.00 0.00 H new ATOM 0 HA GLN A 36 4.893 2.686 -16.025 1.00 0.00 H new ATOM 0 HB2 GLN A 36 7.058 3.620 -16.985 1.00 0.00 H new ATOM 0 HB3 GLN A 36 7.904 2.792 -15.693 1.00 0.00 H new ATOM 0 HG2 GLN A 36 7.969 1.202 -17.428 1.00 0.00 H new ATOM 0 HG3 GLN A 36 6.599 0.658 -16.480 1.00 0.00 H new ATOM 0 HE21 GLN A 36 4.949 0.050 -17.628 1.00 0.00 H new ATOM 0 HE22 GLN A 36 4.396 0.750 -19.152 1.00 0.00 H new ATOM 510 N LEU A 37 6.920 1.925 -13.533 1.00 0.00 N ATOM 511 CA LEU A 37 7.101 1.026 -12.408 1.00 0.00 C ATOM 512 C LEU A 37 5.828 1.014 -11.558 1.00 0.00 C ATOM 513 O LEU A 37 5.313 -0.048 -11.218 1.00 0.00 O ATOM 514 CB LEU A 37 8.361 1.395 -11.623 1.00 0.00 C ATOM 515 CG LEU A 37 9.657 0.722 -12.080 1.00 0.00 C ATOM 516 CD1 LEU A 37 10.850 1.668 -11.925 1.00 0.00 C ATOM 517 CD2 LEU A 37 9.876 -0.602 -11.345 1.00 0.00 C ATOM 0 H LEU A 37 7.701 2.560 -13.701 1.00 0.00 H new ATOM 0 HA LEU A 37 7.260 0.006 -12.759 1.00 0.00 H new ATOM 0 HB2 LEU A 37 8.497 2.475 -11.679 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.197 1.148 -10.574 1.00 0.00 H new ATOM 0 HG LEU A 37 9.566 0.490 -13.141 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.758 1.165 -12.257 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.688 2.560 -12.530 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.955 1.953 -10.878 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.804 -1.060 -11.688 1.00 0.00 H new ATOM 0 HD22 LEU A 37 9.938 -0.417 -10.273 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.043 -1.274 -11.550 1.00 0.00 H new ATOM 528 N LEU A 38 5.358 2.213 -11.239 1.00 0.00 N ATOM 529 CA LEU A 38 4.156 2.354 -10.435 1.00 0.00 C ATOM 530 C LEU A 38 2.985 1.681 -11.154 1.00 0.00 C ATOM 531 O LEU A 38 2.501 0.638 -10.717 1.00 0.00 O ATOM 532 CB LEU A 38 3.907 3.826 -10.100 1.00 0.00 C ATOM 533 CG LEU A 38 4.854 4.449 -9.071 1.00 0.00 C ATOM 534 CD1 LEU A 38 4.674 5.967 -9.009 1.00 0.00 C ATOM 535 CD2 LEU A 38 4.681 3.794 -7.699 1.00 0.00 C ATOM 0 H LEU A 38 5.788 3.093 -11.523 1.00 0.00 H new ATOM 0 HA LEU A 38 4.276 1.848 -9.477 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.973 4.404 -11.022 1.00 0.00 H new ATOM 0 HB3 LEU A 38 2.886 3.927 -9.733 1.00 0.00 H new ATOM 0 HG LEU A 38 5.879 4.259 -9.391 1.00 0.00 H new ATOM 0 HD11 LEU A 38 5.358 6.385 -8.271 1.00 0.00 H new ATOM 0 HD12 LEU A 38 4.887 6.399 -9.987 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.648 6.200 -8.726 1.00 0.00 H new ATOM 0 HD21 LEU A 38 5.365 4.255 -6.987 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.655 3.931 -7.357 1.00 0.00 H new ATOM 0 HD23 LEU A 38 4.899 2.729 -7.774 1.00 0.00 H new ATOM 546 N GLN A 39 2.565 2.304 -12.245 1.00 0.00 N ATOM 547 CA GLN A 39 1.460 1.779 -13.029 1.00 0.00 C ATOM 548 C GLN A 39 1.522 0.251 -13.075 1.00 0.00 C ATOM 549 O GLN A 39 0.503 -0.421 -12.918 1.00 0.00 O ATOM 550 CB GLN A 39 1.457 2.371 -14.439 1.00 0.00 C ATOM 551 CG GLN A 39 0.333 1.768 -15.285 1.00 0.00 C ATOM 552 CD GLN A 39 0.867 0.656 -16.191 1.00 0.00 C ATOM 553 OE1 GLN A 39 0.994 -0.493 -15.799 1.00 0.00 O ATOM 554 NE2 GLN A 39 1.169 1.059 -17.422 1.00 0.00 N ATOM 0 H GLN A 39 2.970 3.168 -12.605 1.00 0.00 H new ATOM 0 HA GLN A 39 0.527 2.071 -12.547 1.00 0.00 H new ATOM 0 HB2 GLN A 39 1.334 3.453 -14.383 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.418 2.184 -14.918 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -0.444 1.369 -14.633 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -0.128 2.547 -15.892 1.00 0.00 H new ATOM 0 HE21 GLN A 39 1.039 2.036 -17.685 1.00 0.00 H new ATOM 0 HE22 GLN A 39 1.531 0.391 -18.103 1.00 0.00 H new ATOM 561 N LEU A 40 2.728 -0.254 -13.293 1.00 0.00 N ATOM 562 CA LEU A 40 2.936 -1.690 -13.362 1.00 0.00 C ATOM 563 C LEU A 40 2.521 -2.327 -12.034 1.00 0.00 C ATOM 564 O LEU A 40 1.509 -3.022 -11.965 1.00 0.00 O ATOM 565 CB LEU A 40 4.377 -2.003 -13.770 1.00 0.00 C ATOM 566 CG LEU A 40 4.551 -2.768 -15.085 1.00 0.00 C ATOM 567 CD1 LEU A 40 5.762 -2.249 -15.864 1.00 0.00 C ATOM 568 CD2 LEU A 40 4.633 -4.275 -14.836 1.00 0.00 C ATOM 0 H LEU A 40 3.570 0.306 -13.424 1.00 0.00 H new ATOM 0 HA LEU A 40 2.307 -2.129 -14.136 1.00 0.00 H new ATOM 0 HB2 LEU A 40 4.925 -1.064 -13.844 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.842 -2.581 -12.972 1.00 0.00 H new ATOM 0 HG LEU A 40 3.670 -2.591 -15.702 1.00 0.00 H new ATOM 0 HD11 LEU A 40 5.864 -2.809 -16.794 1.00 0.00 H new ATOM 0 HD12 LEU A 40 5.623 -1.192 -16.090 1.00 0.00 H new ATOM 0 HD13 LEU A 40 6.663 -2.376 -15.264 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.756 -4.795 -15.786 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.484 -4.491 -14.191 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.717 -4.614 -14.353 1.00 0.00 H new ATOM 579 N ILE A 41 3.324 -2.065 -11.014 1.00 0.00 N ATOM 580 CA ILE A 41 3.053 -2.604 -9.691 1.00 0.00 C ATOM 581 C ILE A 41 1.557 -2.481 -9.392 1.00 0.00 C ATOM 582 O ILE A 41 0.920 -3.453 -8.989 1.00 0.00 O ATOM 583 CB ILE A 41 3.946 -1.933 -8.646 1.00 0.00 C ATOM 584 CG1 ILE A 41 4.471 -2.956 -7.635 1.00 0.00 C ATOM 585 CG2 ILE A 41 3.216 -0.775 -7.963 1.00 0.00 C ATOM 586 CD1 ILE A 41 5.812 -2.509 -7.050 1.00 0.00 C ATOM 0 H ILE A 41 4.162 -1.487 -11.076 1.00 0.00 H new ATOM 0 HA ILE A 41 3.300 -3.665 -9.654 1.00 0.00 H new ATOM 0 HB ILE A 41 4.812 -1.511 -9.157 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.745 -3.085 -6.832 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.586 -3.926 -8.120 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.873 -0.315 -7.225 1.00 0.00 H new ATOM 0 HG22 ILE A 41 2.933 -0.033 -8.709 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.321 -1.151 -7.468 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.163 -3.253 -6.335 1.00 0.00 H new ATOM 0 HD12 ILE A 41 6.542 -2.404 -7.852 1.00 0.00 H new ATOM 0 HD13 ILE A 41 5.688 -1.551 -6.545 1.00 0.00 H new ATOM 597 N PHE A 42 1.041 -1.279 -9.603 1.00 0.00 N ATOM 598 CA PHE A 42 -0.367 -1.018 -9.361 1.00 0.00 C ATOM 599 C PHE A 42 -1.249 -2.002 -10.132 1.00 0.00 C ATOM 600 O PHE A 42 -2.058 -2.713 -9.539 1.00 0.00 O ATOM 601 CB PHE A 42 -0.651 0.401 -9.859 1.00 0.00 C ATOM 602 CG PHE A 42 -0.516 1.478 -8.781 1.00 0.00 C ATOM 603 CD1 PHE A 42 -1.331 1.456 -7.692 1.00 0.00 C ATOM 604 CD2 PHE A 42 0.418 2.457 -8.911 1.00 0.00 C ATOM 605 CE1 PHE A 42 -1.206 2.455 -6.691 1.00 0.00 C ATOM 606 CE2 PHE A 42 0.543 3.457 -7.910 1.00 0.00 C ATOM 607 CZ PHE A 42 -0.272 3.435 -6.821 1.00 0.00 C ATOM 0 H PHE A 42 1.573 -0.476 -9.939 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.588 -1.129 -8.299 1.00 0.00 H new ATOM 0 HB2 PHE A 42 0.033 0.632 -10.676 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -1.661 0.436 -10.268 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -2.073 0.678 -7.589 1.00 0.00 H new ATOM 0 HD2 PHE A 42 1.065 2.475 -9.775 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -1.853 2.437 -5.826 1.00 0.00 H new ATOM 0 HE2 PHE A 42 1.285 4.235 -8.013 1.00 0.00 H new ATOM 0 HZ PHE A 42 -0.177 4.195 -6.060 1.00 0.00 H new ATOM 616 N LYS A 43 -1.062 -2.011 -11.444 1.00 0.00 N ATOM 617 CA LYS A 43 -1.829 -2.897 -12.303 1.00 0.00 C ATOM 618 C LYS A 43 -1.888 -4.289 -11.671 1.00 0.00 C ATOM 619 O LYS A 43 -2.931 -4.941 -11.693 1.00 0.00 O ATOM 620 CB LYS A 43 -1.261 -2.890 -13.724 1.00 0.00 C ATOM 621 CG LYS A 43 -1.743 -1.663 -14.501 1.00 0.00 C ATOM 622 CD LYS A 43 -3.271 -1.598 -14.531 1.00 0.00 C ATOM 623 CE LYS A 43 -3.776 -1.226 -15.926 1.00 0.00 C ATOM 624 NZ LYS A 43 -3.986 -2.442 -16.743 1.00 0.00 N ATOM 0 H LYS A 43 -0.391 -1.419 -11.933 1.00 0.00 H new ATOM 0 HA LYS A 43 -2.856 -2.544 -12.393 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -0.172 -2.895 -13.684 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -1.565 -3.798 -14.245 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -1.346 -0.758 -14.041 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -1.357 -1.699 -15.520 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -3.686 -2.562 -14.235 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -3.622 -0.864 -13.806 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -4.710 -0.670 -15.845 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -3.056 -0.571 -16.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.329 -2.171 -17.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -3.087 -2.957 -16.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -4.690 -3.053 -16.281 1.00 0.00 H new ATOM 634 N ALA A 44 -0.756 -4.704 -11.123 1.00 0.00 N ATOM 635 CA ALA A 44 -0.666 -6.006 -10.486 1.00 0.00 C ATOM 636 C ALA A 44 -1.246 -5.920 -9.073 1.00 0.00 C ATOM 637 O ALA A 44 -1.781 -6.901 -8.557 1.00 0.00 O ATOM 638 CB ALA A 44 0.791 -6.477 -10.489 1.00 0.00 C ATOM 0 H ALA A 44 0.107 -4.161 -11.107 1.00 0.00 H new ATOM 0 HA ALA A 44 -1.249 -6.743 -11.038 1.00 0.00 H new ATOM 0 HB1 ALA A 44 0.858 -7.454 -10.011 1.00 0.00 H new ATOM 0 HB2 ALA A 44 1.148 -6.550 -11.516 1.00 0.00 H new ATOM 0 HB3 ALA A 44 1.406 -5.762 -9.942 1.00 0.00 H new ATOM 644 N ILE A 45 -1.123 -4.737 -8.488 1.00 0.00 N ATOM 645 CA ILE A 45 -1.630 -4.511 -7.145 1.00 0.00 C ATOM 646 C ILE A 45 -3.159 -4.530 -7.172 1.00 0.00 C ATOM 647 O ILE A 45 -3.801 -4.574 -6.123 1.00 0.00 O ATOM 648 CB ILE A 45 -1.041 -3.224 -6.561 1.00 0.00 C ATOM 649 CG1 ILE A 45 -0.425 -3.480 -5.184 1.00 0.00 C ATOM 650 CG2 ILE A 45 -2.090 -2.110 -6.522 1.00 0.00 C ATOM 651 CD1 ILE A 45 1.086 -3.697 -5.291 1.00 0.00 C ATOM 0 H ILE A 45 -0.680 -3.926 -8.919 1.00 0.00 H new ATOM 0 HA ILE A 45 -1.313 -5.312 -6.477 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.238 -2.887 -7.216 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -0.629 -2.634 -4.527 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.890 -4.355 -4.730 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.646 -1.207 -6.103 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -2.442 -1.906 -7.533 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.930 -2.423 -5.902 1.00 0.00 H new ATOM 0 HD11 ILE A 45 1.499 -3.877 -4.298 1.00 0.00 H new ATOM 0 HD12 ILE A 45 1.286 -4.558 -5.929 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.551 -2.811 -5.722 1.00 0.00 H new ATOM 662 N ASP A 46 -3.699 -4.498 -8.381 1.00 0.00 N ATOM 663 CA ASP A 46 -5.141 -4.512 -8.558 1.00 0.00 C ATOM 664 C ASP A 46 -5.595 -5.931 -8.905 1.00 0.00 C ATOM 665 O ASP A 46 -5.897 -6.724 -8.017 1.00 0.00 O ATOM 666 CB ASP A 46 -5.565 -3.587 -9.701 1.00 0.00 C ATOM 667 CG ASP A 46 -7.018 -3.742 -10.153 1.00 0.00 C ATOM 668 OD1 ASP A 46 -7.345 -4.624 -10.961 1.00 0.00 O ATOM 669 OD2 ASP A 46 -7.843 -2.898 -9.633 1.00 0.00 O ATOM 0 H ASP A 46 -3.163 -4.462 -9.248 1.00 0.00 H new ATOM 0 HA ASP A 46 -5.597 -4.170 -7.629 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -5.405 -2.554 -9.391 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -4.913 -3.768 -10.556 1.00 0.00 H new ATOM 674 N ILE A 47 -5.626 -6.207 -10.202 1.00 0.00 N ATOM 675 CA ILE A 47 -6.037 -7.517 -10.677 1.00 0.00 C ATOM 676 C ILE A 47 -7.199 -8.024 -9.821 1.00 0.00 C ATOM 677 O ILE A 47 -7.365 -9.230 -9.645 1.00 0.00 O ATOM 678 CB ILE A 47 -4.842 -8.472 -10.718 1.00 0.00 C ATOM 679 CG1 ILE A 47 -3.656 -7.835 -11.446 1.00 0.00 C ATOM 680 CG2 ILE A 47 -5.235 -9.817 -11.332 1.00 0.00 C ATOM 681 CD1 ILE A 47 -4.106 -7.169 -12.749 1.00 0.00 C ATOM 0 H ILE A 47 -5.373 -5.546 -10.937 1.00 0.00 H new ATOM 0 HA ILE A 47 -6.400 -7.453 -11.703 1.00 0.00 H new ATOM 0 HB ILE A 47 -4.525 -8.666 -9.693 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -3.183 -7.096 -10.800 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -2.906 -8.596 -11.662 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -4.367 -10.477 -11.349 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -6.025 -10.272 -10.735 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -5.593 -9.662 -12.350 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -3.244 -6.724 -13.247 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -4.557 -7.916 -13.402 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -4.838 -6.392 -12.527 1.00 0.00 H new ATOM 692 N ASP A 48 -7.975 -7.078 -9.313 1.00 0.00 N ATOM 693 CA ASP A 48 -9.117 -7.414 -8.479 1.00 0.00 C ATOM 694 C ASP A 48 -10.257 -7.921 -9.365 1.00 0.00 C ATOM 695 O ASP A 48 -11.323 -8.276 -8.867 1.00 0.00 O ATOM 696 CB ASP A 48 -9.621 -6.188 -7.715 1.00 0.00 C ATOM 697 CG ASP A 48 -11.068 -6.279 -7.229 1.00 0.00 C ATOM 698 OD1 ASP A 48 -12.016 -6.108 -8.010 1.00 0.00 O ATOM 699 OD2 ASP A 48 -11.206 -6.542 -5.973 1.00 0.00 O ATOM 0 H ASP A 48 -7.836 -6.079 -9.463 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.803 -8.178 -7.767 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -8.974 -6.024 -6.853 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.524 -5.313 -8.358 1.00 0.00 H new ATOM 704 N GLY A 49 -9.992 -7.938 -10.663 1.00 0.00 N ATOM 705 CA GLY A 49 -10.983 -8.395 -11.622 1.00 0.00 C ATOM 706 C GLY A 49 -11.271 -7.317 -12.669 1.00 0.00 C ATOM 707 O GLY A 49 -12.411 -7.160 -13.107 1.00 0.00 O ATOM 0 H GLY A 49 -9.106 -7.643 -11.073 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -10.627 -9.300 -12.115 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.904 -8.657 -11.102 1.00 0.00 H new ATOM 711 N ASN A 50 -10.220 -6.600 -13.039 1.00 0.00 N ATOM 712 CA ASN A 50 -10.347 -5.541 -14.027 1.00 0.00 C ATOM 713 C ASN A 50 -8.973 -4.912 -14.271 1.00 0.00 C ATOM 714 O ASN A 50 -8.279 -5.277 -15.218 1.00 0.00 O ATOM 715 CB ASN A 50 -11.290 -4.442 -13.536 1.00 0.00 C ATOM 716 CG ASN A 50 -11.336 -4.400 -12.007 1.00 0.00 C ATOM 717 OD1 ASN A 50 -10.492 -3.813 -11.351 1.00 0.00 O ATOM 718 ND2 ASN A 50 -12.367 -5.053 -11.480 1.00 0.00 N ATOM 0 H ASN A 50 -9.277 -6.731 -12.673 1.00 0.00 H new ATOM 0 HA ASN A 50 -10.748 -5.977 -14.942 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -10.960 -3.477 -13.920 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -12.292 -4.616 -13.929 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -12.488 -5.084 -10.468 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -13.037 -5.523 -12.088 1.00 0.00 H new ATOM 724 N GLY A 51 -8.623 -3.977 -13.401 1.00 0.00 N ATOM 725 CA GLY A 51 -7.345 -3.293 -13.510 1.00 0.00 C ATOM 726 C GLY A 51 -7.491 -1.804 -13.192 1.00 0.00 C ATOM 727 O GLY A 51 -6.496 -1.095 -13.051 1.00 0.00 O ATOM 0 H GLY A 51 -9.202 -3.676 -12.617 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.627 -3.746 -12.826 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.947 -3.416 -14.517 1.00 0.00 H new ATOM 731 N GLU A 52 -8.740 -1.373 -13.088 1.00 0.00 N ATOM 732 CA GLU A 52 -9.029 0.019 -12.790 1.00 0.00 C ATOM 733 C GLU A 52 -9.227 0.209 -11.285 1.00 0.00 C ATOM 734 O GLU A 52 -10.156 -0.349 -10.701 1.00 0.00 O ATOM 735 CB GLU A 52 -10.254 0.505 -13.569 1.00 0.00 C ATOM 736 CG GLU A 52 -10.001 0.449 -15.077 1.00 0.00 C ATOM 737 CD GLU A 52 -11.287 0.724 -15.858 1.00 0.00 C ATOM 738 OE1 GLU A 52 -12.307 0.056 -15.629 1.00 0.00 O ATOM 739 OE2 GLU A 52 -11.204 1.671 -16.731 1.00 0.00 O ATOM 0 H GLU A 52 -9.563 -1.964 -13.205 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.177 0.622 -13.105 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -11.117 -0.111 -13.318 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.495 1.526 -13.275 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -9.242 1.182 -15.350 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -9.609 -0.531 -15.348 1.00 0.00 H new ATOM 745 N ILE A 53 -8.339 0.998 -10.699 1.00 0.00 N ATOM 746 CA ILE A 53 -8.404 1.269 -9.272 1.00 0.00 C ATOM 747 C ILE A 53 -9.054 2.635 -9.046 1.00 0.00 C ATOM 748 O ILE A 53 -9.302 3.374 -9.997 1.00 0.00 O ATOM 749 CB ILE A 53 -7.018 1.134 -8.638 1.00 0.00 C ATOM 750 CG1 ILE A 53 -6.140 0.169 -9.437 1.00 0.00 C ATOM 751 CG2 ILE A 53 -7.125 0.728 -7.167 1.00 0.00 C ATOM 752 CD1 ILE A 53 -4.737 0.078 -8.835 1.00 0.00 C ATOM 0 H ILE A 53 -7.570 1.459 -11.186 1.00 0.00 H new ATOM 0 HA ILE A 53 -9.031 0.531 -8.772 1.00 0.00 H new ATOM 0 HB ILE A 53 -6.533 2.110 -8.668 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -6.599 -0.820 -9.450 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -6.074 0.504 -10.472 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -6.126 0.639 -6.741 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -7.687 1.485 -6.620 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -7.639 -0.230 -7.090 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -4.133 -0.614 -9.422 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -4.272 1.064 -8.846 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -4.804 -0.280 -7.808 1.00 0.00 H new ATOM 763 N ASP A 54 -9.313 2.929 -7.780 1.00 0.00 N ATOM 764 CA ASP A 54 -9.929 4.193 -7.416 1.00 0.00 C ATOM 765 C ASP A 54 -9.030 4.927 -6.418 1.00 0.00 C ATOM 766 O ASP A 54 -8.504 4.317 -5.489 1.00 0.00 O ATOM 767 CB ASP A 54 -11.290 3.971 -6.753 1.00 0.00 C ATOM 768 CG ASP A 54 -11.993 5.244 -6.279 1.00 0.00 C ATOM 769 OD1 ASP A 54 -11.347 6.265 -5.999 1.00 0.00 O ATOM 770 OD2 ASP A 54 -13.279 5.161 -6.200 1.00 0.00 O ATOM 0 H ASP A 54 -9.107 2.313 -6.994 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.062 4.777 -8.326 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -11.941 3.455 -7.459 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -11.157 3.307 -5.898 1.00 0.00 H new ATOM 775 N LEU A 55 -8.882 6.223 -6.646 1.00 0.00 N ATOM 776 CA LEU A 55 -8.057 7.046 -5.779 1.00 0.00 C ATOM 777 C LEU A 55 -8.236 6.591 -4.329 1.00 0.00 C ATOM 778 O LEU A 55 -7.303 6.666 -3.531 1.00 0.00 O ATOM 779 CB LEU A 55 -8.358 8.529 -6.000 1.00 0.00 C ATOM 780 CG LEU A 55 -7.287 9.329 -6.744 1.00 0.00 C ATOM 781 CD1 LEU A 55 -6.310 9.981 -5.763 1.00 0.00 C ATOM 782 CD2 LEU A 55 -6.567 8.455 -7.773 1.00 0.00 C ATOM 0 H LEU A 55 -9.320 6.724 -7.419 1.00 0.00 H new ATOM 0 HA LEU A 55 -7.003 6.920 -6.025 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -9.294 8.611 -6.553 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.521 8.995 -5.028 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.779 10.133 -7.291 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -5.559 10.544 -6.317 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.854 10.656 -5.102 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.820 9.209 -5.170 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.811 9.047 -8.288 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -6.089 7.616 -7.267 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -7.288 8.078 -8.498 1.00 0.00 H new ATOM 793 N ALA A 56 -9.442 6.129 -4.033 1.00 0.00 N ATOM 794 CA ALA A 56 -9.756 5.662 -2.693 1.00 0.00 C ATOM 795 C ALA A 56 -8.862 4.468 -2.351 1.00 0.00 C ATOM 796 O ALA A 56 -8.112 4.509 -1.377 1.00 0.00 O ATOM 797 CB ALA A 56 -11.245 5.319 -2.607 1.00 0.00 C ATOM 0 H ALA A 56 -10.213 6.068 -4.698 1.00 0.00 H new ATOM 0 HA ALA A 56 -9.559 6.443 -1.959 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -11.480 4.969 -1.602 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -11.836 6.207 -2.829 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -11.480 4.536 -3.328 1.00 0.00 H new ATOM 803 N GLU A 57 -8.972 3.433 -3.172 1.00 0.00 N ATOM 804 CA GLU A 57 -8.183 2.231 -2.969 1.00 0.00 C ATOM 805 C GLU A 57 -6.730 2.595 -2.655 1.00 0.00 C ATOM 806 O GLU A 57 -6.118 2.008 -1.764 1.00 0.00 O ATOM 807 CB GLU A 57 -8.266 1.308 -4.186 1.00 0.00 C ATOM 808 CG GLU A 57 -9.259 0.170 -3.944 1.00 0.00 C ATOM 809 CD GLU A 57 -9.499 -0.631 -5.227 1.00 0.00 C ATOM 810 OE1 GLU A 57 -8.603 -1.357 -5.681 1.00 0.00 O ATOM 811 OE2 GLU A 57 -10.667 -0.479 -5.753 1.00 0.00 O ATOM 0 H GLU A 57 -9.596 3.403 -3.979 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.594 1.691 -2.116 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -8.571 1.881 -5.062 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -7.280 0.896 -4.402 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.878 -0.490 -3.165 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -10.204 0.577 -3.583 1.00 0.00 H new ATOM 817 N PHE A 58 -6.221 3.561 -3.406 1.00 0.00 N ATOM 818 CA PHE A 58 -4.852 4.011 -3.219 1.00 0.00 C ATOM 819 C PHE A 58 -4.683 4.707 -1.868 1.00 0.00 C ATOM 820 O PHE A 58 -3.831 4.321 -1.069 1.00 0.00 O ATOM 821 CB PHE A 58 -4.553 5.011 -4.337 1.00 0.00 C ATOM 822 CG PHE A 58 -3.430 5.995 -4.007 1.00 0.00 C ATOM 823 CD1 PHE A 58 -2.131 5.615 -4.143 1.00 0.00 C ATOM 824 CD2 PHE A 58 -3.728 7.250 -3.578 1.00 0.00 C ATOM 825 CE1 PHE A 58 -1.088 6.528 -3.837 1.00 0.00 C ATOM 826 CE2 PHE A 58 -2.686 8.164 -3.272 1.00 0.00 C ATOM 827 CZ PHE A 58 -1.387 7.783 -3.408 1.00 0.00 C ATOM 0 H PHE A 58 -6.732 4.044 -4.145 1.00 0.00 H new ATOM 0 HA PHE A 58 -4.173 3.158 -3.244 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -4.287 4.462 -5.240 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -5.460 5.572 -4.561 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -1.893 4.618 -4.484 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -4.759 7.552 -3.470 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -0.057 6.226 -3.945 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -2.924 9.161 -2.932 1.00 0.00 H new ATOM 0 HZ PHE A 58 -0.593 8.477 -3.175 1.00 0.00 H new ATOM 836 N THR A 59 -5.507 5.722 -1.654 1.00 0.00 N ATOM 837 CA THR A 59 -5.459 6.477 -0.413 1.00 0.00 C ATOM 838 C THR A 59 -5.646 5.545 0.785 1.00 0.00 C ATOM 839 O THR A 59 -4.814 5.518 1.691 1.00 0.00 O ATOM 840 CB THR A 59 -6.513 7.583 -0.493 1.00 0.00 C ATOM 841 OG1 THR A 59 -6.099 8.379 -1.600 1.00 0.00 O ATOM 842 CG2 THR A 59 -6.448 8.540 0.700 1.00 0.00 C ATOM 0 H THR A 59 -6.212 6.040 -2.319 1.00 0.00 H new ATOM 0 HA THR A 59 -4.485 6.945 -0.271 1.00 0.00 H new ATOM 0 HB THR A 59 -7.505 7.135 -0.546 1.00 0.00 H new ATOM 0 HG1 THR A 59 -6.439 7.986 -2.431 1.00 0.00 H new ATOM 0 HG21 THR A 59 -7.217 9.306 0.594 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.614 7.984 1.622 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.467 9.013 0.734 1.00 0.00 H new ATOM 850 N LYS A 60 -6.743 4.803 0.752 1.00 0.00 N ATOM 851 CA LYS A 60 -7.050 3.872 1.825 1.00 0.00 C ATOM 852 C LYS A 60 -5.826 2.997 2.101 1.00 0.00 C ATOM 853 O LYS A 60 -5.413 2.847 3.250 1.00 0.00 O ATOM 854 CB LYS A 60 -8.314 3.073 1.496 1.00 0.00 C ATOM 855 CG LYS A 60 -7.960 1.689 0.945 1.00 0.00 C ATOM 856 CD LYS A 60 -9.222 0.863 0.687 1.00 0.00 C ATOM 857 CE LYS A 60 -8.894 -0.406 -0.101 1.00 0.00 C ATOM 858 NZ LYS A 60 -10.120 -1.202 -0.336 1.00 0.00 N ATOM 0 H LYS A 60 -7.431 4.827 -0.001 1.00 0.00 H new ATOM 0 HA LYS A 60 -7.271 4.412 2.746 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -8.925 2.966 2.393 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -8.913 3.617 0.765 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -7.395 1.796 0.019 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -7.317 1.166 1.652 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -9.687 0.596 1.636 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -9.946 1.462 0.135 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -8.437 -0.141 -1.054 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -8.165 -1.003 0.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -9.879 -2.060 -0.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -10.540 -1.471 0.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -10.803 -0.635 -0.878 1.00 0.00 H new ATOM 868 N PHE A 61 -5.277 2.446 1.029 1.00 0.00 N ATOM 869 CA PHE A 61 -4.108 1.591 1.141 1.00 0.00 C ATOM 870 C PHE A 61 -2.965 2.317 1.854 1.00 0.00 C ATOM 871 O PHE A 61 -2.264 1.725 2.673 1.00 0.00 O ATOM 872 CB PHE A 61 -3.667 1.245 -0.282 1.00 0.00 C ATOM 873 CG PHE A 61 -4.109 -0.142 -0.751 1.00 0.00 C ATOM 874 CD1 PHE A 61 -5.400 -0.536 -0.589 1.00 0.00 C ATOM 875 CD2 PHE A 61 -3.209 -0.983 -1.329 1.00 0.00 C ATOM 876 CE1 PHE A 61 -5.810 -1.823 -1.025 1.00 0.00 C ATOM 877 CE2 PHE A 61 -3.619 -2.271 -1.764 1.00 0.00 C ATOM 878 CZ PHE A 61 -4.910 -2.664 -1.603 1.00 0.00 C ATOM 0 H PHE A 61 -5.621 2.575 0.077 1.00 0.00 H new ATOM 0 HA PHE A 61 -4.354 0.699 1.718 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.066 1.993 -0.967 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.580 1.307 -0.340 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -6.114 0.131 -0.128 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.183 -0.671 -1.457 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.836 -2.135 -0.898 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -2.905 -2.939 -2.223 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.222 -3.644 -1.934 1.00 0.00 H new ATOM 887 N ALA A 62 -2.813 3.589 1.516 1.00 0.00 N ATOM 888 CA ALA A 62 -1.767 4.402 2.114 1.00 0.00 C ATOM 889 C ALA A 62 -2.030 4.541 3.614 1.00 0.00 C ATOM 890 O ALA A 62 -1.110 4.426 4.423 1.00 0.00 O ATOM 891 CB ALA A 62 -1.706 5.757 1.404 1.00 0.00 C ATOM 0 H ALA A 62 -3.396 4.077 0.836 1.00 0.00 H new ATOM 0 HA ALA A 62 -0.794 3.926 1.993 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -0.922 6.367 1.852 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.488 5.604 0.347 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.665 6.265 1.507 1.00 0.00 H new ATOM 897 N ALA A 63 -3.290 4.788 3.942 1.00 0.00 N ATOM 898 CA ALA A 63 -3.685 4.942 5.332 1.00 0.00 C ATOM 899 C ALA A 63 -3.667 3.576 6.019 1.00 0.00 C ATOM 900 O ALA A 63 -3.602 3.494 7.245 1.00 0.00 O ATOM 901 CB ALA A 63 -5.060 5.611 5.399 1.00 0.00 C ATOM 0 H ALA A 63 -4.050 4.885 3.269 1.00 0.00 H new ATOM 0 HA ALA A 63 -2.982 5.585 5.862 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -5.358 5.727 6.441 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -5.011 6.591 4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -5.792 4.992 4.880 1.00 0.00 H new ATOM 907 N ALA A 64 -3.725 2.537 5.200 1.00 0.00 N ATOM 908 CA ALA A 64 -3.716 1.177 5.713 1.00 0.00 C ATOM 909 C ALA A 64 -2.278 0.774 6.051 1.00 0.00 C ATOM 910 O ALA A 64 -2.045 0.048 7.016 1.00 0.00 O ATOM 911 CB ALA A 64 -4.358 0.240 4.689 1.00 0.00 C ATOM 0 H ALA A 64 -3.778 2.609 4.184 1.00 0.00 H new ATOM 0 HA ALA A 64 -4.302 1.109 6.629 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.351 -0.780 5.074 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.386 0.551 4.505 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -3.795 0.279 3.757 1.00 0.00 H new ATOM 917 N VAL A 65 -1.354 1.264 5.238 1.00 0.00 N ATOM 918 CA VAL A 65 0.054 0.964 5.440 1.00 0.00 C ATOM 919 C VAL A 65 0.619 1.889 6.519 1.00 0.00 C ATOM 920 O VAL A 65 1.568 1.530 7.215 1.00 0.00 O ATOM 921 CB VAL A 65 0.806 1.066 4.111 1.00 0.00 C ATOM 922 CG1 VAL A 65 1.327 2.486 3.884 1.00 0.00 C ATOM 923 CG2 VAL A 65 1.945 0.047 4.044 1.00 0.00 C ATOM 0 H VAL A 65 -1.552 1.866 4.439 1.00 0.00 H new ATOM 0 HA VAL A 65 0.180 -0.060 5.792 1.00 0.00 H new ATOM 0 HB VAL A 65 0.103 0.834 3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.857 2.531 2.933 1.00 0.00 H new ATOM 0 HG12 VAL A 65 0.489 3.182 3.865 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.007 2.758 4.692 1.00 0.00 H new ATOM 0 HG21 VAL A 65 2.462 0.142 3.089 1.00 0.00 H new ATOM 0 HG22 VAL A 65 2.647 0.232 4.857 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.538 -0.960 4.138 1.00 0.00 H new ATOM 1020 N ASP A 72 4.134 -4.350 9.665 1.00 0.00 N ATOM 1021 CA ASP A 72 5.258 -4.882 10.417 1.00 0.00 C ATOM 1022 C ASP A 72 5.134 -6.405 10.500 1.00 0.00 C ATOM 1023 O ASP A 72 6.042 -7.128 10.094 1.00 0.00 O ATOM 1024 CB ASP A 72 5.277 -4.330 11.844 1.00 0.00 C ATOM 1025 CG ASP A 72 4.948 -2.841 11.965 1.00 0.00 C ATOM 1026 OD1 ASP A 72 5.073 -2.078 10.995 1.00 0.00 O ATOM 1027 OD2 ASP A 72 4.544 -2.465 13.131 1.00 0.00 O ATOM 0 HA ASP A 72 6.175 -4.590 9.906 1.00 0.00 H new ATOM 0 HB2 ASP A 72 4.564 -4.894 12.445 1.00 0.00 H new ATOM 0 HB3 ASP A 72 6.264 -4.505 12.272 1.00 0.00 H new ATOM 1032 N GLU A 73 4.004 -6.847 11.031 1.00 0.00 N ATOM 1033 CA GLU A 73 3.750 -8.271 11.174 1.00 0.00 C ATOM 1034 C GLU A 73 4.221 -9.021 9.926 1.00 0.00 C ATOM 1035 O GLU A 73 4.836 -10.081 10.030 1.00 0.00 O ATOM 1036 CB GLU A 73 2.269 -8.538 11.449 1.00 0.00 C ATOM 1037 CG GLU A 73 2.097 -9.577 12.560 1.00 0.00 C ATOM 1038 CD GLU A 73 0.624 -9.728 12.945 1.00 0.00 C ATOM 1039 OE1 GLU A 73 -0.159 -8.781 12.781 1.00 0.00 O ATOM 1040 OE2 GLU A 73 0.303 -10.878 13.431 1.00 0.00 O ATOM 0 H GLU A 73 3.253 -6.244 11.368 1.00 0.00 H new ATOM 0 HA GLU A 73 4.316 -8.638 12.030 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.775 -7.609 11.735 1.00 0.00 H new ATOM 0 HB3 GLU A 73 1.784 -8.890 10.539 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.490 -10.538 12.228 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.677 -9.280 13.434 1.00 0.00 H new ATOM 1046 N LYS A 74 3.914 -8.441 8.775 1.00 0.00 N ATOM 1047 CA LYS A 74 4.298 -9.042 7.509 1.00 0.00 C ATOM 1048 C LYS A 74 5.769 -8.727 7.226 1.00 0.00 C ATOM 1049 O LYS A 74 6.522 -9.601 6.796 1.00 0.00 O ATOM 1050 CB LYS A 74 3.348 -8.598 6.395 1.00 0.00 C ATOM 1051 CG LYS A 74 2.267 -9.651 6.143 1.00 0.00 C ATOM 1052 CD LYS A 74 1.503 -9.354 4.851 1.00 0.00 C ATOM 1053 CE LYS A 74 0.056 -8.957 5.150 1.00 0.00 C ATOM 1054 NZ LYS A 74 -0.142 -7.509 4.913 1.00 0.00 N ATOM 0 H LYS A 74 3.404 -7.562 8.693 1.00 0.00 H new ATOM 0 HA LYS A 74 4.208 -10.127 7.559 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.882 -7.651 6.666 1.00 0.00 H new ATOM 0 HB3 LYS A 74 3.912 -8.425 5.479 1.00 0.00 H new ATOM 0 HG2 LYS A 74 2.724 -10.639 6.081 1.00 0.00 H new ATOM 0 HG3 LYS A 74 1.573 -9.673 6.983 1.00 0.00 H new ATOM 0 HD2 LYS A 74 2.000 -8.551 4.307 1.00 0.00 H new ATOM 0 HD3 LYS A 74 1.517 -10.232 4.206 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -0.623 -9.531 4.520 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -0.188 -9.199 6.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -1.129 -7.255 5.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 0.493 -6.966 5.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 0.071 -7.288 3.919 1.00 0.00 H new ATOM 1064 N VAL A 75 6.132 -7.479 7.477 1.00 0.00 N ATOM 1065 CA VAL A 75 7.498 -7.038 7.253 1.00 0.00 C ATOM 1066 C VAL A 75 8.464 -8.141 7.694 1.00 0.00 C ATOM 1067 O VAL A 75 9.459 -8.404 7.021 1.00 0.00 O ATOM 1068 CB VAL A 75 7.743 -5.709 7.969 1.00 0.00 C ATOM 1069 CG1 VAL A 75 9.232 -5.352 7.971 1.00 0.00 C ATOM 1070 CG2 VAL A 75 6.912 -4.587 7.342 1.00 0.00 C ATOM 0 H VAL A 75 5.504 -6.759 7.833 1.00 0.00 H new ATOM 0 HA VAL A 75 7.672 -6.857 6.192 1.00 0.00 H new ATOM 0 HB VAL A 75 7.425 -5.824 9.005 1.00 0.00 H new ATOM 0 HG11 VAL A 75 9.378 -4.403 8.486 1.00 0.00 H new ATOM 0 HG12 VAL A 75 9.793 -6.133 8.484 1.00 0.00 H new ATOM 0 HG13 VAL A 75 9.587 -5.266 6.944 1.00 0.00 H new ATOM 0 HG21 VAL A 75 7.105 -3.653 7.870 1.00 0.00 H new ATOM 0 HG22 VAL A 75 7.186 -4.474 6.293 1.00 0.00 H new ATOM 0 HG23 VAL A 75 5.853 -4.834 7.416 1.00 0.00 H new ATOM 1080 N GLY A 76 8.135 -8.755 8.820 1.00 0.00 N ATOM 1081 CA GLY A 76 8.960 -9.823 9.359 1.00 0.00 C ATOM 1082 C GLY A 76 9.167 -10.930 8.324 1.00 0.00 C ATOM 1083 O GLY A 76 10.292 -11.184 7.898 1.00 0.00 O ATOM 0 H GLY A 76 7.308 -8.534 9.375 1.00 0.00 H new ATOM 0 HA2 GLY A 76 9.926 -9.422 9.666 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.489 -10.237 10.250 1.00 0.00 H new ATOM 1087 N LEU A 77 8.063 -11.561 7.950 1.00 0.00 N ATOM 1088 CA LEU A 77 8.110 -12.635 6.973 1.00 0.00 C ATOM 1089 C LEU A 77 8.752 -12.119 5.683 1.00 0.00 C ATOM 1090 O LEU A 77 9.325 -12.893 4.918 1.00 0.00 O ATOM 1091 CB LEU A 77 6.717 -13.235 6.769 1.00 0.00 C ATOM 1092 CG LEU A 77 6.068 -12.977 5.407 1.00 0.00 C ATOM 1093 CD1 LEU A 77 5.013 -14.039 5.093 1.00 0.00 C ATOM 1094 CD2 LEU A 77 5.495 -11.561 5.333 1.00 0.00 C ATOM 0 H LEU A 77 7.131 -11.349 8.306 1.00 0.00 H new ATOM 0 HA LEU A 77 8.734 -13.452 7.335 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.782 -14.313 6.920 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.058 -12.843 7.543 1.00 0.00 H new ATOM 0 HG LEU A 77 6.839 -13.053 4.641 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.567 -13.832 4.120 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.481 -15.023 5.076 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.238 -14.019 5.859 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.040 -11.403 4.355 1.00 0.00 H new ATOM 0 HD22 LEU A 77 4.741 -11.433 6.109 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.296 -10.836 5.482 1.00 0.00 H new ATOM 1105 N LYS A 78 8.633 -10.815 5.482 1.00 0.00 N ATOM 1106 CA LYS A 78 9.195 -10.187 4.299 1.00 0.00 C ATOM 1107 C LYS A 78 10.720 -10.168 4.411 1.00 0.00 C ATOM 1108 O LYS A 78 11.414 -10.776 3.597 1.00 0.00 O ATOM 1109 CB LYS A 78 8.578 -8.803 4.083 1.00 0.00 C ATOM 1110 CG LYS A 78 9.301 -8.048 2.965 1.00 0.00 C ATOM 1111 CD LYS A 78 8.792 -6.609 2.858 1.00 0.00 C ATOM 1112 CE LYS A 78 9.613 -5.669 3.743 1.00 0.00 C ATOM 1113 NZ LYS A 78 8.760 -4.586 4.280 1.00 0.00 N ATOM 0 H LYS A 78 8.156 -10.176 6.118 1.00 0.00 H new ATOM 0 HA LYS A 78 8.948 -10.765 3.408 1.00 0.00 H new ATOM 0 HB2 LYS A 78 7.522 -8.907 3.833 1.00 0.00 H new ATOM 0 HB3 LYS A 78 8.631 -8.229 5.008 1.00 0.00 H new ATOM 0 HG2 LYS A 78 10.374 -8.045 3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.149 -8.563 2.016 1.00 0.00 H new ATOM 0 HD2 LYS A 78 8.845 -6.277 1.821 1.00 0.00 H new ATOM 0 HD3 LYS A 78 7.743 -6.568 3.152 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.059 -6.230 4.564 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.434 -5.242 3.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 9.114 -4.296 5.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 8.783 -3.773 3.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 7.782 -4.928 4.372 1.00 0.00 H new ATOM 1123 N ILE A 79 11.198 -9.465 5.428 1.00 0.00 N ATOM 1124 CA ILE A 79 12.629 -9.360 5.658 1.00 0.00 C ATOM 1125 C ILE A 79 13.258 -10.753 5.580 1.00 0.00 C ATOM 1126 O ILE A 79 14.389 -10.903 5.120 1.00 0.00 O ATOM 1127 CB ILE A 79 12.908 -8.632 6.974 1.00 0.00 C ATOM 1128 CG1 ILE A 79 12.344 -7.210 6.945 1.00 0.00 C ATOM 1129 CG2 ILE A 79 14.402 -8.649 7.304 1.00 0.00 C ATOM 1130 CD1 ILE A 79 12.520 -6.523 8.300 1.00 0.00 C ATOM 0 H ILE A 79 10.620 -8.963 6.102 1.00 0.00 H new ATOM 0 HA ILE A 79 13.096 -8.755 4.881 1.00 0.00 H new ATOM 0 HB ILE A 79 12.395 -9.165 7.774 1.00 0.00 H new ATOM 0 HG12 ILE A 79 12.848 -6.631 6.171 1.00 0.00 H new ATOM 0 HG13 ILE A 79 11.286 -7.240 6.683 1.00 0.00 H new ATOM 0 HG21 ILE A 79 14.573 -8.125 8.244 1.00 0.00 H new ATOM 0 HG22 ILE A 79 14.742 -9.680 7.396 1.00 0.00 H new ATOM 0 HG23 ILE A 79 14.956 -8.154 6.507 1.00 0.00 H new ATOM 0 HD11 ILE A 79 12.111 -5.514 8.252 1.00 0.00 H new ATOM 0 HD12 ILE A 79 11.995 -7.092 9.067 1.00 0.00 H new ATOM 0 HD13 ILE A 79 13.580 -6.473 8.548 1.00 0.00 H new ATOM 1141 N LEU A 80 12.497 -11.737 6.037 1.00 0.00 N ATOM 1142 CA LEU A 80 12.965 -13.112 6.025 1.00 0.00 C ATOM 1143 C LEU A 80 12.965 -13.634 4.587 1.00 0.00 C ATOM 1144 O LEU A 80 13.876 -14.354 4.183 1.00 0.00 O ATOM 1145 CB LEU A 80 12.141 -13.967 6.989 1.00 0.00 C ATOM 1146 CG LEU A 80 12.888 -14.507 8.212 1.00 0.00 C ATOM 1147 CD1 LEU A 80 12.065 -14.311 9.486 1.00 0.00 C ATOM 1148 CD2 LEU A 80 13.288 -15.970 8.008 1.00 0.00 C ATOM 0 H LEU A 80 11.559 -11.609 6.418 1.00 0.00 H new ATOM 0 HA LEU A 80 13.992 -13.167 6.385 1.00 0.00 H new ATOM 0 HB2 LEU A 80 11.295 -13.374 7.337 1.00 0.00 H new ATOM 0 HB3 LEU A 80 11.732 -14.812 6.435 1.00 0.00 H new ATOM 0 HG LEU A 80 13.808 -13.935 8.331 1.00 0.00 H new ATOM 0 HD11 LEU A 80 12.618 -14.703 10.340 1.00 0.00 H new ATOM 0 HD12 LEU A 80 11.872 -13.249 9.635 1.00 0.00 H new ATOM 0 HD13 LEU A 80 11.118 -14.842 9.392 1.00 0.00 H new ATOM 0 HD21 LEU A 80 13.817 -16.329 8.891 1.00 0.00 H new ATOM 0 HD22 LEU A 80 12.394 -16.573 7.850 1.00 0.00 H new ATOM 0 HD23 LEU A 80 13.939 -16.051 7.137 1.00 0.00 H new ATOM 1159 N TYR A 81 11.930 -13.252 3.852 1.00 0.00 N ATOM 1160 CA TYR A 81 11.798 -13.672 2.468 1.00 0.00 C ATOM 1161 C TYR A 81 12.985 -13.187 1.633 1.00 0.00 C ATOM 1162 O TYR A 81 13.413 -13.868 0.701 1.00 0.00 O ATOM 1163 CB TYR A 81 10.520 -13.012 1.946 1.00 0.00 C ATOM 1164 CG TYR A 81 10.025 -13.581 0.616 1.00 0.00 C ATOM 1165 CD1 TYR A 81 10.806 -13.471 -0.517 1.00 0.00 C ATOM 1166 CD2 TYR A 81 8.794 -14.204 0.547 1.00 0.00 C ATOM 1167 CE1 TYR A 81 10.340 -14.007 -1.769 1.00 0.00 C ATOM 1168 CE2 TYR A 81 8.328 -14.740 -0.705 1.00 0.00 C ATOM 1169 CZ TYR A 81 9.124 -14.615 -1.801 1.00 0.00 C ATOM 1170 OH TYR A 81 8.682 -15.121 -2.984 1.00 0.00 O ATOM 0 H TYR A 81 11.175 -12.656 4.190 1.00 0.00 H new ATOM 0 HA TYR A 81 11.765 -14.759 2.399 1.00 0.00 H new ATOM 0 HB2 TYR A 81 9.734 -13.125 2.693 1.00 0.00 H new ATOM 0 HB3 TYR A 81 10.697 -11.943 1.829 1.00 0.00 H new ATOM 0 HD1 TYR A 81 11.768 -12.982 -0.464 1.00 0.00 H new ATOM 0 HD2 TYR A 81 8.181 -14.289 1.432 1.00 0.00 H new ATOM 0 HE1 TYR A 81 10.942 -13.928 -2.662 1.00 0.00 H new ATOM 0 HE2 TYR A 81 7.368 -15.230 -0.773 1.00 0.00 H new ATOM 0 HH TYR A 81 9.404 -15.083 -3.646 1.00 0.00 H new ATOM 1179 N LYS A 82 13.485 -12.016 1.997 1.00 0.00 N ATOM 1180 CA LYS A 82 14.615 -11.433 1.292 1.00 0.00 C ATOM 1181 C LYS A 82 15.909 -12.083 1.787 1.00 0.00 C ATOM 1182 O LYS A 82 16.781 -12.423 0.988 1.00 0.00 O ATOM 1183 CB LYS A 82 14.601 -9.909 1.427 1.00 0.00 C ATOM 1184 CG LYS A 82 15.575 -9.446 2.513 1.00 0.00 C ATOM 1185 CD LYS A 82 17.024 -9.572 2.041 1.00 0.00 C ATOM 1186 CE LYS A 82 17.675 -8.194 1.894 1.00 0.00 C ATOM 1187 NZ LYS A 82 18.330 -8.069 0.573 1.00 0.00 N ATOM 0 H LYS A 82 13.129 -11.455 2.771 1.00 0.00 H new ATOM 0 HA LYS A 82 14.544 -11.636 0.223 1.00 0.00 H new ATOM 0 HB2 LYS A 82 14.870 -9.453 0.474 1.00 0.00 H new ATOM 0 HB3 LYS A 82 13.593 -9.571 1.669 1.00 0.00 H new ATOM 0 HG2 LYS A 82 15.364 -8.410 2.778 1.00 0.00 H new ATOM 0 HG3 LYS A 82 15.430 -10.041 3.414 1.00 0.00 H new ATOM 0 HD2 LYS A 82 17.591 -10.172 2.753 1.00 0.00 H new ATOM 0 HD3 LYS A 82 17.055 -10.096 1.086 1.00 0.00 H new ATOM 0 HE2 LYS A 82 16.921 -7.415 2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 82 18.409 -8.046 2.686 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 18.767 -7.129 0.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 19.063 -8.801 0.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 17.621 -8.190 -0.179 1.00 0.00 H new ATOM 1197 N LEU A 83 15.992 -12.236 3.100 1.00 0.00 N ATOM 1198 CA LEU A 83 17.166 -12.839 3.710 1.00 0.00 C ATOM 1199 C LEU A 83 17.264 -14.304 3.278 1.00 0.00 C ATOM 1200 O LEU A 83 18.153 -14.670 2.511 1.00 0.00 O ATOM 1201 CB LEU A 83 17.140 -12.646 5.228 1.00 0.00 C ATOM 1202 CG LEU A 83 18.296 -13.279 6.004 1.00 0.00 C ATOM 1203 CD1 LEU A 83 18.540 -12.541 7.321 1.00 0.00 C ATOM 1204 CD2 LEU A 83 18.058 -14.775 6.220 1.00 0.00 C ATOM 0 H LEU A 83 15.266 -11.953 3.759 1.00 0.00 H new ATOM 0 HA LEU A 83 18.073 -12.343 3.364 1.00 0.00 H new ATOM 0 HB2 LEU A 83 17.130 -11.577 5.438 1.00 0.00 H new ATOM 0 HB3 LEU A 83 16.205 -13.055 5.610 1.00 0.00 H new ATOM 0 HG LEU A 83 19.203 -13.181 5.407 1.00 0.00 H new ATOM 0 HD11 LEU A 83 19.367 -13.011 7.854 1.00 0.00 H new ATOM 0 HD12 LEU A 83 18.787 -11.500 7.114 1.00 0.00 H new ATOM 0 HD13 LEU A 83 17.641 -12.586 7.935 1.00 0.00 H new ATOM 0 HD21 LEU A 83 18.895 -15.200 6.774 1.00 0.00 H new ATOM 0 HD22 LEU A 83 17.138 -14.919 6.786 1.00 0.00 H new ATOM 0 HD23 LEU A 83 17.972 -15.273 5.254 1.00 0.00 H new ATOM 1215 N MET A 84 16.338 -15.102 3.789 1.00 0.00 N ATOM 1216 CA MET A 84 16.309 -16.518 3.465 1.00 0.00 C ATOM 1217 C MET A 84 16.662 -16.752 1.996 1.00 0.00 C ATOM 1218 O MET A 84 17.201 -17.800 1.642 1.00 0.00 O ATOM 1219 CB MET A 84 14.913 -17.077 3.750 1.00 0.00 C ATOM 1220 CG MET A 84 14.997 -18.504 4.296 1.00 0.00 C ATOM 1221 SD MET A 84 14.917 -18.481 6.079 1.00 0.00 S ATOM 1222 CE MET A 84 15.212 -20.206 6.426 1.00 0.00 C ATOM 0 H MET A 84 15.602 -14.795 4.425 1.00 0.00 H new ATOM 0 HA MET A 84 17.049 -17.028 4.082 1.00 0.00 H new ATOM 0 HB2 MET A 84 14.401 -16.438 4.469 1.00 0.00 H new ATOM 0 HB3 MET A 84 14.320 -17.068 2.836 1.00 0.00 H new ATOM 0 HG2 MET A 84 14.180 -19.104 3.895 1.00 0.00 H new ATOM 0 HG3 MET A 84 15.926 -18.972 3.971 1.00 0.00 H new ATOM 0 HE1 MET A 84 15.195 -20.368 7.504 1.00 0.00 H new ATOM 0 HE2 MET A 84 14.436 -20.810 5.956 1.00 0.00 H new ATOM 0 HE3 MET A 84 16.186 -20.495 6.031 1.00 0.00 H new ATOM 1230 N ASP A 85 16.345 -15.758 1.177 1.00 0.00 N ATOM 1231 CA ASP A 85 16.624 -15.842 -0.245 1.00 0.00 C ATOM 1232 C ASP A 85 18.134 -15.758 -0.471 1.00 0.00 C ATOM 1233 O ASP A 85 18.672 -14.676 -0.702 1.00 0.00 O ATOM 1234 CB ASP A 85 15.966 -14.688 -1.004 1.00 0.00 C ATOM 1235 CG ASP A 85 15.033 -15.109 -2.141 1.00 0.00 C ATOM 1236 OD1 ASP A 85 15.129 -16.229 -2.664 1.00 0.00 O ATOM 1237 OD2 ASP A 85 14.168 -14.220 -2.494 1.00 0.00 O ATOM 0 H ASP A 85 15.897 -14.891 1.473 1.00 0.00 H new ATOM 0 HA ASP A 85 16.226 -16.788 -0.611 1.00 0.00 H new ATOM 0 HB2 ASP A 85 15.400 -14.083 -0.295 1.00 0.00 H new ATOM 0 HB3 ASP A 85 16.749 -14.050 -1.414 1.00 0.00 H new ATOM 1242 N ALA A 86 18.777 -16.914 -0.399 1.00 0.00 N ATOM 1243 CA ALA A 86 20.215 -16.985 -0.592 1.00 0.00 C ATOM 1244 C ALA A 86 20.511 -17.479 -2.010 1.00 0.00 C ATOM 1245 O ALA A 86 21.531 -17.121 -2.596 1.00 0.00 O ATOM 1246 CB ALA A 86 20.832 -17.886 0.480 1.00 0.00 C ATOM 0 H ALA A 86 18.328 -17.810 -0.209 1.00 0.00 H new ATOM 0 HA ALA A 86 20.665 -15.998 -0.485 1.00 0.00 H new ATOM 0 HB1 ALA A 86 21.911 -17.939 0.334 1.00 0.00 H new ATOM 0 HB2 ALA A 86 20.619 -17.476 1.467 1.00 0.00 H new ATOM 0 HB3 ALA A 86 20.406 -18.887 0.403 1.00 0.00 H new ATOM 1252 N ASP A 87 19.600 -18.296 -2.520 1.00 0.00 N ATOM 1253 CA ASP A 87 19.751 -18.842 -3.858 1.00 0.00 C ATOM 1254 C ASP A 87 18.946 -17.993 -4.845 1.00 0.00 C ATOM 1255 O ASP A 87 19.408 -17.717 -5.951 1.00 0.00 O ATOM 1256 CB ASP A 87 19.222 -20.277 -3.929 1.00 0.00 C ATOM 1257 CG ASP A 87 18.804 -20.743 -5.324 1.00 0.00 C ATOM 1258 OD1 ASP A 87 19.507 -20.499 -6.317 1.00 0.00 O ATOM 1259 OD2 ASP A 87 17.692 -21.394 -5.372 1.00 0.00 O ATOM 0 H ASP A 87 18.756 -18.593 -2.031 1.00 0.00 H new ATOM 0 HA ASP A 87 20.812 -18.835 -4.108 1.00 0.00 H new ATOM 0 HB2 ASP A 87 19.991 -20.951 -3.553 1.00 0.00 H new ATOM 0 HB3 ASP A 87 18.366 -20.366 -3.261 1.00 0.00 H new ATOM 1264 N GLY A 88 17.759 -17.602 -4.408 1.00 0.00 N ATOM 1265 CA GLY A 88 16.886 -16.790 -5.240 1.00 0.00 C ATOM 1266 C GLY A 88 17.616 -15.544 -5.747 1.00 0.00 C ATOM 1267 O GLY A 88 17.612 -15.262 -6.944 1.00 0.00 O ATOM 0 H GLY A 88 17.380 -17.832 -3.489 1.00 0.00 H new ATOM 0 HA2 GLY A 88 16.533 -17.379 -6.087 1.00 0.00 H new ATOM 0 HA3 GLY A 88 16.006 -16.493 -4.669 1.00 0.00 H new ATOM 1271 N ASP A 89 18.225 -14.832 -4.810 1.00 0.00 N ATOM 1272 CA ASP A 89 18.957 -13.624 -5.146 1.00 0.00 C ATOM 1273 C ASP A 89 17.965 -12.492 -5.426 1.00 0.00 C ATOM 1274 O ASP A 89 18.348 -11.435 -5.923 1.00 0.00 O ATOM 1275 CB ASP A 89 19.807 -13.826 -6.402 1.00 0.00 C ATOM 1276 CG ASP A 89 20.221 -15.273 -6.675 1.00 0.00 C ATOM 1277 OD1 ASP A 89 19.925 -15.831 -7.742 1.00 0.00 O ATOM 1278 OD2 ASP A 89 20.885 -15.840 -5.725 1.00 0.00 O ATOM 0 H ASP A 89 18.226 -15.069 -3.818 1.00 0.00 H new ATOM 0 HA ASP A 89 19.606 -13.379 -4.305 1.00 0.00 H new ATOM 0 HB2 ASP A 89 19.251 -13.454 -7.263 1.00 0.00 H new ATOM 0 HB3 ASP A 89 20.706 -13.216 -6.316 1.00 0.00 H new ATOM 1283 N GLY A 90 16.710 -12.754 -5.092 1.00 0.00 N ATOM 1284 CA GLY A 90 15.660 -11.771 -5.300 1.00 0.00 C ATOM 1285 C GLY A 90 14.320 -12.453 -5.584 1.00 0.00 C ATOM 1286 O GLY A 90 13.272 -11.975 -5.150 1.00 0.00 O ATOM 0 H GLY A 90 16.397 -13.632 -4.679 1.00 0.00 H new ATOM 0 HA2 GLY A 90 15.570 -11.137 -4.418 1.00 0.00 H new ATOM 0 HA3 GLY A 90 15.925 -11.121 -6.134 1.00 0.00 H new ATOM 1290 N LYS A 91 14.396 -13.558 -6.310 1.00 0.00 N ATOM 1291 CA LYS A 91 13.201 -14.309 -6.657 1.00 0.00 C ATOM 1292 C LYS A 91 13.300 -15.717 -6.066 1.00 0.00 C ATOM 1293 O LYS A 91 14.334 -16.374 -6.186 1.00 0.00 O ATOM 1294 CB LYS A 91 12.978 -14.293 -8.171 1.00 0.00 C ATOM 1295 CG LYS A 91 13.395 -15.623 -8.801 1.00 0.00 C ATOM 1296 CD LYS A 91 14.917 -15.721 -8.919 1.00 0.00 C ATOM 1297 CE LYS A 91 15.338 -17.081 -9.478 1.00 0.00 C ATOM 1298 NZ LYS A 91 15.721 -16.960 -10.902 1.00 0.00 N ATOM 0 H LYS A 91 15.266 -13.952 -6.668 1.00 0.00 H new ATOM 0 HA LYS A 91 12.318 -13.841 -6.223 1.00 0.00 H new ATOM 0 HB2 LYS A 91 11.927 -14.099 -8.385 1.00 0.00 H new ATOM 0 HB3 LYS A 91 13.550 -13.480 -8.618 1.00 0.00 H new ATOM 0 HG2 LYS A 91 13.020 -16.449 -8.197 1.00 0.00 H new ATOM 0 HG3 LYS A 91 12.943 -15.719 -9.788 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.287 -14.927 -9.568 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.372 -15.570 -7.940 1.00 0.00 H new ATOM 0 HE2 LYS A 91 16.176 -17.474 -8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 91 14.519 -17.793 -9.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 16.004 -17.892 -11.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 14.911 -16.606 -11.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.517 -16.297 -10.992 1.00 0.00 H new ATOM 1308 N LEU A 92 12.213 -16.139 -5.438 1.00 0.00 N ATOM 1309 CA LEU A 92 12.164 -17.457 -4.827 1.00 0.00 C ATOM 1310 C LEU A 92 11.523 -18.444 -5.804 1.00 0.00 C ATOM 1311 O LEU A 92 10.382 -18.253 -6.227 1.00 0.00 O ATOM 1312 CB LEU A 92 11.463 -17.393 -3.469 1.00 0.00 C ATOM 1313 CG LEU A 92 12.329 -16.950 -2.288 1.00 0.00 C ATOM 1314 CD1 LEU A 92 11.464 -16.597 -1.076 1.00 0.00 C ATOM 1315 CD2 LEU A 92 13.381 -18.008 -1.953 1.00 0.00 C ATOM 0 H LEU A 92 11.358 -15.591 -5.339 1.00 0.00 H new ATOM 0 HA LEU A 92 13.172 -17.819 -4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 92 10.618 -16.710 -3.551 1.00 0.00 H new ATOM 0 HB3 LEU A 92 11.056 -18.379 -3.246 1.00 0.00 H new ATOM 0 HG LEU A 92 12.863 -16.045 -2.576 1.00 0.00 H new ATOM 0 HD11 LEU A 92 12.104 -16.285 -0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 92 10.787 -15.784 -1.337 1.00 0.00 H new ATOM 0 HD13 LEU A 92 10.884 -17.470 -0.776 1.00 0.00 H new ATOM 0 HD21 LEU A 92 13.983 -17.668 -1.110 1.00 0.00 H new ATOM 0 HD22 LEU A 92 12.886 -18.943 -1.692 1.00 0.00 H new ATOM 0 HD23 LEU A 92 14.025 -18.167 -2.818 1.00 0.00 H new ATOM 1326 N THR A 93 12.282 -19.477 -6.135 1.00 0.00 N ATOM 1327 CA THR A 93 11.801 -20.495 -7.056 1.00 0.00 C ATOM 1328 C THR A 93 10.814 -21.428 -6.350 1.00 0.00 C ATOM 1329 O THR A 93 10.893 -21.618 -5.138 1.00 0.00 O ATOM 1330 CB THR A 93 13.017 -21.222 -7.633 1.00 0.00 C ATOM 1331 OG1 THR A 93 13.746 -21.646 -6.485 1.00 0.00 O ATOM 1332 CG2 THR A 93 13.976 -20.274 -8.356 1.00 0.00 C ATOM 0 H THR A 93 13.227 -19.632 -5.783 1.00 0.00 H new ATOM 0 HA THR A 93 11.247 -20.051 -7.883 1.00 0.00 H new ATOM 0 HB THR A 93 12.683 -21.997 -8.323 1.00 0.00 H new ATOM 0 HG1 THR A 93 14.551 -22.128 -6.768 1.00 0.00 H new ATOM 0 HG21 THR A 93 14.822 -20.840 -8.747 1.00 0.00 H new ATOM 0 HG22 THR A 93 13.454 -19.787 -9.180 1.00 0.00 H new ATOM 0 HG23 THR A 93 14.336 -19.519 -7.658 1.00 0.00 H new ATOM 1340 N LYS A 94 9.908 -21.985 -7.140 1.00 0.00 N ATOM 1341 CA LYS A 94 8.906 -22.893 -6.608 1.00 0.00 C ATOM 1342 C LYS A 94 9.471 -23.600 -5.374 1.00 0.00 C ATOM 1343 O LYS A 94 9.159 -23.230 -4.244 1.00 0.00 O ATOM 1344 CB LYS A 94 8.418 -23.851 -7.696 1.00 0.00 C ATOM 1345 CG LYS A 94 7.131 -24.558 -7.267 1.00 0.00 C ATOM 1346 CD LYS A 94 7.347 -26.067 -7.152 1.00 0.00 C ATOM 1347 CE LYS A 94 7.170 -26.752 -8.508 1.00 0.00 C ATOM 1348 NZ LYS A 94 8.480 -26.930 -9.174 1.00 0.00 N ATOM 0 H LYS A 94 9.847 -21.825 -8.145 1.00 0.00 H new ATOM 0 HA LYS A 94 8.024 -22.340 -6.285 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.243 -23.299 -8.620 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.190 -24.591 -7.907 1.00 0.00 H new ATOM 0 HG2 LYS A 94 6.796 -24.161 -6.309 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.341 -24.354 -7.990 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.347 -26.266 -6.768 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.641 -26.485 -6.435 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.690 -27.721 -8.373 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.512 -26.156 -9.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.372 -27.569 -9.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.830 -26.008 -9.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.159 -27.338 -8.501 1.00 0.00 H new ATOM 1358 N GLU A 95 10.294 -24.606 -5.633 1.00 0.00 N ATOM 1359 CA GLU A 95 10.905 -25.369 -4.558 1.00 0.00 C ATOM 1360 C GLU A 95 11.268 -24.447 -3.393 1.00 0.00 C ATOM 1361 O GLU A 95 10.887 -24.703 -2.252 1.00 0.00 O ATOM 1362 CB GLU A 95 12.134 -26.132 -5.057 1.00 0.00 C ATOM 1363 CG GLU A 95 11.735 -27.479 -5.662 1.00 0.00 C ATOM 1364 CD GLU A 95 12.968 -28.267 -6.109 1.00 0.00 C ATOM 1365 OE1 GLU A 95 13.605 -28.942 -5.285 1.00 0.00 O ATOM 1366 OE2 GLU A 95 13.259 -28.161 -7.360 1.00 0.00 O ATOM 0 H GLU A 95 10.552 -24.910 -6.572 1.00 0.00 H new ATOM 0 HA GLU A 95 10.182 -26.103 -4.203 1.00 0.00 H new ATOM 0 HB2 GLU A 95 12.659 -25.535 -5.803 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.827 -26.291 -4.231 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.175 -28.059 -4.929 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.074 -27.318 -6.514 1.00 0.00 H new ATOM 1372 N GLU A 96 12.000 -23.392 -3.720 1.00 0.00 N ATOM 1373 CA GLU A 96 12.418 -22.430 -2.715 1.00 0.00 C ATOM 1374 C GLU A 96 11.214 -21.956 -1.899 1.00 0.00 C ATOM 1375 O GLU A 96 11.133 -22.212 -0.699 1.00 0.00 O ATOM 1376 CB GLU A 96 13.146 -21.247 -3.357 1.00 0.00 C ATOM 1377 CG GLU A 96 14.658 -21.354 -3.148 1.00 0.00 C ATOM 1378 CD GLU A 96 15.365 -20.073 -3.598 1.00 0.00 C ATOM 1379 OE1 GLU A 96 16.119 -19.475 -2.818 1.00 0.00 O ATOM 1380 OE2 GLU A 96 15.108 -19.705 -4.808 1.00 0.00 O ATOM 0 H GLU A 96 12.314 -23.182 -4.667 1.00 0.00 H new ATOM 0 HA GLU A 96 13.118 -22.922 -2.040 1.00 0.00 H new ATOM 0 HB2 GLU A 96 12.924 -21.215 -4.424 1.00 0.00 H new ATOM 0 HB3 GLU A 96 12.781 -20.314 -2.927 1.00 0.00 H new ATOM 0 HG2 GLU A 96 14.871 -21.541 -2.095 1.00 0.00 H new ATOM 0 HG3 GLU A 96 15.047 -22.204 -3.708 1.00 0.00 H new ATOM 1386 N VAL A 97 10.308 -21.274 -2.584 1.00 0.00 N ATOM 1387 CA VAL A 97 9.110 -20.763 -1.938 1.00 0.00 C ATOM 1388 C VAL A 97 8.387 -21.910 -1.232 1.00 0.00 C ATOM 1389 O VAL A 97 8.318 -21.945 -0.005 1.00 0.00 O ATOM 1390 CB VAL A 97 8.232 -20.041 -2.961 1.00 0.00 C ATOM 1391 CG1 VAL A 97 6.755 -20.119 -2.569 1.00 0.00 C ATOM 1392 CG2 VAL A 97 8.676 -18.587 -3.137 1.00 0.00 C ATOM 0 H VAL A 97 10.379 -21.063 -3.579 1.00 0.00 H new ATOM 0 HA VAL A 97 9.371 -20.027 -1.177 1.00 0.00 H new ATOM 0 HB VAL A 97 8.352 -20.546 -3.919 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.153 -19.598 -3.313 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.446 -21.163 -2.519 1.00 0.00 H new ATOM 0 HG13 VAL A 97 6.612 -19.652 -1.595 1.00 0.00 H new ATOM 0 HG21 VAL A 97 8.035 -18.097 -3.870 1.00 0.00 H new ATOM 0 HG22 VAL A 97 8.601 -18.066 -2.183 1.00 0.00 H new ATOM 0 HG23 VAL A 97 9.709 -18.561 -3.484 1.00 0.00 H new ATOM 1402 N THR A 98 7.864 -22.822 -2.039 1.00 0.00 N ATOM 1403 CA THR A 98 7.148 -23.969 -1.507 1.00 0.00 C ATOM 1404 C THR A 98 7.698 -24.352 -0.131 1.00 0.00 C ATOM 1405 O THR A 98 6.944 -24.461 0.834 1.00 0.00 O ATOM 1406 CB THR A 98 7.237 -25.101 -2.533 1.00 0.00 C ATOM 1407 OG1 THR A 98 8.624 -25.170 -2.854 1.00 0.00 O ATOM 1408 CG2 THR A 98 6.565 -24.741 -3.860 1.00 0.00 C ATOM 0 H THR A 98 7.922 -22.790 -3.057 1.00 0.00 H new ATOM 0 HA THR A 98 6.095 -23.737 -1.348 1.00 0.00 H new ATOM 0 HB THR A 98 6.775 -26.000 -2.124 1.00 0.00 H new ATOM 0 HG1 THR A 98 8.960 -24.270 -3.047 1.00 0.00 H new ATOM 0 HG21 THR A 98 6.656 -25.578 -4.553 1.00 0.00 H new ATOM 0 HG22 THR A 98 5.510 -24.526 -3.687 1.00 0.00 H new ATOM 0 HG23 THR A 98 7.049 -23.862 -4.286 1.00 0.00 H new ATOM 1416 N THR A 99 9.008 -24.544 -0.087 1.00 0.00 N ATOM 1417 CA THR A 99 9.669 -24.912 1.154 1.00 0.00 C ATOM 1418 C THR A 99 9.626 -23.748 2.146 1.00 0.00 C ATOM 1419 O THR A 99 9.218 -23.921 3.293 1.00 0.00 O ATOM 1420 CB THR A 99 11.089 -25.371 0.816 1.00 0.00 C ATOM 1421 OG1 THR A 99 11.216 -26.624 1.481 1.00 0.00 O ATOM 1422 CG2 THR A 99 12.158 -24.491 1.467 1.00 0.00 C ATOM 0 H THR A 99 9.630 -24.452 -0.890 1.00 0.00 H new ATOM 0 HA THR A 99 9.155 -25.737 1.647 1.00 0.00 H new ATOM 0 HB THR A 99 11.225 -25.366 -0.265 1.00 0.00 H new ATOM 0 HG1 THR A 99 12.108 -26.994 1.314 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.147 -24.859 1.196 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.045 -23.464 1.119 1.00 0.00 H new ATOM 0 HG23 THR A 99 12.044 -24.522 2.551 1.00 0.00 H new ATOM 1430 N PHE A 100 10.053 -22.589 1.667 1.00 0.00 N ATOM 1431 CA PHE A 100 10.068 -21.396 2.498 1.00 0.00 C ATOM 1432 C PHE A 100 8.676 -21.104 3.064 1.00 0.00 C ATOM 1433 O PHE A 100 8.447 -21.250 4.262 1.00 0.00 O ATOM 1434 CB PHE A 100 10.497 -20.233 1.602 1.00 0.00 C ATOM 1435 CG PHE A 100 10.548 -18.882 2.319 1.00 0.00 C ATOM 1436 CD1 PHE A 100 11.507 -18.643 3.253 1.00 0.00 C ATOM 1437 CD2 PHE A 100 9.635 -17.919 2.022 1.00 0.00 C ATOM 1438 CE1 PHE A 100 11.554 -17.390 3.918 1.00 0.00 C ATOM 1439 CE2 PHE A 100 9.682 -16.666 2.687 1.00 0.00 C ATOM 1440 CZ PHE A 100 10.641 -16.427 3.621 1.00 0.00 C ATOM 0 H PHE A 100 10.391 -22.450 0.715 1.00 0.00 H new ATOM 0 HA PHE A 100 10.749 -21.535 3.337 1.00 0.00 H new ATOM 0 HB2 PHE A 100 11.482 -20.451 1.188 1.00 0.00 H new ATOM 0 HB3 PHE A 100 9.807 -20.161 0.762 1.00 0.00 H new ATOM 0 HD1 PHE A 100 12.233 -19.407 3.489 1.00 0.00 H new ATOM 0 HD2 PHE A 100 8.874 -18.108 1.280 1.00 0.00 H new ATOM 0 HE1 PHE A 100 12.315 -17.201 4.660 1.00 0.00 H new ATOM 0 HE2 PHE A 100 8.956 -15.902 2.451 1.00 0.00 H new ATOM 0 HZ PHE A 100 10.677 -15.473 4.126 1.00 0.00 H new ATOM 1449 N PHE A 101 7.785 -20.696 2.172 1.00 0.00 N ATOM 1450 CA PHE A 101 6.423 -20.381 2.567 1.00 0.00 C ATOM 1451 C PHE A 101 5.844 -21.478 3.463 1.00 0.00 C ATOM 1452 O PHE A 101 5.092 -21.192 4.393 1.00 0.00 O ATOM 1453 CB PHE A 101 5.593 -20.298 1.284 1.00 0.00 C ATOM 1454 CG PHE A 101 4.939 -18.934 1.053 1.00 0.00 C ATOM 1455 CD1 PHE A 101 5.685 -17.800 1.140 1.00 0.00 C ATOM 1456 CD2 PHE A 101 3.613 -18.856 0.759 1.00 0.00 C ATOM 1457 CE1 PHE A 101 5.078 -16.534 0.926 1.00 0.00 C ATOM 1458 CE2 PHE A 101 3.007 -17.590 0.545 1.00 0.00 C ATOM 1459 CZ PHE A 101 3.752 -16.455 0.633 1.00 0.00 C ATOM 0 H PHE A 101 7.980 -20.576 1.178 1.00 0.00 H new ATOM 0 HA PHE A 101 6.405 -19.445 3.125 1.00 0.00 H new ATOM 0 HB2 PHE A 101 6.234 -20.531 0.433 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.816 -21.061 1.316 1.00 0.00 H new ATOM 0 HD1 PHE A 101 6.738 -17.862 1.372 1.00 0.00 H new ATOM 0 HD2 PHE A 101 3.021 -19.757 0.688 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.670 -15.633 0.996 1.00 0.00 H new ATOM 0 HE2 PHE A 101 1.954 -17.528 0.312 1.00 0.00 H new ATOM 0 HZ PHE A 101 3.291 -15.492 0.470 1.00 0.00 H new ATOM 1468 N LYS A 102 6.218 -22.710 3.153 1.00 0.00 N ATOM 1469 CA LYS A 102 5.746 -23.852 3.919 1.00 0.00 C ATOM 1470 C LYS A 102 6.404 -23.840 5.300 1.00 0.00 C ATOM 1471 O LYS A 102 5.737 -24.051 6.312 1.00 0.00 O ATOM 1472 CB LYS A 102 5.971 -25.149 3.141 1.00 0.00 C ATOM 1473 CG LYS A 102 5.553 -26.364 3.969 1.00 0.00 C ATOM 1474 CD LYS A 102 5.914 -27.668 3.253 1.00 0.00 C ATOM 1475 CE LYS A 102 4.953 -27.941 2.095 1.00 0.00 C ATOM 1476 NZ LYS A 102 5.706 -28.198 0.846 1.00 0.00 N ATOM 0 H LYS A 102 6.843 -22.943 2.381 1.00 0.00 H new ATOM 0 HA LYS A 102 4.670 -23.787 4.078 1.00 0.00 H new ATOM 0 HB2 LYS A 102 5.401 -25.124 2.212 1.00 0.00 H new ATOM 0 HB3 LYS A 102 7.023 -25.235 2.867 1.00 0.00 H new ATOM 0 HG2 LYS A 102 6.044 -26.332 4.942 1.00 0.00 H new ATOM 0 HG3 LYS A 102 4.479 -26.331 4.152 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.935 -27.610 2.877 1.00 0.00 H new ATOM 0 HD3 LYS A 102 5.882 -28.497 3.960 1.00 0.00 H new ATOM 0 HE2 LYS A 102 4.324 -28.800 2.331 1.00 0.00 H new ATOM 0 HE3 LYS A 102 4.289 -27.088 1.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 5.039 -28.381 0.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 6.287 -27.367 0.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.322 -29.026 0.976 1.00 0.00 H new ATOM 1486 N LYS A 103 7.706 -23.592 5.297 1.00 0.00 N ATOM 1487 CA LYS A 103 8.462 -23.551 6.538 1.00 0.00 C ATOM 1488 C LYS A 103 7.949 -22.400 7.404 1.00 0.00 C ATOM 1489 O LYS A 103 8.111 -22.415 8.624 1.00 0.00 O ATOM 1490 CB LYS A 103 9.963 -23.482 6.248 1.00 0.00 C ATOM 1491 CG LYS A 103 10.537 -24.877 5.991 1.00 0.00 C ATOM 1492 CD LYS A 103 11.862 -25.070 6.732 1.00 0.00 C ATOM 1493 CE LYS A 103 12.920 -24.088 6.225 1.00 0.00 C ATOM 1494 NZ LYS A 103 13.026 -22.925 7.133 1.00 0.00 N ATOM 0 H LYS A 103 8.256 -23.418 4.456 1.00 0.00 H new ATOM 0 HA LYS A 103 8.313 -24.469 7.107 1.00 0.00 H new ATOM 0 HB2 LYS A 103 10.140 -22.846 5.380 1.00 0.00 H new ATOM 0 HB3 LYS A 103 10.479 -23.022 7.091 1.00 0.00 H new ATOM 0 HG2 LYS A 103 9.822 -25.634 6.314 1.00 0.00 H new ATOM 0 HG3 LYS A 103 10.690 -25.020 4.921 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.709 -24.926 7.802 1.00 0.00 H new ATOM 0 HD3 LYS A 103 12.214 -26.092 6.595 1.00 0.00 H new ATOM 0 HE2 LYS A 103 13.885 -24.590 6.153 1.00 0.00 H new ATOM 0 HE3 LYS A 103 12.660 -23.751 5.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 14.012 -22.597 7.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 12.416 -22.157 6.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 12.724 -23.202 8.089 1.00 0.00 H new ATOM 1504 N PHE A 104 7.341 -21.427 6.741 1.00 0.00 N ATOM 1505 CA PHE A 104 6.804 -20.269 7.435 1.00 0.00 C ATOM 1506 C PHE A 104 5.391 -20.547 7.951 1.00 0.00 C ATOM 1507 O PHE A 104 4.998 -20.037 9.000 1.00 0.00 O ATOM 1508 CB PHE A 104 6.748 -19.125 6.421 1.00 0.00 C ATOM 1509 CG PHE A 104 7.663 -17.946 6.761 1.00 0.00 C ATOM 1510 CD1 PHE A 104 7.270 -17.023 7.679 1.00 0.00 C ATOM 1511 CD2 PHE A 104 8.869 -17.822 6.144 1.00 0.00 C ATOM 1512 CE1 PHE A 104 8.119 -15.930 7.994 1.00 0.00 C ATOM 1513 CE2 PHE A 104 9.718 -16.729 6.460 1.00 0.00 C ATOM 1514 CZ PHE A 104 9.325 -15.806 7.377 1.00 0.00 C ATOM 0 H PHE A 104 7.208 -21.417 5.730 1.00 0.00 H new ATOM 0 HA PHE A 104 7.433 -20.023 8.290 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.019 -19.511 5.438 1.00 0.00 H new ATOM 0 HB3 PHE A 104 5.721 -18.766 6.350 1.00 0.00 H new ATOM 0 HD1 PHE A 104 6.312 -17.122 8.168 1.00 0.00 H new ATOM 0 HD2 PHE A 104 9.180 -18.555 5.414 1.00 0.00 H new ATOM 0 HE1 PHE A 104 7.808 -15.197 8.723 1.00 0.00 H new ATOM 0 HE2 PHE A 104 10.676 -16.631 5.972 1.00 0.00 H new ATOM 0 HZ PHE A 104 9.970 -14.974 7.616 1.00 0.00 H new ATOM 1523 N GLY A 105 4.666 -21.355 7.192 1.00 0.00 N ATOM 1524 CA GLY A 105 3.305 -21.706 7.560 1.00 0.00 C ATOM 1525 C GLY A 105 2.327 -21.365 6.433 1.00 0.00 C ATOM 1526 O GLY A 105 1.262 -20.801 6.680 1.00 0.00 O ATOM 0 H GLY A 105 4.995 -21.777 6.324 1.00 0.00 H new ATOM 0 HA2 GLY A 105 3.249 -22.771 7.786 1.00 0.00 H new ATOM 0 HA3 GLY A 105 3.021 -21.173 8.467 1.00 0.00 H new ATOM 1530 N TYR A 106 2.724 -21.719 5.220 1.00 0.00 N ATOM 1531 CA TYR A 106 1.896 -21.457 4.055 1.00 0.00 C ATOM 1532 C TYR A 106 1.887 -22.659 3.107 1.00 0.00 C ATOM 1533 O TYR A 106 2.176 -22.520 1.921 1.00 0.00 O ATOM 1534 CB TYR A 106 2.536 -20.265 3.342 1.00 0.00 C ATOM 1535 CG TYR A 106 2.640 -19.006 4.204 1.00 0.00 C ATOM 1536 CD1 TYR A 106 1.494 -18.386 4.660 1.00 0.00 C ATOM 1537 CD2 TYR A 106 3.877 -18.489 4.526 1.00 0.00 C ATOM 1538 CE1 TYR A 106 1.590 -17.201 5.472 1.00 0.00 C ATOM 1539 CE2 TYR A 106 3.974 -17.304 5.338 1.00 0.00 C ATOM 1540 CZ TYR A 106 2.825 -16.718 5.771 1.00 0.00 C ATOM 1541 OH TYR A 106 2.916 -15.598 6.537 1.00 0.00 O ATOM 0 H TYR A 106 3.608 -22.185 5.018 1.00 0.00 H new ATOM 0 HA TYR A 106 0.866 -21.262 4.353 1.00 0.00 H new ATOM 0 HB2 TYR A 106 3.534 -20.548 3.008 1.00 0.00 H new ATOM 0 HB3 TYR A 106 1.955 -20.034 2.449 1.00 0.00 H new ATOM 0 HD1 TYR A 106 0.525 -18.790 4.407 1.00 0.00 H new ATOM 0 HD2 TYR A 106 4.774 -18.973 4.169 1.00 0.00 H new ATOM 0 HE1 TYR A 106 0.701 -16.707 5.835 1.00 0.00 H new ATOM 0 HE2 TYR A 106 4.937 -16.890 5.597 1.00 0.00 H new ATOM 0 HH TYR A 106 3.545 -15.755 7.272 1.00 0.00 H new ATOM 1550 N GLU A 107 1.552 -23.812 3.668 1.00 0.00 N ATOM 1551 CA GLU A 107 1.501 -25.036 2.888 1.00 0.00 C ATOM 1552 C GLU A 107 0.299 -25.014 1.942 1.00 0.00 C ATOM 1553 O GLU A 107 0.394 -25.468 0.803 1.00 0.00 O ATOM 1554 CB GLU A 107 1.459 -26.266 3.799 1.00 0.00 C ATOM 1555 CG GLU A 107 2.056 -27.488 3.099 1.00 0.00 C ATOM 1556 CD GLU A 107 1.143 -28.706 3.249 1.00 0.00 C ATOM 1557 OE1 GLU A 107 1.551 -29.717 3.840 1.00 0.00 O ATOM 1558 OE2 GLU A 107 -0.029 -28.577 2.726 1.00 0.00 O ATOM 0 H GLU A 107 1.313 -23.924 4.653 1.00 0.00 H new ATOM 0 HA GLU A 107 2.409 -25.099 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.011 -26.062 4.716 1.00 0.00 H new ATOM 0 HB3 GLU A 107 0.429 -26.475 4.087 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.205 -27.269 2.042 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.037 -27.710 3.520 1.00 0.00 H new ATOM 1564 N LYS A 108 -0.802 -24.479 2.448 1.00 0.00 N ATOM 1565 CA LYS A 108 -2.020 -24.391 1.662 1.00 0.00 C ATOM 1566 C LYS A 108 -1.820 -23.382 0.529 1.00 0.00 C ATOM 1567 O LYS A 108 -2.569 -23.381 -0.447 1.00 0.00 O ATOM 1568 CB LYS A 108 -3.217 -24.076 2.561 1.00 0.00 C ATOM 1569 CG LYS A 108 -4.451 -24.871 2.133 1.00 0.00 C ATOM 1570 CD LYS A 108 -5.572 -23.939 1.670 1.00 0.00 C ATOM 1571 CE LYS A 108 -6.660 -24.716 0.927 1.00 0.00 C ATOM 1572 NZ LYS A 108 -7.444 -25.543 1.872 1.00 0.00 N ATOM 0 H LYS A 108 -0.876 -24.102 3.393 1.00 0.00 H new ATOM 0 HA LYS A 108 -2.243 -25.352 1.198 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -2.970 -24.311 3.596 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -3.436 -23.009 2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -4.186 -25.555 1.327 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -4.801 -25.481 2.966 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -6.007 -23.431 2.531 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -5.162 -23.167 1.018 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -7.321 -24.022 0.408 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -6.206 -25.353 0.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -8.178 -26.064 1.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -6.813 -26.218 2.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -7.893 -24.929 2.581 1.00 0.00 H new ATOM 1582 N VAL A 109 -0.805 -22.547 0.695 1.00 0.00 N ATOM 1583 CA VAL A 109 -0.496 -21.536 -0.301 1.00 0.00 C ATOM 1584 C VAL A 109 0.266 -22.183 -1.459 1.00 0.00 C ATOM 1585 O VAL A 109 0.074 -21.814 -2.616 1.00 0.00 O ATOM 1586 CB VAL A 109 0.270 -20.380 0.347 1.00 0.00 C ATOM 1587 CG1 VAL A 109 0.315 -19.165 -0.581 1.00 0.00 C ATOM 1588 CG2 VAL A 109 -0.337 -20.012 1.702 1.00 0.00 C ATOM 0 H VAL A 109 -0.186 -22.550 1.505 1.00 0.00 H new ATOM 0 HA VAL A 109 -1.412 -21.112 -0.712 1.00 0.00 H new ATOM 0 HB VAL A 109 1.295 -20.710 0.517 1.00 0.00 H new ATOM 0 HG11 VAL A 109 0.865 -18.358 -0.097 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.813 -19.436 -1.512 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.701 -18.834 -0.796 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.226 -19.188 2.141 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -1.375 -19.710 1.566 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -0.294 -20.875 2.366 1.00 0.00 H new ATOM 1598 N VAL A 110 1.116 -23.137 -1.106 1.00 0.00 N ATOM 1599 CA VAL A 110 1.908 -23.838 -2.102 1.00 0.00 C ATOM 1600 C VAL A 110 1.049 -24.097 -3.342 1.00 0.00 C ATOM 1601 O VAL A 110 1.553 -24.085 -4.463 1.00 0.00 O ATOM 1602 CB VAL A 110 2.490 -25.119 -1.500 1.00 0.00 C ATOM 1603 CG1 VAL A 110 3.091 -26.012 -2.588 1.00 0.00 C ATOM 1604 CG2 VAL A 110 3.526 -24.796 -0.421 1.00 0.00 C ATOM 0 H VAL A 110 1.273 -23.440 -0.145 1.00 0.00 H new ATOM 0 HA VAL A 110 2.755 -23.227 -2.415 1.00 0.00 H new ATOM 0 HB VAL A 110 1.675 -25.668 -1.028 1.00 0.00 H new ATOM 0 HG11 VAL A 110 3.498 -26.915 -2.134 1.00 0.00 H new ATOM 0 HG12 VAL A 110 2.316 -26.284 -3.305 1.00 0.00 H new ATOM 0 HG13 VAL A 110 3.888 -25.474 -3.101 1.00 0.00 H new ATOM 0 HG21 VAL A 110 3.924 -25.724 -0.009 1.00 0.00 H new ATOM 0 HG22 VAL A 110 4.338 -24.215 -0.859 1.00 0.00 H new ATOM 0 HG23 VAL A 110 3.055 -24.219 0.375 1.00 0.00 H new ATOM 1614 N ASP A 111 -0.234 -24.323 -3.096 1.00 0.00 N ATOM 1615 CA ASP A 111 -1.167 -24.585 -4.179 1.00 0.00 C ATOM 1616 C ASP A 111 -1.322 -23.321 -5.028 1.00 0.00 C ATOM 1617 O ASP A 111 -1.082 -23.346 -6.234 1.00 0.00 O ATOM 1618 CB ASP A 111 -2.547 -24.962 -3.636 1.00 0.00 C ATOM 1619 CG ASP A 111 -3.364 -25.891 -4.537 1.00 0.00 C ATOM 1620 OD1 ASP A 111 -4.241 -25.442 -5.290 1.00 0.00 O ATOM 1621 OD2 ASP A 111 -3.065 -27.142 -4.443 1.00 0.00 O ATOM 0 H ASP A 111 -0.648 -24.330 -2.164 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.774 -25.411 -4.772 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.421 -25.441 -2.665 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -3.117 -24.048 -3.469 1.00 0.00 H new ATOM 1626 N GLN A 112 -1.723 -22.246 -4.365 1.00 0.00 N ATOM 1627 CA GLN A 112 -1.914 -20.976 -5.044 1.00 0.00 C ATOM 1628 C GLN A 112 -0.576 -20.448 -5.567 1.00 0.00 C ATOM 1629 O GLN A 112 -0.539 -19.698 -6.542 1.00 0.00 O ATOM 1630 CB GLN A 112 -2.583 -19.956 -4.121 1.00 0.00 C ATOM 1631 CG GLN A 112 -4.097 -19.929 -4.338 1.00 0.00 C ATOM 1632 CD GLN A 112 -4.784 -21.048 -3.552 1.00 0.00 C ATOM 1633 OE1 GLN A 112 -4.656 -22.253 -4.102 1.00 0.00 O flip ATOM 1634 NE2 GLN A 112 -5.389 -20.832 -2.515 1.00 0.00 N flip ATOM 0 H GLN A 112 -1.921 -22.229 -3.365 1.00 0.00 H new ATOM 0 HA GLN A 112 -2.577 -21.136 -5.894 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -2.366 -20.203 -3.082 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -2.168 -18.965 -4.307 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -4.495 -18.963 -4.026 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.318 -20.037 -5.400 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -5.449 -19.882 -2.148 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -5.835 -21.601 -2.015 1.00 0.00 H new ATOM 1641 N ILE A 113 0.489 -20.861 -4.897 1.00 0.00 N ATOM 1642 CA ILE A 113 1.825 -20.439 -5.282 1.00 0.00 C ATOM 1643 C ILE A 113 2.174 -21.045 -6.643 1.00 0.00 C ATOM 1644 O ILE A 113 2.532 -20.325 -7.573 1.00 0.00 O ATOM 1645 CB ILE A 113 2.832 -20.778 -4.181 1.00 0.00 C ATOM 1646 CG1 ILE A 113 2.487 -20.051 -2.879 1.00 0.00 C ATOM 1647 CG2 ILE A 113 4.263 -20.486 -4.638 1.00 0.00 C ATOM 1648 CD1 ILE A 113 2.966 -18.599 -2.918 1.00 0.00 C ATOM 0 H ILE A 113 0.454 -21.484 -4.090 1.00 0.00 H new ATOM 0 HA ILE A 113 1.865 -19.356 -5.395 1.00 0.00 H new ATOM 0 HB ILE A 113 2.770 -21.847 -3.979 1.00 0.00 H new ATOM 0 HG12 ILE A 113 1.409 -20.078 -2.718 1.00 0.00 H new ATOM 0 HG13 ILE A 113 2.948 -20.567 -2.037 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.959 -20.736 -3.837 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.493 -21.086 -5.519 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.358 -19.428 -4.884 1.00 0.00 H new ATOM 0 HD11 ILE A 113 2.708 -18.106 -1.981 1.00 0.00 H new ATOM 0 HD12 ILE A 113 4.047 -18.576 -3.055 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.484 -18.079 -3.746 1.00 0.00 H new ATOM 1659 N MET A 114 2.057 -22.363 -6.716 1.00 0.00 N ATOM 1660 CA MET A 114 2.356 -23.074 -7.947 1.00 0.00 C ATOM 1661 C MET A 114 1.390 -22.669 -9.062 1.00 0.00 C ATOM 1662 O MET A 114 1.751 -22.685 -10.238 1.00 0.00 O ATOM 1663 CB MET A 114 2.253 -24.580 -7.705 1.00 0.00 C ATOM 1664 CG MET A 114 3.353 -25.333 -8.456 1.00 0.00 C ATOM 1665 SD MET A 114 3.193 -27.089 -8.175 1.00 0.00 S ATOM 1666 CE MET A 114 2.710 -27.622 -9.808 1.00 0.00 C ATOM 0 H MET A 114 1.759 -22.957 -5.942 1.00 0.00 H new ATOM 0 HA MET A 114 3.369 -22.816 -8.257 1.00 0.00 H new ATOM 0 HB2 MET A 114 2.330 -24.786 -6.637 1.00 0.00 H new ATOM 0 HB3 MET A 114 1.276 -24.938 -8.029 1.00 0.00 H new ATOM 0 HG2 MET A 114 3.288 -25.120 -9.523 1.00 0.00 H new ATOM 0 HG3 MET A 114 4.332 -24.991 -8.122 1.00 0.00 H new ATOM 0 HE1 MET A 114 2.567 -28.703 -9.811 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.778 -27.132 -10.090 1.00 0.00 H new ATOM 0 HE3 MET A 114 3.489 -27.357 -10.522 1.00 0.00 H new ATOM 1674 N LYS A 115 0.180 -22.315 -8.654 1.00 0.00 N ATOM 1675 CA LYS A 115 -0.840 -21.906 -9.604 1.00 0.00 C ATOM 1676 C LYS A 115 -0.764 -20.392 -9.809 1.00 0.00 C ATOM 1677 O LYS A 115 -1.402 -19.851 -10.710 1.00 0.00 O ATOM 1678 CB LYS A 115 -2.218 -22.397 -9.153 1.00 0.00 C ATOM 1679 CG LYS A 115 -3.058 -22.848 -10.350 1.00 0.00 C ATOM 1680 CD LYS A 115 -3.219 -24.370 -10.366 1.00 0.00 C ATOM 1681 CE LYS A 115 -3.414 -24.885 -11.792 1.00 0.00 C ATOM 1682 NZ LYS A 115 -2.105 -25.089 -12.453 1.00 0.00 N ATOM 0 H LYS A 115 -0.117 -22.303 -7.678 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.663 -22.368 -10.575 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.102 -23.225 -8.453 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -2.736 -21.599 -8.621 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -4.039 -22.376 -10.309 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.585 -22.519 -11.275 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.339 -24.837 -9.924 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.073 -24.655 -9.752 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -3.969 -25.823 -11.774 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -4.010 -24.173 -12.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -2.256 -25.439 -13.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.589 -24.187 -12.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -1.550 -25.785 -11.916 1.00 0.00 H new ATOM 1692 N ALA A 116 0.023 -19.751 -8.957 1.00 0.00 N ATOM 1693 CA ALA A 116 0.191 -18.310 -9.033 1.00 0.00 C ATOM 1694 C ALA A 116 1.094 -17.969 -10.221 1.00 0.00 C ATOM 1695 O ALA A 116 0.688 -17.241 -11.126 1.00 0.00 O ATOM 1696 CB ALA A 116 0.751 -17.790 -7.707 1.00 0.00 C ATOM 0 H ALA A 116 0.551 -20.203 -8.211 1.00 0.00 H new ATOM 0 HA ALA A 116 -0.769 -17.820 -9.196 1.00 0.00 H new ATOM 0 HB1 ALA A 116 0.877 -16.709 -7.764 1.00 0.00 H new ATOM 0 HB2 ALA A 116 0.060 -18.033 -6.900 1.00 0.00 H new ATOM 0 HB3 ALA A 116 1.716 -18.258 -7.511 1.00 0.00 H new ATOM 1702 N ASP A 117 2.303 -18.510 -10.179 1.00 0.00 N ATOM 1703 CA ASP A 117 3.267 -18.272 -11.240 1.00 0.00 C ATOM 1704 C ASP A 117 3.074 -19.316 -12.343 1.00 0.00 C ATOM 1705 O ASP A 117 2.713 -20.459 -12.064 1.00 0.00 O ATOM 1706 CB ASP A 117 4.700 -18.395 -10.720 1.00 0.00 C ATOM 1707 CG ASP A 117 5.788 -18.293 -11.790 1.00 0.00 C ATOM 1708 OD1 ASP A 117 5.759 -19.010 -12.801 1.00 0.00 O ATOM 1709 OD2 ASP A 117 6.707 -17.419 -11.553 1.00 0.00 O ATOM 0 H ASP A 117 2.637 -19.112 -9.427 1.00 0.00 H new ATOM 0 HA ASP A 117 3.106 -17.263 -11.621 1.00 0.00 H new ATOM 0 HB2 ASP A 117 4.869 -17.616 -9.977 1.00 0.00 H new ATOM 0 HB3 ASP A 117 4.804 -19.352 -10.208 1.00 0.00 H new ATOM 1714 N ALA A 118 3.321 -18.885 -13.570 1.00 0.00 N ATOM 1715 CA ALA A 118 3.179 -19.768 -14.716 1.00 0.00 C ATOM 1716 C ALA A 118 3.122 -18.932 -15.995 1.00 0.00 C ATOM 1717 O ALA A 118 2.336 -19.222 -16.896 1.00 0.00 O ATOM 1718 CB ALA A 118 1.936 -20.643 -14.536 1.00 0.00 C ATOM 0 H ALA A 118 3.619 -17.936 -13.797 1.00 0.00 H new ATOM 0 HA ALA A 118 4.038 -20.434 -14.795 1.00 0.00 H new ATOM 0 HB1 ALA A 118 1.830 -21.305 -15.395 1.00 0.00 H new ATOM 0 HB2 ALA A 118 2.039 -21.239 -13.629 1.00 0.00 H new ATOM 0 HB3 ALA A 118 1.053 -20.009 -14.455 1.00 0.00 H new ATOM 1724 N ASN A 119 3.963 -17.909 -16.034 1.00 0.00 N ATOM 1725 CA ASN A 119 4.019 -17.029 -17.188 1.00 0.00 C ATOM 1726 C ASN A 119 5.385 -17.164 -17.864 1.00 0.00 C ATOM 1727 O ASN A 119 5.466 -17.380 -19.072 1.00 0.00 O ATOM 1728 CB ASN A 119 3.840 -15.566 -16.775 1.00 0.00 C ATOM 1729 CG ASN A 119 4.149 -15.375 -15.288 1.00 0.00 C ATOM 1730 OD1 ASN A 119 5.276 -15.509 -14.840 1.00 0.00 O ATOM 1731 ND2 ASN A 119 3.089 -15.057 -14.552 1.00 0.00 N ATOM 0 H ASN A 119 4.612 -17.670 -15.284 1.00 0.00 H new ATOM 0 HA ASN A 119 3.215 -17.314 -17.867 1.00 0.00 H new ATOM 0 HB2 ASN A 119 4.497 -14.933 -17.371 1.00 0.00 H new ATOM 0 HB3 ASN A 119 2.818 -15.248 -16.982 1.00 0.00 H new ATOM 0 HD21 ASN A 119 3.191 -14.909 -13.548 1.00 0.00 H new ATOM 0 HD22 ASN A 119 2.173 -14.961 -14.991 1.00 0.00 H new ATOM 1737 N GLY A 120 6.426 -17.034 -17.054 1.00 0.00 N ATOM 1738 CA GLY A 120 7.785 -17.140 -17.558 1.00 0.00 C ATOM 1739 C GLY A 120 8.803 -16.847 -16.454 1.00 0.00 C ATOM 1740 O GLY A 120 9.842 -16.240 -16.709 1.00 0.00 O ATOM 0 H GLY A 120 6.355 -16.856 -16.052 1.00 0.00 H new ATOM 0 HA2 GLY A 120 7.952 -18.141 -17.956 1.00 0.00 H new ATOM 0 HA3 GLY A 120 7.926 -16.442 -18.383 1.00 0.00 H new ATOM 1744 N ASP A 121 8.470 -17.292 -15.252 1.00 0.00 N ATOM 1745 CA ASP A 121 9.342 -17.086 -14.109 1.00 0.00 C ATOM 1746 C ASP A 121 9.487 -18.400 -13.339 1.00 0.00 C ATOM 1747 O ASP A 121 10.595 -18.790 -12.974 1.00 0.00 O ATOM 1748 CB ASP A 121 8.761 -16.040 -13.155 1.00 0.00 C ATOM 1749 CG ASP A 121 9.023 -14.586 -13.551 1.00 0.00 C ATOM 1750 OD1 ASP A 121 9.895 -14.298 -14.385 1.00 0.00 O ATOM 1751 OD2 ASP A 121 8.277 -13.717 -12.959 1.00 0.00 O ATOM 0 H ASP A 121 7.607 -17.795 -15.045 1.00 0.00 H new ATOM 0 HA ASP A 121 10.307 -16.740 -14.479 1.00 0.00 H new ATOM 0 HB2 ASP A 121 7.684 -16.193 -13.085 1.00 0.00 H new ATOM 0 HB3 ASP A 121 9.173 -16.209 -12.160 1.00 0.00 H new ATOM 1756 N GLY A 122 8.352 -19.046 -13.116 1.00 0.00 N ATOM 1757 CA GLY A 122 8.338 -20.308 -12.396 1.00 0.00 C ATOM 1758 C GLY A 122 8.737 -20.109 -10.932 1.00 0.00 C ATOM 1759 O GLY A 122 8.918 -21.079 -10.197 1.00 0.00 O ATOM 0 H GLY A 122 7.435 -18.719 -13.421 1.00 0.00 H new ATOM 0 HA2 GLY A 122 7.343 -20.750 -12.449 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.024 -21.010 -12.871 1.00 0.00 H new ATOM 1763 N TYR A 123 8.863 -18.846 -10.554 1.00 0.00 N ATOM 1764 CA TYR A 123 9.238 -18.507 -9.191 1.00 0.00 C ATOM 1765 C TYR A 123 8.322 -17.420 -8.624 1.00 0.00 C ATOM 1766 O TYR A 123 7.399 -16.967 -9.300 1.00 0.00 O ATOM 1767 CB TYR A 123 10.666 -17.965 -9.269 1.00 0.00 C ATOM 1768 CG TYR A 123 10.807 -16.702 -10.120 1.00 0.00 C ATOM 1769 CD1 TYR A 123 10.243 -15.516 -9.693 1.00 0.00 C ATOM 1770 CD2 TYR A 123 11.497 -16.747 -11.314 1.00 0.00 C ATOM 1771 CE1 TYR A 123 10.375 -14.327 -10.495 1.00 0.00 C ATOM 1772 CE2 TYR A 123 11.629 -15.558 -12.116 1.00 0.00 C ATOM 1773 CZ TYR A 123 11.062 -14.407 -11.666 1.00 0.00 C ATOM 1774 OH TYR A 123 11.186 -13.283 -12.423 1.00 0.00 O ATOM 0 H TYR A 123 8.712 -18.045 -11.167 1.00 0.00 H new ATOM 0 HA TYR A 123 9.157 -19.379 -8.543 1.00 0.00 H new ATOM 0 HB2 TYR A 123 11.018 -17.752 -8.260 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.316 -18.740 -9.676 1.00 0.00 H new ATOM 0 HD1 TYR A 123 9.703 -15.480 -8.758 1.00 0.00 H new ATOM 0 HD2 TYR A 123 11.938 -17.675 -11.647 1.00 0.00 H new ATOM 0 HE1 TYR A 123 9.938 -13.393 -10.174 1.00 0.00 H new ATOM 0 HE2 TYR A 123 12.166 -15.580 -13.053 1.00 0.00 H new ATOM 0 HH TYR A 123 11.148 -13.522 -13.373 1.00 0.00 H new ATOM 1783 N ILE A 124 8.609 -17.033 -7.391 1.00 0.00 N ATOM 1784 CA ILE A 124 7.824 -16.006 -6.726 1.00 0.00 C ATOM 1785 C ILE A 124 8.760 -15.068 -5.961 1.00 0.00 C ATOM 1786 O ILE A 124 9.568 -15.518 -5.151 1.00 0.00 O ATOM 1787 CB ILE A 124 6.742 -16.644 -5.851 1.00 0.00 C ATOM 1788 CG1 ILE A 124 5.479 -16.935 -6.665 1.00 0.00 C ATOM 1789 CG2 ILE A 124 6.447 -15.777 -4.626 1.00 0.00 C ATOM 1790 CD1 ILE A 124 4.369 -17.494 -5.774 1.00 0.00 C ATOM 0 H ILE A 124 9.375 -17.412 -6.834 1.00 0.00 H new ATOM 0 HA ILE A 124 7.293 -15.398 -7.458 1.00 0.00 H new ATOM 0 HB ILE A 124 7.117 -17.600 -5.486 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.136 -16.021 -7.149 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.709 -17.648 -7.457 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.675 -16.253 -4.021 1.00 0.00 H new ATOM 0 HG22 ILE A 124 7.355 -15.664 -4.033 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.101 -14.795 -4.950 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.483 -17.692 -6.377 1.00 0.00 H new ATOM 0 HD12 ILE A 124 4.707 -18.421 -5.310 1.00 0.00 H new ATOM 0 HD13 ILE A 124 4.125 -16.768 -4.998 1.00 0.00 H new ATOM 1801 N THR A 125 8.619 -13.782 -6.247 1.00 0.00 N ATOM 1802 CA THR A 125 9.442 -12.777 -5.596 1.00 0.00 C ATOM 1803 C THR A 125 8.710 -12.189 -4.388 1.00 0.00 C ATOM 1804 O THR A 125 7.508 -12.394 -4.226 1.00 0.00 O ATOM 1805 CB THR A 125 9.825 -11.730 -6.643 1.00 0.00 C ATOM 1806 OG1 THR A 125 8.754 -10.789 -6.601 1.00 0.00 O ATOM 1807 CG2 THR A 125 9.779 -12.283 -8.069 1.00 0.00 C ATOM 0 H THR A 125 7.948 -13.413 -6.920 1.00 0.00 H new ATOM 0 HA THR A 125 10.359 -13.213 -5.200 1.00 0.00 H new ATOM 0 HB THR A 125 10.826 -11.355 -6.431 1.00 0.00 H new ATOM 0 HG1 THR A 125 8.922 -10.073 -7.249 1.00 0.00 H new ATOM 0 HG21 THR A 125 10.059 -11.499 -8.772 1.00 0.00 H new ATOM 0 HG22 THR A 125 10.475 -13.117 -8.159 1.00 0.00 H new ATOM 0 HG23 THR A 125 8.770 -12.628 -8.293 1.00 0.00 H new ATOM 1815 N LEU A 126 9.466 -11.472 -3.571 1.00 0.00 N ATOM 1816 CA LEU A 126 8.905 -10.853 -2.382 1.00 0.00 C ATOM 1817 C LEU A 126 7.512 -10.309 -2.705 1.00 0.00 C ATOM 1818 O LEU A 126 6.526 -10.712 -2.090 1.00 0.00 O ATOM 1819 CB LEU A 126 9.862 -9.799 -1.823 1.00 0.00 C ATOM 1820 CG LEU A 126 11.242 -10.305 -1.397 1.00 0.00 C ATOM 1821 CD1 LEU A 126 12.340 -9.719 -2.288 1.00 0.00 C ATOM 1822 CD2 LEU A 126 11.496 -10.023 0.085 1.00 0.00 C ATOM 0 H LEU A 126 10.463 -11.305 -3.709 1.00 0.00 H new ATOM 0 HA LEU A 126 8.784 -11.592 -1.590 1.00 0.00 H new ATOM 0 HB2 LEU A 126 9.998 -9.024 -2.577 1.00 0.00 H new ATOM 0 HB3 LEU A 126 9.388 -9.327 -0.962 1.00 0.00 H new ATOM 0 HG LEU A 126 11.264 -11.387 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 126 13.311 -10.095 -1.964 1.00 0.00 H new ATOM 0 HD12 LEU A 126 12.164 -10.013 -3.323 1.00 0.00 H new ATOM 0 HD13 LEU A 126 12.328 -8.632 -2.213 1.00 0.00 H new ATOM 0 HD21 LEU A 126 12.483 -10.393 0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 126 11.447 -8.949 0.265 1.00 0.00 H new ATOM 0 HD23 LEU A 126 10.739 -10.526 0.686 1.00 0.00 H new ATOM 1833 N GLU A 127 7.475 -9.400 -3.669 1.00 0.00 N ATOM 1834 CA GLU A 127 6.220 -8.797 -4.081 1.00 0.00 C ATOM 1835 C GLU A 127 5.152 -9.875 -4.278 1.00 0.00 C ATOM 1836 O GLU A 127 4.140 -9.885 -3.581 1.00 0.00 O ATOM 1837 CB GLU A 127 6.403 -7.967 -5.353 1.00 0.00 C ATOM 1838 CG GLU A 127 5.264 -6.957 -5.517 1.00 0.00 C ATOM 1839 CD GLU A 127 4.565 -7.134 -6.867 1.00 0.00 C ATOM 1840 OE1 GLU A 127 5.221 -7.075 -7.917 1.00 0.00 O ATOM 1841 OE2 GLU A 127 3.293 -7.340 -6.799 1.00 0.00 O ATOM 0 H GLU A 127 8.295 -9.067 -4.176 1.00 0.00 H new ATOM 0 HA GLU A 127 5.886 -8.123 -3.292 1.00 0.00 H new ATOM 0 HB2 GLU A 127 7.357 -7.442 -5.315 1.00 0.00 H new ATOM 0 HB3 GLU A 127 6.437 -8.626 -6.220 1.00 0.00 H new ATOM 0 HG2 GLU A 127 4.542 -7.083 -4.710 1.00 0.00 H new ATOM 0 HG3 GLU A 127 5.657 -5.944 -5.437 1.00 0.00 H new ATOM 1847 N GLU A 128 5.415 -10.755 -5.233 1.00 0.00 N ATOM 1848 CA GLU A 128 4.489 -11.834 -5.531 1.00 0.00 C ATOM 1849 C GLU A 128 3.805 -12.316 -4.250 1.00 0.00 C ATOM 1850 O GLU A 128 2.606 -12.115 -4.070 1.00 0.00 O ATOM 1851 CB GLU A 128 5.202 -12.988 -6.239 1.00 0.00 C ATOM 1852 CG GLU A 128 4.511 -13.331 -7.561 1.00 0.00 C ATOM 1853 CD GLU A 128 5.483 -13.214 -8.735 1.00 0.00 C ATOM 1854 OE1 GLU A 128 6.618 -13.707 -8.653 1.00 0.00 O ATOM 1855 OE2 GLU A 128 5.023 -12.584 -9.762 1.00 0.00 O ATOM 0 H GLU A 128 6.256 -10.743 -5.810 1.00 0.00 H new ATOM 0 HA GLU A 128 3.723 -11.453 -6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 128 6.241 -12.718 -6.427 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.213 -13.865 -5.592 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.112 -14.344 -7.514 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.665 -12.662 -7.717 1.00 0.00 H new ATOM 1861 N PHE A 129 4.598 -12.942 -3.393 1.00 0.00 N ATOM 1862 CA PHE A 129 4.085 -13.454 -2.134 1.00 0.00 C ATOM 1863 C PHE A 129 3.188 -12.422 -1.447 1.00 0.00 C ATOM 1864 O PHE A 129 2.058 -12.730 -1.070 1.00 0.00 O ATOM 1865 CB PHE A 129 5.294 -13.737 -1.240 1.00 0.00 C ATOM 1866 CG PHE A 129 5.369 -12.849 0.004 1.00 0.00 C ATOM 1867 CD1 PHE A 129 4.358 -12.866 0.914 1.00 0.00 C ATOM 1868 CD2 PHE A 129 6.446 -12.043 0.200 1.00 0.00 C ATOM 1869 CE1 PHE A 129 4.427 -12.042 2.068 1.00 0.00 C ATOM 1870 CE2 PHE A 129 6.515 -11.218 1.355 1.00 0.00 C ATOM 1871 CZ PHE A 129 5.505 -11.236 2.264 1.00 0.00 C ATOM 0 H PHE A 129 5.593 -13.106 -3.546 1.00 0.00 H new ATOM 0 HA PHE A 129 3.491 -14.351 -2.311 1.00 0.00 H new ATOM 0 HB2 PHE A 129 5.266 -14.781 -0.928 1.00 0.00 H new ATOM 0 HB3 PHE A 129 6.204 -13.604 -1.824 1.00 0.00 H new ATOM 0 HD1 PHE A 129 3.503 -13.507 0.759 1.00 0.00 H new ATOM 0 HD2 PHE A 129 7.249 -12.030 -0.522 1.00 0.00 H new ATOM 0 HE1 PHE A 129 3.624 -12.055 2.790 1.00 0.00 H new ATOM 0 HE2 PHE A 129 7.370 -10.577 1.510 1.00 0.00 H new ATOM 0 HZ PHE A 129 5.558 -10.610 3.142 1.00 0.00 H new ATOM 1880 N LEU A 130 3.725 -11.219 -1.308 1.00 0.00 N ATOM 1881 CA LEU A 130 2.986 -10.140 -0.674 1.00 0.00 C ATOM 1882 C LEU A 130 1.752 -9.808 -1.515 1.00 0.00 C ATOM 1883 O LEU A 130 0.774 -9.267 -1.003 1.00 0.00 O ATOM 1884 CB LEU A 130 3.902 -8.939 -0.425 1.00 0.00 C ATOM 1885 CG LEU A 130 3.204 -7.586 -0.269 1.00 0.00 C ATOM 1886 CD1 LEU A 130 4.003 -6.662 0.653 1.00 0.00 C ATOM 1887 CD2 LEU A 130 2.940 -6.944 -1.632 1.00 0.00 C ATOM 0 H LEU A 130 4.662 -10.968 -1.623 1.00 0.00 H new ATOM 0 HA LEU A 130 2.628 -10.449 0.308 1.00 0.00 H new ATOM 0 HB2 LEU A 130 4.484 -9.132 0.476 1.00 0.00 H new ATOM 0 HB3 LEU A 130 4.609 -8.868 -1.252 1.00 0.00 H new ATOM 0 HG LEU A 130 2.235 -7.754 0.201 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.486 -5.707 0.748 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.098 -7.122 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.995 -6.498 0.232 1.00 0.00 H new ATOM 0 HD21 LEU A 130 2.443 -5.984 -1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.886 -6.791 -2.151 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.302 -7.599 -2.225 1.00 0.00 H new ATOM 1898 N ALA A 131 1.838 -10.147 -2.793 1.00 0.00 N ATOM 1899 CA ALA A 131 0.740 -9.892 -3.711 1.00 0.00 C ATOM 1900 C ALA A 131 -0.433 -10.809 -3.362 1.00 0.00 C ATOM 1901 O ALA A 131 -1.584 -10.375 -3.357 1.00 0.00 O ATOM 1902 CB ALA A 131 1.224 -10.085 -5.150 1.00 0.00 C ATOM 0 H ALA A 131 2.651 -10.596 -3.215 1.00 0.00 H new ATOM 0 HA ALA A 131 0.392 -8.863 -3.619 1.00 0.00 H new ATOM 0 HB1 ALA A 131 0.401 -9.894 -5.839 1.00 0.00 H new ATOM 0 HB2 ALA A 131 2.039 -9.391 -5.356 1.00 0.00 H new ATOM 0 HB3 ALA A 131 1.577 -11.108 -5.281 1.00 0.00 H new ATOM 1908 N PHE A 132 -0.101 -12.061 -3.079 1.00 0.00 N ATOM 1909 CA PHE A 132 -1.113 -13.042 -2.730 1.00 0.00 C ATOM 1910 C PHE A 132 -1.912 -12.594 -1.504 1.00 0.00 C ATOM 1911 O PHE A 132 -3.082 -12.944 -1.359 1.00 0.00 O ATOM 1912 CB PHE A 132 -0.380 -14.343 -2.398 1.00 0.00 C ATOM 1913 CG PHE A 132 -1.264 -15.407 -1.745 1.00 0.00 C ATOM 1914 CD1 PHE A 132 -1.415 -15.431 -0.393 1.00 0.00 C ATOM 1915 CD2 PHE A 132 -1.899 -16.331 -2.517 1.00 0.00 C ATOM 1916 CE1 PHE A 132 -2.236 -16.419 0.212 1.00 0.00 C ATOM 1917 CE2 PHE A 132 -2.719 -17.319 -1.911 1.00 0.00 C ATOM 1918 CZ PHE A 132 -2.871 -17.342 -0.559 1.00 0.00 C ATOM 0 H PHE A 132 0.855 -12.417 -3.085 1.00 0.00 H new ATOM 0 HA PHE A 132 -1.810 -13.168 -3.559 1.00 0.00 H new ATOM 0 HB2 PHE A 132 0.046 -14.752 -3.314 1.00 0.00 H new ATOM 0 HB3 PHE A 132 0.453 -14.119 -1.732 1.00 0.00 H new ATOM 0 HD1 PHE A 132 -0.910 -14.699 0.220 1.00 0.00 H new ATOM 0 HD2 PHE A 132 -1.779 -16.313 -3.590 1.00 0.00 H new ATOM 0 HE1 PHE A 132 -2.356 -16.438 1.285 1.00 0.00 H new ATOM 0 HE2 PHE A 132 -3.222 -18.053 -2.523 1.00 0.00 H new ATOM 0 HZ PHE A 132 -3.496 -18.093 -0.098 1.00 0.00 H new ATOM 1927 N ASN A 133 -1.247 -11.827 -0.652 1.00 0.00 N ATOM 1928 CA ASN A 133 -1.881 -11.328 0.556 1.00 0.00 C ATOM 1929 C ASN A 133 -1.570 -9.837 0.712 1.00 0.00 C ATOM 1930 O ASN A 133 -0.842 -9.443 1.621 1.00 0.00 O ATOM 1931 CB ASN A 133 -1.352 -12.052 1.795 1.00 0.00 C ATOM 1932 CG ASN A 133 -2.146 -13.332 2.062 1.00 0.00 C ATOM 1933 OD1 ASN A 133 -3.314 -13.451 1.727 1.00 0.00 O ATOM 1934 ND2 ASN A 133 -1.451 -14.282 2.682 1.00 0.00 N ATOM 0 H ASN A 133 -0.276 -11.539 -0.775 1.00 0.00 H new ATOM 0 HA ASN A 133 -2.954 -11.499 0.468 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -0.299 -12.295 1.656 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -1.416 -11.393 2.661 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -1.893 -15.174 2.904 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -0.477 -14.118 2.935 1.00 0.00 H new ATOM 1940 N LEU A 134 -2.136 -9.050 -0.191 1.00 0.00 N ATOM 1941 CA LEU A 134 -1.929 -7.612 -0.165 1.00 0.00 C ATOM 1942 C LEU A 134 -3.187 -6.928 0.372 1.00 0.00 C ATOM 1943 O LEU A 134 -3.379 -6.836 1.584 1.00 0.00 O ATOM 1944 CB LEU A 134 -1.496 -7.108 -1.544 1.00 0.00 C ATOM 1945 CG LEU A 134 -2.493 -7.332 -2.683 1.00 0.00 C ATOM 1946 CD1 LEU A 134 -3.644 -6.326 -2.608 1.00 0.00 C ATOM 1947 CD2 LEU A 134 -1.791 -7.300 -4.041 1.00 0.00 C ATOM 0 H LEU A 134 -2.738 -9.381 -0.945 1.00 0.00 H new ATOM 0 HA LEU A 134 -1.114 -7.357 0.513 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.292 -6.040 -1.471 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -0.557 -7.594 -1.808 1.00 0.00 H new ATOM 0 HG LEU A 134 -2.925 -8.326 -2.569 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.339 -6.506 -3.428 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -4.166 -6.441 -1.658 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -3.248 -5.313 -2.684 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -2.523 -7.462 -4.833 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -1.313 -6.330 -4.181 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -1.036 -8.085 -4.079 1.00 0.00 H new