USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 838 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: B 160 ASN : amide:sc= -0.265 X(o=-0.56,f=-0.47) USER MOD Set 1.2: B 162 GLN : amide:sc= -0.292 X(o=-0.56,f=-0.41) USER MOD Set 2.1: B 107 THR OG1 : rot -55:sc= -0.254 USER MOD Set 2.2: B 109 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 6 MET CE :methyl -102:sc= -8.83! (180deg=-6.81!) USER MOD Set 3.2: A 15 MET CE :methyl 145:sc= -6.04! (180deg=-5.79!) USER MOD Set 4.1: A 10 GLN : amide:sc= -5.77! C(o=-15!,f=-17!) USER MOD Set 4.2: A 11 HIS : no HD1:sc= -8.83! C(o=-15!,f=-15!) USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.094 (180deg=0) USER MOD Single : A 2 SER OG : rot 40:sc= 0.235 USER MOD Single : A 3 THR OG1 : rot -64:sc= 0.361 USER MOD Single : A 4 SER OG : rot 180:sc= -1.42 USER MOD Single : A 13 THR OG1 : rot 10:sc= 0.912 USER MOD Single : A 16 ASN :FLIP amide:sc= -4.33 F(o=-5.7!,f=-4.3) USER MOD Single : A 17 GLN :FLIP amide:sc= -3.31! C(o=-4.9!,f=-3.3!) USER MOD Single : A 20 THR OG1 : rot -68:sc= -2.75 USER MOD Single : A 22 HIS : no HD1:sc= -2.44 K(o=-2.4,f=-5.3!) USER MOD Single : A 25 MET CE :methyl 162:sc= -5.86 (180deg=-9.09!) USER MOD Single : A 27 SER OG : rot -52:sc= 0.18 USER MOD Single : A 31 THR OG1 : rot -40:sc= 0.693 USER MOD Single : B 101 MET CE :methyl -136:sc= -3.08 (180deg=-4.97!) USER MOD Single : B 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 112 THR OG1 : rot 180:sc= 0 USER MOD Single : B 114 THR OG1 : rot -104:sc= 0.0181 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 122 THR OG1 : rot -170:sc= -1.29 USER MOD Single : B 125 ASN :FLIP amide:sc= 0.273 F(o=-0.9,f=0.27) USER MOD Single : B 127 LYS NZ :NH3+ -158:sc= -0.544 (180deg=-1.71) USER MOD Single : B 129 LYS NZ :NH3+ 164:sc= 1.05 (180deg=0.466) USER MOD Single : B 131 GLN : amide:sc= -0.155 K(o=-0.15,f=-1.6) USER MOD Single : B 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 140 GLN : amide:sc= -9.48! C(o=-9.5!,f=-15!) USER MOD Single : B 141 GLN : amide:sc= -3.36 K(o=-3.4,f=-7.2!) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 149 GLN : amide:sc= 0.462 K(o=0.46,f=-0.43) USER MOD Single : B 155 THR OG1 : rot 180:sc= -1.03 USER MOD Single : B 157 SER OG : rot 180:sc= 0 USER MOD Single : B 159 TYR OH : rot -97:sc= 1.1 USER MOD Single : B 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 165 SER OG : rot -101:sc= -0.115 USER MOD Single : B 166 THR OG1 : rot 180:sc= 0 USER MOD Single : B 168 HIS : no HD1:sc= -0.245 K(o=-0.25,f=-0.86) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 7.945 -20.570 19.490 1.00 0.00 N ATOM 2 CA GLY A 1 7.572 -21.880 18.900 1.00 0.00 C ATOM 3 C GLY A 1 6.458 -21.770 17.879 1.00 0.00 C ATOM 4 O GLY A 1 6.048 -20.660 17.521 1.00 0.00 O ATOM 0 H1 GLY A 1 8.958 -20.395 19.334 1.00 0.00 H new ATOM 0 H2 GLY A 1 7.389 -19.815 19.039 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.749 -20.581 20.511 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.449 -22.323 18.428 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.263 -22.557 19.696 1.00 0.00 H new ATOM 10 N SER A 2 5.967 -22.910 17.407 1.00 0.00 N ATOM 11 CA SER A 2 4.894 -22.930 16.420 1.00 0.00 C ATOM 12 C SER A 2 3.641 -22.250 16.964 1.00 0.00 C ATOM 13 O SER A 2 3.111 -22.640 18.003 1.00 0.00 O ATOM 14 CB SER A 2 4.571 -24.370 16.017 1.00 0.00 C ATOM 15 OG SER A 2 4.217 -25.150 17.147 1.00 0.00 O ATOM 0 H SER A 2 6.295 -23.833 17.692 1.00 0.00 H new ATOM 0 HA SER A 2 5.232 -22.380 15.542 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.752 -24.374 15.297 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.434 -24.814 15.521 1.00 0.00 H new ATOM 0 HG SER A 2 3.661 -24.616 17.752 1.00 0.00 H new ATOM 21 N THR A 3 3.175 -21.230 16.255 1.00 0.00 N ATOM 22 CA THR A 3 1.985 -20.490 16.666 1.00 0.00 C ATOM 23 C THR A 3 1.382 -19.730 15.490 1.00 0.00 C ATOM 24 O THR A 3 1.863 -19.830 14.361 1.00 0.00 O ATOM 25 CB THR A 3 2.326 -19.520 17.797 1.00 0.00 C ATOM 26 OG1 THR A 3 3.664 -19.070 17.683 1.00 0.00 O ATOM 27 CG2 THR A 3 2.161 -20.120 19.175 1.00 0.00 C ATOM 0 H THR A 3 3.602 -20.895 15.392 1.00 0.00 H new ATOM 0 HA THR A 3 1.248 -21.209 17.025 1.00 0.00 H new ATOM 0 HB THR A 3 1.619 -18.697 17.692 1.00 0.00 H new ATOM 0 HG1 THR A 3 4.275 -19.828 17.794 1.00 0.00 H new ATOM 0 HG21 THR A 3 2.420 -19.377 19.929 1.00 0.00 H new ATOM 0 HG22 THR A 3 1.126 -20.433 19.314 1.00 0.00 H new ATOM 0 HG23 THR A 3 2.818 -20.984 19.277 1.00 0.00 H new ATOM 35 N SER A 4 0.328 -18.970 15.762 1.00 0.00 N ATOM 36 CA SER A 4 -0.340 -18.190 14.726 1.00 0.00 C ATOM 37 C SER A 4 0.621 -17.190 14.093 1.00 0.00 C ATOM 38 O SER A 4 1.245 -16.390 14.787 1.00 0.00 O ATOM 39 CB SER A 4 -1.548 -17.450 15.311 1.00 0.00 C ATOM 40 OG SER A 4 -2.616 -17.410 14.381 1.00 0.00 O ATOM 0 H SER A 4 -0.083 -18.877 16.691 1.00 0.00 H new ATOM 0 HA SER A 4 -0.682 -18.879 13.954 1.00 0.00 H new ATOM 0 HB2 SER A 4 -1.875 -17.945 16.225 1.00 0.00 H new ATOM 0 HB3 SER A 4 -1.260 -16.435 15.584 1.00 0.00 H new ATOM 0 HG SER A 4 -3.376 -16.935 14.776 1.00 0.00 H new ATOM 46 N ALA A 5 0.735 -17.240 12.770 1.00 0.00 N ATOM 47 CA ALA A 5 1.621 -16.340 12.042 1.00 0.00 C ATOM 48 C ALA A 5 0.829 -15.410 11.125 1.00 0.00 C ATOM 49 O ALA A 5 -0.398 -15.470 11.076 1.00 0.00 O ATOM 50 CB ALA A 5 2.638 -17.140 11.239 1.00 0.00 C ATOM 0 H ALA A 5 0.224 -17.896 12.179 1.00 0.00 H new ATOM 0 HA ALA A 5 2.151 -15.723 12.768 1.00 0.00 H new ATOM 0 HB1 ALA A 5 3.294 -16.457 10.700 1.00 0.00 H new ATOM 0 HB2 ALA A 5 3.232 -17.756 11.914 1.00 0.00 H new ATOM 0 HB3 ALA A 5 2.117 -17.781 10.527 1.00 0.00 H new ATOM 56 N MET A 6 1.539 -14.560 10.396 1.00 0.00 N ATOM 57 CA MET A 6 0.900 -13.620 9.478 1.00 0.00 C ATOM 58 C MET A 6 0.480 -14.350 8.208 1.00 0.00 C ATOM 59 O MET A 6 0.830 -15.510 8.008 1.00 0.00 O ATOM 60 CB MET A 6 1.848 -12.480 9.110 1.00 0.00 C ATOM 61 CG MET A 6 2.870 -12.130 10.183 1.00 0.00 C ATOM 62 SD MET A 6 4.565 -12.510 9.678 1.00 0.00 S ATOM 63 CE MET A 6 4.511 -12.130 7.923 1.00 0.00 C ATOM 0 H MET A 6 2.557 -14.500 10.421 1.00 0.00 H new ATOM 0 HA MET A 6 0.026 -13.200 9.976 1.00 0.00 H new ATOM 0 HB2 MET A 6 2.378 -12.747 8.196 1.00 0.00 H new ATOM 0 HB3 MET A 6 1.257 -11.592 8.887 1.00 0.00 H new ATOM 0 HG2 MET A 6 2.794 -11.069 10.419 1.00 0.00 H new ATOM 0 HG3 MET A 6 2.635 -12.677 11.096 1.00 0.00 H new ATOM 0 HE1 MET A 6 4.435 -13.056 7.352 1.00 0.00 H new ATOM 0 HE2 MET A 6 3.645 -11.502 7.713 1.00 0.00 H new ATOM 0 HE3 MET A 6 5.420 -11.602 7.637 1.00 0.00 H new ATOM 73 N TRP A 7 -0.249 -13.660 7.338 1.00 0.00 N ATOM 74 CA TRP A 7 -0.675 -14.270 6.084 1.00 0.00 C ATOM 75 C TRP A 7 -0.727 -13.240 4.973 1.00 0.00 C ATOM 76 O TRP A 7 -1.356 -12.190 5.103 1.00 0.00 O ATOM 77 CB TRP A 7 -2.026 -14.980 6.220 1.00 0.00 C ATOM 78 CG TRP A 7 -3.146 -14.100 6.707 1.00 0.00 C ATOM 79 CD1 TRP A 7 -3.500 -13.860 8.007 1.00 0.00 C ATOM 80 CD2 TRP A 7 -4.075 -13.360 5.895 1.00 0.00 C ATOM 81 NE1 TRP A 7 -4.590 -13.020 8.045 1.00 0.00 N ATOM 82 CE2 TRP A 7 -4.952 -12.700 6.768 1.00 0.00 C ATOM 83 CE3 TRP A 7 -4.247 -13.200 4.516 1.00 0.00 C ATOM 84 CZ2 TRP A 7 -5.980 -11.880 6.315 1.00 0.00 C ATOM 85 CZ3 TRP A 7 -5.272 -12.380 4.066 1.00 0.00 C ATOM 86 CH2 TRP A 7 -6.125 -11.730 4.962 1.00 0.00 C ATOM 0 H TRP A 7 -0.553 -12.696 7.473 1.00 0.00 H new ATOM 0 HA TRP A 7 0.068 -15.025 5.827 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -2.303 -15.396 5.251 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -1.914 -15.819 6.907 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -3.000 -14.268 8.873 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -5.053 -12.690 8.892 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -3.596 -13.704 3.817 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -6.641 -11.379 7.007 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -5.413 -12.242 3.004 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -6.913 -11.098 4.580 1.00 0.00 H new ATOM 97 N ALA A 8 -0.055 -13.560 3.880 1.00 0.00 N ATOM 98 CA ALA A 8 -0.009 -12.670 2.728 1.00 0.00 C ATOM 99 C ALA A 8 -1.342 -12.690 1.993 1.00 0.00 C ATOM 100 O ALA A 8 -1.786 -13.730 1.522 1.00 0.00 O ATOM 101 CB ALA A 8 1.119 -13.080 1.792 1.00 0.00 C ATOM 0 H ALA A 8 0.467 -14.429 3.764 1.00 0.00 H new ATOM 0 HA ALA A 8 0.180 -11.655 3.077 1.00 0.00 H new ATOM 0 HB1 ALA A 8 1.143 -12.407 0.935 1.00 0.00 H new ATOM 0 HB2 ALA A 8 2.070 -13.026 2.322 1.00 0.00 H new ATOM 0 HB3 ALA A 8 0.953 -14.101 1.448 1.00 0.00 H new ATOM 107 N CYS A 9 -1.982 -11.520 1.902 1.00 0.00 N ATOM 108 CA CYS A 9 -3.271 -11.410 1.226 1.00 0.00 C ATOM 109 C CYS A 9 -3.252 -12.140 -0.117 1.00 0.00 C ATOM 110 O CYS A 9 -2.188 -12.360 -0.697 1.00 0.00 O ATOM 111 CB CYS A 9 -3.646 -9.958 1.004 1.00 0.00 C ATOM 112 SG CYS A 9 -5.374 -9.726 0.541 1.00 0.00 S ATOM 0 H CYS A 9 -1.629 -10.644 2.286 1.00 0.00 H new ATOM 0 HA CYS A 9 -4.016 -11.875 1.872 1.00 0.00 H new ATOM 0 HB2 CYS A 9 -3.443 -9.395 1.915 1.00 0.00 H new ATOM 0 HB3 CYS A 9 -3.009 -9.542 0.223 1.00 0.00 H new ATOM 117 N GLN A 10 -4.429 -12.520 -0.604 1.00 0.00 N ATOM 118 CA GLN A 10 -4.536 -13.230 -1.876 1.00 0.00 C ATOM 119 C GLN A 10 -5.033 -12.310 -2.994 1.00 0.00 C ATOM 120 O GLN A 10 -5.408 -12.780 -4.068 1.00 0.00 O ATOM 121 CB GLN A 10 -5.475 -14.430 -1.736 1.00 0.00 C ATOM 122 CG GLN A 10 -6.888 -14.040 -1.329 1.00 0.00 C ATOM 123 CD GLN A 10 -7.067 -13.990 0.176 1.00 0.00 C ATOM 124 OE1 GLN A 10 -6.433 -14.740 0.916 1.00 0.00 O ATOM 125 NE2 GLN A 10 -7.933 -13.100 0.637 1.00 0.00 N ATOM 0 H GLN A 10 -5.321 -12.349 -0.139 1.00 0.00 H new ATOM 0 HA GLN A 10 -3.539 -13.579 -2.143 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -5.512 -14.967 -2.684 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -5.067 -15.118 -0.995 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -7.128 -13.065 -1.753 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -7.594 -14.754 -1.752 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -8.438 -12.497 -0.012 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -8.094 -13.018 1.641 1.00 0.00 H new ATOM 134 N HIS A 11 -5.036 -11.000 -2.742 1.00 0.00 N ATOM 135 CA HIS A 11 -5.491 -10.040 -3.739 1.00 0.00 C ATOM 136 C HIS A 11 -4.593 -8.808 -3.771 1.00 0.00 C ATOM 137 O HIS A 11 -4.103 -8.411 -4.828 1.00 0.00 O ATOM 138 CB HIS A 11 -6.926 -9.606 -3.444 1.00 0.00 C ATOM 139 CG HIS A 11 -7.839 -10.730 -3.097 1.00 0.00 C ATOM 140 ND1 HIS A 11 -8.185 -11.730 -3.981 1.00 0.00 N ATOM 141 CD2 HIS A 11 -8.492 -11.000 -1.952 1.00 0.00 C ATOM 142 CE1 HIS A 11 -9.017 -12.560 -3.387 1.00 0.00 C ATOM 143 NE2 HIS A 11 -9.219 -12.140 -2.153 1.00 0.00 N ATOM 0 H HIS A 11 -4.730 -10.585 -1.862 1.00 0.00 H new ATOM 0 HA HIS A 11 -5.448 -10.531 -4.711 1.00 0.00 H new ATOM 0 HB2 HIS A 11 -6.917 -8.892 -2.621 1.00 0.00 H new ATOM 0 HB3 HIS A 11 -7.323 -9.084 -4.315 1.00 0.00 H new ATOM 0 HD2 HIS A 11 -8.450 -10.422 -1.041 1.00 0.00 H new ATOM 0 HE1 HIS A 11 -9.460 -13.437 -3.835 1.00 0.00 H new ATOM 0 HE2 HIS A 11 -9.819 -12.591 -1.463 1.00 0.00 H new ATOM 152 N CYS A 12 -4.391 -8.202 -2.607 1.00 0.00 N ATOM 153 CA CYS A 12 -3.564 -7.008 -2.498 1.00 0.00 C ATOM 154 C CYS A 12 -2.140 -7.356 -2.058 1.00 0.00 C ATOM 155 O CYS A 12 -1.266 -6.491 -2.009 1.00 0.00 O ATOM 156 CB CYS A 12 -4.218 -6.011 -1.529 1.00 0.00 C ATOM 157 SG CYS A 12 -3.841 -6.286 0.219 1.00 0.00 S ATOM 0 H CYS A 12 -4.790 -8.519 -1.724 1.00 0.00 H new ATOM 0 HA CYS A 12 -3.490 -6.544 -3.481 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -3.902 -5.004 -1.799 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -5.299 -6.053 -1.663 1.00 0.00 H new ATOM 162 N THR A 13 -1.917 -8.632 -1.749 1.00 0.00 N ATOM 163 CA THR A 13 -0.605 -9.109 -1.324 1.00 0.00 C ATOM 164 C THR A 13 -0.035 -8.262 -0.187 1.00 0.00 C ATOM 165 O THR A 13 0.937 -7.530 -0.372 1.00 0.00 O ATOM 166 CB THR A 13 0.365 -9.116 -2.506 1.00 0.00 C ATOM 167 OG1 THR A 13 0.614 -7.798 -2.960 1.00 0.00 O ATOM 168 CG2 THR A 13 -0.135 -9.921 -3.686 1.00 0.00 C ATOM 0 H THR A 13 -2.634 -9.357 -1.786 1.00 0.00 H new ATOM 0 HA THR A 13 -0.731 -10.126 -0.953 1.00 0.00 H new ATOM 0 HB THR A 13 1.275 -9.582 -2.128 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.235 -7.156 -2.324 1.00 0.00 H new ATOM 0 HG21 THR A 13 0.601 -9.884 -4.489 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.288 -10.956 -3.381 1.00 0.00 H new ATOM 0 HG23 THR A 13 -1.078 -9.503 -4.038 1.00 0.00 H new ATOM 176 N PHE A 14 -0.644 -8.371 0.988 1.00 0.00 N ATOM 177 CA PHE A 14 -0.199 -7.624 2.153 1.00 0.00 C ATOM 178 C PHE A 14 -0.045 -8.543 3.362 1.00 0.00 C ATOM 179 O PHE A 14 -0.638 -9.620 3.421 1.00 0.00 O ATOM 180 CB PHE A 14 -1.193 -6.501 2.465 1.00 0.00 C ATOM 181 CG PHE A 14 -1.190 -6.056 3.903 1.00 0.00 C ATOM 182 CD1 PHE A 14 -0.231 -5.170 4.368 1.00 0.00 C ATOM 183 CD2 PHE A 14 -2.144 -6.531 4.788 1.00 0.00 C ATOM 184 CE1 PHE A 14 -0.226 -4.765 5.690 1.00 0.00 C ATOM 185 CE2 PHE A 14 -2.143 -6.132 6.110 1.00 0.00 C ATOM 186 CZ PHE A 14 -1.183 -5.247 6.562 1.00 0.00 C ATOM 0 H PHE A 14 -1.450 -8.973 1.157 1.00 0.00 H new ATOM 0 HA PHE A 14 0.775 -7.188 1.931 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -0.966 -5.644 1.831 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -2.196 -6.836 2.202 1.00 0.00 H new ATOM 0 HD1 PHE A 14 0.520 -4.792 3.691 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -2.898 -7.222 4.440 1.00 0.00 H new ATOM 0 HE1 PHE A 14 0.525 -4.073 6.041 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -2.892 -6.511 6.790 1.00 0.00 H new ATOM 0 HZ PHE A 14 -1.181 -4.933 7.595 1.00 0.00 H new ATOM 196 N MET A 15 0.746 -8.095 4.328 1.00 0.00 N ATOM 197 CA MET A 15 0.982 -8.843 5.545 1.00 0.00 C ATOM 198 C MET A 15 -0.127 -8.642 6.563 1.00 0.00 C ATOM 199 O MET A 15 -0.129 -7.664 7.310 1.00 0.00 O ATOM 200 CB MET A 15 2.303 -8.414 6.160 1.00 0.00 C ATOM 201 CG MET A 15 3.452 -9.376 5.952 1.00 0.00 C ATOM 202 SD MET A 15 4.734 -9.139 7.195 1.00 0.00 S ATOM 203 CE MET A 15 3.773 -9.348 8.697 1.00 0.00 C ATOM 0 H MET A 15 1.239 -7.203 4.285 1.00 0.00 H new ATOM 0 HA MET A 15 1.009 -9.900 5.279 1.00 0.00 H new ATOM 0 HB2 MET A 15 2.581 -7.445 5.745 1.00 0.00 H new ATOM 0 HB3 MET A 15 2.158 -8.272 7.231 1.00 0.00 H new ATOM 0 HG2 MET A 15 3.084 -10.401 5.996 1.00 0.00 H new ATOM 0 HG3 MET A 15 3.875 -9.232 4.958 1.00 0.00 H new ATOM 0 HE1 MET A 15 4.384 -9.838 9.455 1.00 0.00 H new ATOM 0 HE2 MET A 15 3.454 -8.372 9.063 1.00 0.00 H new ATOM 0 HE3 MET A 15 2.897 -9.961 8.486 1.00 0.00 H new ATOM 213 N ASN A 16 -1.039 -9.592 6.618 1.00 0.00 N ATOM 214 CA ASN A 16 -2.120 -9.542 7.578 1.00 0.00 C ATOM 215 C ASN A 16 -1.651 -10.220 8.854 1.00 0.00 C ATOM 216 O ASN A 16 -0.562 -10.780 8.882 1.00 0.00 O ATOM 217 CB ASN A 16 -3.352 -10.240 7.014 1.00 0.00 C ATOM 218 CG ASN A 16 -3.695 -9.766 5.617 1.00 0.00 C ATOM 219 OD1 ASN A 16 -3.225 -10.490 4.612 1.00 0.00 O flip ATOM 220 ND2 ASN A 16 -4.375 -8.756 5.444 1.00 0.00 N flip ATOM 0 H ASN A 16 -1.052 -10.409 6.007 1.00 0.00 H new ATOM 0 HA ASN A 16 -2.393 -8.508 7.791 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -3.181 -11.316 6.998 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -4.201 -10.062 7.674 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -4.717 -8.228 6.247 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -4.597 -8.447 4.498 1.00 0.00 H new ATOM 227 N GLN A 17 -2.449 -10.180 9.907 1.00 0.00 N ATOM 228 CA GLN A 17 -2.049 -10.810 11.157 1.00 0.00 C ATOM 229 C GLN A 17 -2.587 -12.230 11.214 1.00 0.00 C ATOM 230 O GLN A 17 -3.331 -12.660 10.347 1.00 0.00 O ATOM 231 CB GLN A 17 -2.521 -10.010 12.366 1.00 0.00 C ATOM 232 CG GLN A 17 -1.763 -8.702 12.575 1.00 0.00 C ATOM 233 CD GLN A 17 -1.431 -7.985 11.277 1.00 0.00 C ATOM 234 OE1 GLN A 17 -0.366 -8.422 10.610 1.00 0.00 O flip ATOM 235 NE2 GLN A 17 -2.125 -7.049 10.879 1.00 0.00 N flip ATOM 0 H GLN A 17 -3.363 -9.727 9.925 1.00 0.00 H new ATOM 0 HA GLN A 17 -0.960 -10.837 11.190 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -3.582 -9.789 12.252 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.418 -10.625 13.260 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -2.359 -8.041 13.205 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -0.839 -8.908 13.115 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -2.933 -6.746 11.422 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -1.892 -6.576 10.006 1.00 0.00 H new ATOM 244 N PRO A 18 -2.197 -13.000 12.226 1.00 0.00 N ATOM 245 CA PRO A 18 -2.629 -14.380 12.380 1.00 0.00 C ATOM 246 C PRO A 18 -4.080 -14.500 12.841 1.00 0.00 C ATOM 247 O PRO A 18 -4.666 -15.580 12.799 1.00 0.00 O ATOM 248 CB PRO A 18 -1.675 -14.950 13.438 1.00 0.00 C ATOM 249 CG PRO A 18 -0.661 -13.870 13.705 1.00 0.00 C ATOM 250 CD PRO A 18 -1.294 -12.580 13.287 1.00 0.00 C ATOM 0 HA PRO A 18 -2.595 -14.915 11.431 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -2.214 -15.213 14.348 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -1.192 -15.859 13.079 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -0.390 -13.845 14.760 1.00 0.00 H new ATOM 0 HG3 PRO A 18 0.256 -14.052 13.144 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -1.828 -12.105 14.110 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -0.555 -11.862 12.930 1.00 0.00 H new ATOM 258 N GLY A 19 -4.660 -13.380 13.272 1.00 0.00 N ATOM 259 CA GLY A 19 -6.040 -13.390 13.723 1.00 0.00 C ATOM 260 C GLY A 19 -6.936 -12.520 12.862 1.00 0.00 C ATOM 261 O GLY A 19 -8.045 -12.170 13.264 1.00 0.00 O ATOM 0 H GLY A 19 -4.200 -12.471 13.316 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.415 -14.413 13.714 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.085 -13.043 14.755 1.00 0.00 H new ATOM 265 N THR A 20 -6.453 -12.170 11.674 1.00 0.00 N ATOM 266 CA THR A 20 -7.214 -11.330 10.758 1.00 0.00 C ATOM 267 C THR A 20 -8.028 -12.170 9.785 1.00 0.00 C ATOM 268 O THR A 20 -7.549 -12.510 8.703 1.00 0.00 O ATOM 269 CB THR A 20 -6.272 -10.410 9.973 1.00 0.00 C ATOM 270 OG1 THR A 20 -4.948 -10.900 10.003 1.00 0.00 O ATOM 271 CG2 THR A 20 -6.239 -8.994 10.494 1.00 0.00 C ATOM 0 H THR A 20 -5.538 -12.455 11.324 1.00 0.00 H new ATOM 0 HA THR A 20 -7.900 -10.728 11.354 1.00 0.00 H new ATOM 0 HB THR A 20 -6.670 -10.400 8.958 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.593 -10.828 10.914 1.00 0.00 H new ATOM 0 HG21 THR A 20 -5.552 -8.400 9.891 1.00 0.00 H new ATOM 0 HG22 THR A 20 -7.238 -8.562 10.437 1.00 0.00 H new ATOM 0 HG23 THR A 20 -5.903 -8.996 11.531 1.00 0.00 H new ATOM 279 N GLY A 21 -9.265 -12.490 10.161 1.00 0.00 N ATOM 280 CA GLY A 21 -10.120 -13.280 9.283 1.00 0.00 C ATOM 281 C GLY A 21 -10.090 -12.740 7.867 1.00 0.00 C ATOM 282 O GLY A 21 -9.958 -13.490 6.903 1.00 0.00 O ATOM 0 H GLY A 21 -9.689 -12.220 11.049 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -9.791 -14.319 9.287 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -11.143 -13.269 9.659 1.00 0.00 H new ATOM 286 N HIS A 22 -10.200 -11.420 7.756 1.00 0.00 N ATOM 287 CA HIS A 22 -10.170 -10.740 6.479 1.00 0.00 C ATOM 288 C HIS A 22 -8.929 -9.873 6.418 1.00 0.00 C ATOM 289 O HIS A 22 -8.158 -9.815 7.376 1.00 0.00 O ATOM 290 CB HIS A 22 -11.410 -9.883 6.293 1.00 0.00 C ATOM 291 CG HIS A 22 -12.700 -10.640 6.255 1.00 0.00 C ATOM 292 ND1 HIS A 22 -12.990 -11.690 7.106 1.00 0.00 N ATOM 293 CD2 HIS A 22 -13.780 -10.500 5.456 1.00 0.00 C ATOM 294 CE1 HIS A 22 -14.200 -12.150 6.826 1.00 0.00 C ATOM 295 NE2 HIS A 22 -14.700 -11.450 5.829 1.00 0.00 N ATOM 0 H HIS A 22 -10.312 -10.796 8.555 1.00 0.00 H new ATOM 0 HA HIS A 22 -10.150 -11.481 5.679 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -11.456 -9.156 7.104 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.309 -9.320 5.365 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -13.899 -9.773 4.667 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -14.695 -12.965 7.332 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -15.617 -11.590 5.405 1.00 0.00 H new ATOM 304 N CYS A 23 -8.739 -9.184 5.306 1.00 0.00 N ATOM 305 CA CYS A 23 -7.587 -8.308 5.154 1.00 0.00 C ATOM 306 C CYS A 23 -7.881 -6.937 5.751 1.00 0.00 C ATOM 307 O CYS A 23 -8.971 -6.394 5.575 1.00 0.00 O ATOM 308 CB CYS A 23 -7.217 -8.168 3.679 1.00 0.00 C ATOM 309 SG CYS A 23 -5.689 -7.246 3.376 1.00 0.00 S ATOM 0 H CYS A 23 -9.362 -9.213 4.499 1.00 0.00 H new ATOM 0 HA CYS A 23 -6.745 -8.750 5.687 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -7.119 -9.163 3.246 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -8.036 -7.673 3.157 1.00 0.00 H new ATOM 314 N GLU A 24 -6.902 -6.379 6.454 1.00 0.00 N ATOM 315 CA GLU A 24 -7.062 -5.065 7.072 1.00 0.00 C ATOM 316 C GLU A 24 -6.707 -3.948 6.095 1.00 0.00 C ATOM 317 O GLU A 24 -6.497 -2.803 6.496 1.00 0.00 O ATOM 318 CB GLU A 24 -6.189 -4.946 8.321 1.00 0.00 C ATOM 319 CG GLU A 24 -4.815 -5.581 8.179 1.00 0.00 C ATOM 320 CD GLU A 24 -3.870 -5.183 9.296 1.00 0.00 C ATOM 321 OE1 GLU A 24 -4.132 -5.560 10.458 1.00 0.00 O ATOM 322 OE2 GLU A 24 -2.868 -4.495 9.010 1.00 0.00 O ATOM 0 H GLU A 24 -5.992 -6.813 6.611 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.110 -4.962 7.354 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -6.067 -3.891 8.567 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -6.708 -5.411 9.160 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.920 -6.666 8.166 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.382 -5.291 7.221 1.00 0.00 H new ATOM 329 N MET A 25 -6.637 -4.288 4.814 1.00 0.00 N ATOM 330 CA MET A 25 -6.304 -3.321 3.780 1.00 0.00 C ATOM 331 C MET A 25 -7.398 -3.252 2.718 1.00 0.00 C ATOM 332 O MET A 25 -8.020 -2.207 2.527 1.00 0.00 O ATOM 333 CB MET A 25 -4.966 -3.681 3.130 1.00 0.00 C ATOM 334 CG MET A 25 -3.909 -4.132 4.125 1.00 0.00 C ATOM 335 SD MET A 25 -3.538 -2.874 5.362 1.00 0.00 S ATOM 336 CE MET A 25 -2.542 -1.738 4.401 1.00 0.00 C ATOM 0 H MET A 25 -6.808 -5.232 4.467 1.00 0.00 H new ATOM 0 HA MET A 25 -6.222 -2.341 4.250 1.00 0.00 H new ATOM 0 HB2 MET A 25 -5.128 -4.474 2.400 1.00 0.00 H new ATOM 0 HB3 MET A 25 -4.593 -2.815 2.583 1.00 0.00 H new ATOM 0 HG2 MET A 25 -4.250 -5.039 4.625 1.00 0.00 H new ATOM 0 HG3 MET A 25 -2.996 -4.388 3.588 1.00 0.00 H new ATOM 0 HE1 MET A 25 -2.501 -0.773 4.906 1.00 0.00 H new ATOM 0 HE2 MET A 25 -1.533 -2.137 4.298 1.00 0.00 H new ATOM 0 HE3 MET A 25 -2.985 -1.612 3.413 1.00 0.00 H new ATOM 346 N CYS A 26 -7.640 -4.370 2.033 1.00 0.00 N ATOM 347 CA CYS A 26 -8.672 -4.414 1.003 1.00 0.00 C ATOM 348 C CYS A 26 -10.010 -4.808 1.606 1.00 0.00 C ATOM 349 O CYS A 26 -11.060 -4.608 0.995 1.00 0.00 O ATOM 350 CB CYS A 26 -8.273 -5.368 -0.127 1.00 0.00 C ATOM 351 SG CYS A 26 -7.947 -7.058 0.406 1.00 0.00 S ATOM 0 H CYS A 26 -7.140 -5.248 2.172 1.00 0.00 H new ATOM 0 HA CYS A 26 -8.774 -3.417 0.575 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -9.068 -5.382 -0.872 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -7.382 -4.977 -0.619 1.00 0.00 H new ATOM 356 N SER A 27 -9.974 -5.364 2.817 1.00 0.00 N ATOM 357 CA SER A 27 -11.170 -5.783 3.528 1.00 0.00 C ATOM 358 C SER A 27 -11.710 -7.110 2.998 1.00 0.00 C ATOM 359 O SER A 27 -12.810 -7.524 3.352 1.00 0.00 O ATOM 360 CB SER A 27 -12.260 -4.706 3.443 1.00 0.00 C ATOM 361 OG SER A 27 -13.230 -4.882 4.458 1.00 0.00 O ATOM 0 H SER A 27 -9.109 -5.535 3.330 1.00 0.00 H new ATOM 0 HA SER A 27 -10.888 -5.925 4.571 1.00 0.00 H new ATOM 0 HB2 SER A 27 -11.808 -3.718 3.535 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.740 -4.747 2.465 1.00 0.00 H new ATOM 0 HG SER A 27 -13.557 -5.806 4.441 1.00 0.00 H new ATOM 367 N LEU A 28 -10.930 -7.778 2.155 1.00 0.00 N ATOM 368 CA LEU A 28 -11.340 -9.058 1.592 1.00 0.00 C ATOM 369 C LEU A 28 -11.060 -10.180 2.583 1.00 0.00 C ATOM 370 O LEU A 28 -10.110 -10.110 3.363 1.00 0.00 O ATOM 371 CB LEU A 28 -10.600 -9.317 0.276 1.00 0.00 C ATOM 372 CG LEU A 28 -11.050 -8.461 -0.915 1.00 0.00 C ATOM 373 CD1 LEU A 28 -11.360 -7.035 -0.485 1.00 0.00 C ATOM 374 CD2 LEU A 28 -9.995 -8.469 -2.008 1.00 0.00 C ATOM 0 H LEU A 28 -10.013 -7.455 1.847 1.00 0.00 H new ATOM 0 HA LEU A 28 -12.411 -9.027 1.391 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.535 -9.150 0.439 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.721 -10.368 0.012 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.966 -8.898 -1.312 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -11.676 -6.454 -1.352 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.159 -7.044 0.257 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.468 -6.584 -0.051 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -10.333 -7.856 -2.844 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.062 -8.065 -1.616 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -9.833 -9.491 -2.350 1.00 0.00 H new ATOM 386 N PRO A 29 -11.900 -11.230 2.575 1.00 0.00 N ATOM 387 CA PRO A 29 -11.740 -12.370 3.488 1.00 0.00 C ATOM 388 C PRO A 29 -10.540 -13.240 3.151 1.00 0.00 C ATOM 389 O PRO A 29 -10.290 -13.550 1.987 1.00 0.00 O ATOM 390 CB PRO A 29 -13.040 -13.150 3.311 1.00 0.00 C ATOM 391 CG PRO A 29 -13.510 -12.810 1.939 1.00 0.00 C ATOM 392 CD PRO A 29 -13.060 -11.390 1.683 1.00 0.00 C ATOM 0 HA PRO A 29 -11.557 -12.042 4.511 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -12.875 -14.222 3.417 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -13.777 -12.865 4.062 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -13.087 -13.492 1.202 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -14.594 -12.895 1.866 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -12.787 -11.238 0.639 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -13.847 -10.672 1.915 1.00 0.00 H new ATOM 400 N ARG A 30 -9.802 -13.620 4.184 1.00 0.00 N ATOM 401 CA ARG A 30 -8.623 -14.440 4.004 1.00 0.00 C ATOM 402 C ARG A 30 -8.999 -15.810 3.439 1.00 0.00 C ATOM 403 O ARG A 30 -10.000 -16.400 3.829 1.00 0.00 O ATOM 404 CB ARG A 30 -7.878 -14.610 5.331 1.00 0.00 C ATOM 405 CG ARG A 30 -6.726 -15.600 5.273 1.00 0.00 C ATOM 406 CD ARG A 30 -6.938 -16.760 6.235 1.00 0.00 C ATOM 407 NE ARG A 30 -6.136 -17.930 5.874 1.00 0.00 N ATOM 408 CZ ARG A 30 -6.338 -19.150 6.365 1.00 0.00 C ATOM 409 NH1 ARG A 30 -7.314 -19.360 7.237 1.00 0.00 N ATOM 410 NH2 ARG A 30 -5.562 -20.150 5.983 1.00 0.00 N ATOM 0 H ARG A 30 -10.002 -13.372 5.153 1.00 0.00 H new ATOM 0 HA ARG A 30 -7.967 -13.937 3.294 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -7.494 -13.640 5.647 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -8.585 -14.936 6.093 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -6.624 -15.982 4.257 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -5.794 -15.090 5.516 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -6.681 -16.443 7.246 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -7.993 -17.034 6.245 1.00 0.00 H new ATOM 0 HE ARG A 30 -5.376 -17.802 5.206 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -7.910 -18.586 7.531 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -7.469 -20.295 7.614 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -4.810 -19.985 5.313 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -5.715 -21.086 6.358 1.00 0.00 H new ATOM 424 N THR A 31 -8.181 -16.310 2.520 1.00 0.00 N ATOM 425 CA THR A 31 -8.430 -17.610 1.904 1.00 0.00 C ATOM 426 C THR A 31 -7.121 -18.350 1.637 1.00 0.00 C ATOM 427 O THR A 31 -7.162 -19.400 0.961 1.00 0.00 O ATOM 428 CB THR A 31 -9.212 -17.440 0.600 1.00 0.00 C ATOM 429 OG1 THR A 31 -9.663 -18.690 0.114 1.00 0.00 O ATOM 430 CG2 THR A 31 -8.410 -16.780 -0.501 1.00 0.00 C ATOM 431 OXT THR A 31 -6.067 -17.870 2.106 1.00 0.00 O ATOM 0 H THR A 31 -7.342 -15.837 2.185 1.00 0.00 H new ATOM 0 HA THR A 31 -9.023 -18.204 2.599 1.00 0.00 H new ATOM 0 HB THR A 31 -10.051 -16.792 0.854 1.00 0.00 H new ATOM 0 HG1 THR A 31 -8.960 -19.362 0.236 1.00 0.00 H new ATOM 0 HG21 THR A 31 -9.025 -16.691 -1.396 1.00 0.00 H new ATOM 0 HG22 THR A 31 -8.095 -15.788 -0.177 1.00 0.00 H new ATOM 0 HG23 THR A 31 -7.531 -17.385 -0.724 1.00 0.00 H new TER 439 THR A 31 ATOM 440 N MET B 101 13.570 9.697 -7.132 1.00 0.00 N ATOM 441 CA MET B 101 13.312 8.328 -7.653 1.00 0.00 C ATOM 442 C MET B 101 11.864 8.174 -8.106 1.00 0.00 C ATOM 443 O MET B 101 11.076 9.116 -8.038 1.00 0.00 O ATOM 444 CB MET B 101 13.628 7.305 -6.555 1.00 0.00 C ATOM 445 CG MET B 101 13.445 7.834 -5.142 1.00 0.00 C ATOM 446 SD MET B 101 13.651 6.554 -3.891 1.00 0.00 S ATOM 447 CE MET B 101 11.953 6.030 -3.677 1.00 0.00 C ATOM 0 HA MET B 101 13.953 8.157 -8.518 1.00 0.00 H new ATOM 0 HB2 MET B 101 12.988 6.433 -6.691 1.00 0.00 H new ATOM 0 HB3 MET B 101 14.657 6.966 -6.674 1.00 0.00 H new ATOM 0 HG2 MET B 101 14.164 8.633 -4.961 1.00 0.00 H new ATOM 0 HG3 MET B 101 12.451 8.272 -5.048 1.00 0.00 H new ATOM 0 HE1 MET B 101 11.738 5.918 -2.614 1.00 0.00 H new ATOM 0 HE2 MET B 101 11.285 6.777 -4.105 1.00 0.00 H new ATOM 0 HE3 MET B 101 11.801 5.075 -4.181 1.00 0.00 H new ATOM 459 N GLN B 102 11.523 6.975 -8.566 1.00 0.00 N ATOM 460 CA GLN B 102 10.171 6.686 -9.029 1.00 0.00 C ATOM 461 C GLN B 102 9.616 5.454 -8.325 1.00 0.00 C ATOM 462 O GLN B 102 10.343 4.500 -8.057 1.00 0.00 O ATOM 463 CB GLN B 102 10.161 6.471 -10.540 1.00 0.00 C ATOM 464 CG GLN B 102 10.989 7.490 -11.300 1.00 0.00 C ATOM 465 CD GLN B 102 10.459 7.740 -12.700 1.00 0.00 C ATOM 466 OE1 GLN B 102 9.753 8.718 -12.950 1.00 0.00 O ATOM 467 NE2 GLN B 102 10.798 6.852 -13.630 1.00 0.00 N ATOM 0 H GLN B 102 12.166 6.186 -8.628 1.00 0.00 H new ATOM 0 HA GLN B 102 9.538 7.541 -8.790 1.00 0.00 H new ATOM 0 HB2 GLN B 102 10.537 5.472 -10.760 1.00 0.00 H new ATOM 0 HB3 GLN B 102 9.132 6.510 -10.898 1.00 0.00 H new ATOM 0 HG2 GLN B 102 11.002 8.429 -10.747 1.00 0.00 H new ATOM 0 HG3 GLN B 102 12.020 7.142 -11.362 1.00 0.00 H new ATOM 0 HE21 GLN B 102 11.385 6.055 -13.384 1.00 0.00 H new ATOM 0 HE22 GLN B 102 10.471 6.968 -14.589 1.00 0.00 H new ATOM 476 N ILE B 103 8.325 5.483 -8.023 1.00 0.00 N ATOM 477 CA ILE B 103 7.677 4.367 -7.346 1.00 0.00 C ATOM 478 C ILE B 103 6.434 3.909 -8.102 1.00 0.00 C ATOM 479 O ILE B 103 5.667 4.728 -8.607 1.00 0.00 O ATOM 480 CB ILE B 103 7.284 4.744 -5.904 1.00 0.00 C ATOM 481 CG1 ILE B 103 6.194 5.819 -5.906 1.00 0.00 C ATOM 482 CG2 ILE B 103 8.505 5.229 -5.137 1.00 0.00 C ATOM 483 CD1 ILE B 103 5.703 6.184 -4.523 1.00 0.00 C ATOM 0 H ILE B 103 7.706 6.266 -8.236 1.00 0.00 H new ATOM 0 HA ILE B 103 8.397 3.549 -7.318 1.00 0.00 H new ATOM 0 HB ILE B 103 6.889 3.857 -5.409 1.00 0.00 H new ATOM 0 HG12 ILE B 103 6.579 6.714 -6.394 1.00 0.00 H new ATOM 0 HG13 ILE B 103 5.351 5.469 -6.501 1.00 0.00 H new ATOM 0 HG21 ILE B 103 8.215 5.492 -4.120 1.00 0.00 H new ATOM 0 HG22 ILE B 103 9.254 4.438 -5.107 1.00 0.00 H new ATOM 0 HG23 ILE B 103 8.922 6.105 -5.634 1.00 0.00 H new ATOM 0 HD11 ILE B 103 4.932 6.951 -4.601 1.00 0.00 H new ATOM 0 HD12 ILE B 103 5.288 5.300 -4.039 1.00 0.00 H new ATOM 0 HD13 ILE B 103 6.535 6.565 -3.930 1.00 0.00 H new ATOM 495 N PHE B 104 6.238 2.596 -8.174 1.00 0.00 N ATOM 496 CA PHE B 104 5.082 2.041 -8.869 1.00 0.00 C ATOM 497 C PHE B 104 3.940 1.779 -7.894 1.00 0.00 C ATOM 498 O PHE B 104 4.165 1.417 -6.739 1.00 0.00 O ATOM 499 CB PHE B 104 5.459 0.748 -9.592 1.00 0.00 C ATOM 500 CG PHE B 104 6.360 0.962 -10.770 1.00 0.00 C ATOM 501 CD1 PHE B 104 7.601 1.559 -10.610 1.00 0.00 C ATOM 502 CD2 PHE B 104 5.964 0.569 -12.040 1.00 0.00 C ATOM 503 CE1 PHE B 104 8.431 1.758 -11.700 1.00 0.00 C ATOM 504 CE2 PHE B 104 6.790 0.766 -13.130 1.00 0.00 C ATOM 505 CZ PHE B 104 8.025 1.361 -12.960 1.00 0.00 C ATOM 0 H PHE B 104 6.860 1.901 -7.762 1.00 0.00 H new ATOM 0 HA PHE B 104 4.750 2.772 -9.606 1.00 0.00 H new ATOM 0 HB2 PHE B 104 5.949 0.077 -8.887 1.00 0.00 H new ATOM 0 HB3 PHE B 104 4.549 0.250 -9.926 1.00 0.00 H new ATOM 0 HD1 PHE B 104 7.923 1.871 -9.627 1.00 0.00 H new ATOM 0 HD2 PHE B 104 4.999 0.104 -12.178 1.00 0.00 H new ATOM 0 HE1 PHE B 104 9.396 2.224 -11.566 1.00 0.00 H new ATOM 0 HE2 PHE B 104 6.470 0.455 -14.114 1.00 0.00 H new ATOM 0 HZ PHE B 104 8.672 1.516 -13.811 1.00 0.00 H new ATOM 515 N VAL B 105 2.714 1.970 -8.367 1.00 0.00 N ATOM 516 CA VAL B 105 1.534 1.759 -7.537 1.00 0.00 C ATOM 517 C VAL B 105 0.554 0.801 -8.204 1.00 0.00 C ATOM 518 O VAL B 105 -0.159 1.175 -9.135 1.00 0.00 O ATOM 519 CB VAL B 105 0.813 3.088 -7.242 1.00 0.00 C ATOM 520 CG1 VAL B 105 -0.295 2.880 -6.221 1.00 0.00 C ATOM 521 CG2 VAL B 105 1.803 4.137 -6.759 1.00 0.00 C ATOM 0 H VAL B 105 2.511 2.270 -9.320 1.00 0.00 H new ATOM 0 HA VAL B 105 1.881 1.324 -6.600 1.00 0.00 H new ATOM 0 HB VAL B 105 0.360 3.447 -8.166 1.00 0.00 H new ATOM 0 HG11 VAL B 105 -0.793 3.830 -6.026 1.00 0.00 H new ATOM 0 HG12 VAL B 105 -1.019 2.164 -6.611 1.00 0.00 H new ATOM 0 HG13 VAL B 105 0.132 2.496 -5.294 1.00 0.00 H new ATOM 0 HG21 VAL B 105 1.275 5.069 -6.556 1.00 0.00 H new ATOM 0 HG22 VAL B 105 2.287 3.788 -5.847 1.00 0.00 H new ATOM 0 HG23 VAL B 105 2.557 4.307 -7.528 1.00 0.00 H new ATOM 531 N LYS B 106 0.524 -0.438 -7.722 1.00 0.00 N ATOM 532 CA LYS B 106 -0.369 -1.451 -8.274 1.00 0.00 C ATOM 533 C LYS B 106 -1.724 -1.432 -7.572 1.00 0.00 C ATOM 534 O LYS B 106 -1.807 -1.592 -6.354 1.00 0.00 O ATOM 535 CB LYS B 106 0.263 -2.839 -8.147 1.00 0.00 C ATOM 536 CG LYS B 106 -0.253 -3.838 -9.170 1.00 0.00 C ATOM 537 CD LYS B 106 -0.346 -5.237 -8.584 1.00 0.00 C ATOM 538 CE LYS B 106 -0.933 -6.222 -9.583 1.00 0.00 C ATOM 539 NZ LYS B 106 -1.821 -7.219 -8.925 1.00 0.00 N ATOM 0 H LYS B 106 1.107 -0.764 -6.951 1.00 0.00 H new ATOM 0 HA LYS B 106 -0.526 -1.222 -9.328 1.00 0.00 H new ATOM 0 HB2 LYS B 106 1.344 -2.748 -8.253 1.00 0.00 H new ATOM 0 HB3 LYS B 106 0.073 -3.226 -7.146 1.00 0.00 H new ATOM 0 HG2 LYS B 106 -1.235 -3.524 -9.523 1.00 0.00 H new ATOM 0 HG3 LYS B 106 0.409 -3.848 -10.036 1.00 0.00 H new ATOM 0 HD2 LYS B 106 0.646 -5.572 -8.281 1.00 0.00 H new ATOM 0 HD3 LYS B 106 -0.964 -5.216 -7.686 1.00 0.00 H new ATOM 0 HE2 LYS B 106 -1.497 -5.678 -10.340 1.00 0.00 H new ATOM 0 HE3 LYS B 106 -0.125 -6.741 -10.099 1.00 0.00 H new ATOM 0 HZ1 LYS B 106 -2.200 -7.872 -9.640 1.00 0.00 H new ATOM 0 HZ2 LYS B 106 -1.277 -7.756 -8.220 1.00 0.00 H new ATOM 0 HZ3 LYS B 106 -2.607 -6.727 -8.454 1.00 0.00 H new ATOM 553 N THR B 107 -2.784 -1.239 -8.350 1.00 0.00 N ATOM 554 CA THR B 107 -4.137 -1.203 -7.806 1.00 0.00 C ATOM 555 C THR B 107 -4.810 -2.565 -7.935 1.00 0.00 C ATOM 556 O THR B 107 -4.486 -3.345 -8.830 1.00 0.00 O ATOM 557 CB THR B 107 -4.969 -0.140 -8.526 1.00 0.00 C ATOM 558 OG1 THR B 107 -4.503 0.049 -9.850 1.00 0.00 O ATOM 559 CG2 THR B 107 -4.948 1.206 -7.835 1.00 0.00 C ATOM 0 H THR B 107 -2.732 -1.105 -9.360 1.00 0.00 H new ATOM 0 HA THR B 107 -4.071 -0.949 -6.748 1.00 0.00 H new ATOM 0 HB THR B 107 -5.991 -0.518 -8.517 1.00 0.00 H new ATOM 0 HG1 THR B 107 -3.548 0.270 -9.832 1.00 0.00 H new ATOM 0 HG21 THR B 107 -5.557 1.913 -8.397 1.00 0.00 H new ATOM 0 HG22 THR B 107 -5.349 1.104 -6.826 1.00 0.00 H new ATOM 0 HG23 THR B 107 -3.923 1.572 -7.783 1.00 0.00 H new ATOM 567 N LEU B 108 -5.752 -2.844 -7.038 1.00 0.00 N ATOM 568 CA LEU B 108 -6.472 -4.113 -7.061 1.00 0.00 C ATOM 569 C LEU B 108 -7.287 -4.258 -8.345 1.00 0.00 C ATOM 570 O LEU B 108 -7.759 -5.347 -8.668 1.00 0.00 O ATOM 571 CB LEU B 108 -7.399 -4.229 -5.845 1.00 0.00 C ATOM 572 CG LEU B 108 -6.701 -4.429 -4.495 1.00 0.00 C ATOM 573 CD1 LEU B 108 -7.695 -4.914 -3.450 1.00 0.00 C ATOM 574 CD2 LEU B 108 -5.545 -5.410 -4.619 1.00 0.00 C ATOM 0 H LEU B 108 -6.033 -2.211 -6.289 1.00 0.00 H new ATOM 0 HA LEU B 108 -5.734 -4.914 -7.025 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -8.008 -3.327 -5.788 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -8.080 -5.064 -6.009 1.00 0.00 H new ATOM 0 HG LEU B 108 -6.298 -3.467 -4.177 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -7.183 -5.051 -2.497 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -8.489 -4.176 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -8.126 -5.863 -3.770 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -5.067 -5.534 -3.647 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -5.921 -6.373 -4.964 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.818 -5.027 -5.335 1.00 0.00 H new ATOM 586 N THR B 109 -7.450 -3.156 -9.074 1.00 0.00 N ATOM 587 CA THR B 109 -8.210 -3.172 -10.310 1.00 0.00 C ATOM 588 C THR B 109 -7.379 -3.745 -11.460 1.00 0.00 C ATOM 589 O THR B 109 -7.922 -4.149 -12.490 1.00 0.00 O ATOM 590 CB THR B 109 -8.680 -1.760 -10.670 1.00 0.00 C ATOM 591 OG1 THR B 109 -7.580 -0.939 -11.020 1.00 0.00 O ATOM 592 CG2 THR B 109 -9.422 -1.076 -9.544 1.00 0.00 C ATOM 0 H THR B 109 -7.064 -2.245 -8.826 1.00 0.00 H new ATOM 0 HA THR B 109 -9.079 -3.811 -10.156 1.00 0.00 H new ATOM 0 HB THR B 109 -9.361 -1.886 -11.512 1.00 0.00 H new ATOM 0 HG1 THR B 109 -7.901 -0.042 -11.248 1.00 0.00 H new ATOM 0 HG21 THR B 109 -9.728 -0.080 -9.862 1.00 0.00 H new ATOM 0 HG22 THR B 109 -10.304 -1.660 -9.282 1.00 0.00 H new ATOM 0 HG23 THR B 109 -8.769 -0.995 -8.675 1.00 0.00 H new ATOM 600 N GLY B 110 -6.061 -3.781 -11.280 1.00 0.00 N ATOM 601 CA GLY B 110 -5.186 -4.309 -12.310 1.00 0.00 C ATOM 602 C GLY B 110 -4.438 -3.219 -13.050 1.00 0.00 C ATOM 603 O GLY B 110 -4.065 -3.393 -14.210 1.00 0.00 O ATOM 0 H GLY B 110 -5.585 -3.454 -10.439 1.00 0.00 H new ATOM 0 HA2 GLY B 110 -4.469 -4.994 -11.857 1.00 0.00 H new ATOM 0 HA3 GLY B 110 -5.775 -4.888 -13.021 1.00 0.00 H new ATOM 607 N LYS B 111 -4.218 -2.093 -12.380 1.00 0.00 N ATOM 608 CA LYS B 111 -3.510 -0.971 -12.980 1.00 0.00 C ATOM 609 C LYS B 111 -2.308 -0.572 -12.140 1.00 0.00 C ATOM 610 O LYS B 111 -2.352 -0.617 -10.910 1.00 0.00 O ATOM 611 CB LYS B 111 -4.450 0.223 -13.150 1.00 0.00 C ATOM 612 CG LYS B 111 -5.170 0.243 -14.490 1.00 0.00 C ATOM 613 CD LYS B 111 -6.503 0.966 -14.400 1.00 0.00 C ATOM 614 CE LYS B 111 -6.382 2.419 -14.830 1.00 0.00 C ATOM 615 NZ LYS B 111 -7.585 2.879 -15.570 1.00 0.00 N ATOM 0 H LYS B 111 -4.521 -1.934 -11.419 1.00 0.00 H new ATOM 0 HA LYS B 111 -3.154 -1.285 -13.961 1.00 0.00 H new ATOM 0 HB2 LYS B 111 -5.190 0.210 -12.349 1.00 0.00 H new ATOM 0 HB3 LYS B 111 -3.878 1.144 -13.040 1.00 0.00 H new ATOM 0 HG2 LYS B 111 -4.541 0.731 -15.234 1.00 0.00 H new ATOM 0 HG3 LYS B 111 -5.333 -0.779 -14.831 1.00 0.00 H new ATOM 0 HD2 LYS B 111 -7.235 0.460 -15.029 1.00 0.00 H new ATOM 0 HD3 LYS B 111 -6.875 0.919 -13.376 1.00 0.00 H new ATOM 0 HE2 LYS B 111 -6.234 3.047 -13.951 1.00 0.00 H new ATOM 0 HE3 LYS B 111 -5.500 2.539 -15.460 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 -7.463 3.874 -15.846 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 -7.712 2.297 -16.422 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 -8.423 2.788 -14.961 1.00 0.00 H new ATOM 629 N THR B 112 -1.236 -0.185 -12.810 1.00 0.00 N ATOM 630 CA THR B 112 -0.010 0.222 -12.140 1.00 0.00 C ATOM 631 C THR B 112 0.310 1.683 -12.450 1.00 0.00 C ATOM 632 O THR B 112 0.397 2.074 -13.620 1.00 0.00 O ATOM 633 CB THR B 112 1.141 -0.689 -12.580 1.00 0.00 C ATOM 634 OG1 THR B 112 1.063 -1.940 -11.920 1.00 0.00 O ATOM 635 CG2 THR B 112 2.518 -0.116 -12.310 1.00 0.00 C ATOM 0 H THR B 112 -1.189 -0.144 -13.828 1.00 0.00 H new ATOM 0 HA THR B 112 -0.144 0.129 -11.062 1.00 0.00 H new ATOM 0 HB THR B 112 1.022 -0.793 -13.659 1.00 0.00 H new ATOM 0 HG1 THR B 112 1.804 -2.511 -12.213 1.00 0.00 H new ATOM 0 HG21 THR B 112 3.278 -0.820 -12.649 1.00 0.00 H new ATOM 0 HG22 THR B 112 2.631 0.827 -12.846 1.00 0.00 H new ATOM 0 HG23 THR B 112 2.636 0.058 -11.240 1.00 0.00 H new ATOM 643 N ILE B 113 0.479 2.486 -11.410 1.00 0.00 N ATOM 644 CA ILE B 113 0.784 3.902 -11.580 1.00 0.00 C ATOM 645 C ILE B 113 2.220 4.213 -11.170 1.00 0.00 C ATOM 646 O ILE B 113 2.663 3.857 -10.080 1.00 0.00 O ATOM 647 CB ILE B 113 -0.162 4.803 -10.750 1.00 0.00 C ATOM 648 CG1 ILE B 113 -1.513 4.118 -10.530 1.00 0.00 C ATOM 649 CG2 ILE B 113 -0.352 6.141 -11.450 1.00 0.00 C ATOM 650 CD1 ILE B 113 -2.496 4.961 -9.749 1.00 0.00 C ATOM 0 H ILE B 113 0.410 2.183 -10.439 1.00 0.00 H new ATOM 0 HA ILE B 113 0.645 4.115 -12.640 1.00 0.00 H new ATOM 0 HB ILE B 113 0.292 4.975 -9.774 1.00 0.00 H new ATOM 0 HG12 ILE B 113 -1.948 3.870 -11.498 1.00 0.00 H new ATOM 0 HG13 ILE B 113 -1.353 3.178 -10.002 1.00 0.00 H new ATOM 0 HG21 ILE B 113 -1.019 6.769 -10.859 1.00 0.00 H new ATOM 0 HG22 ILE B 113 0.613 6.636 -11.556 1.00 0.00 H new ATOM 0 HG23 ILE B 113 -0.786 5.977 -12.436 1.00 0.00 H new ATOM 0 HD11 ILE B 113 -3.431 4.414 -9.631 1.00 0.00 H new ATOM 0 HD12 ILE B 113 -2.081 5.187 -8.767 1.00 0.00 H new ATOM 0 HD13 ILE B 113 -2.685 5.891 -10.286 1.00 0.00 H new ATOM 662 N THR B 114 2.935 4.891 -12.060 1.00 0.00 N ATOM 663 CA THR B 114 4.318 5.271 -11.800 1.00 0.00 C ATOM 664 C THR B 114 4.403 6.753 -11.460 1.00 0.00 C ATOM 665 O THR B 114 3.893 7.599 -12.200 1.00 0.00 O ATOM 666 CB THR B 114 5.192 4.962 -13.020 1.00 0.00 C ATOM 667 OG1 THR B 114 4.777 3.760 -13.640 1.00 0.00 O ATOM 668 CG2 THR B 114 6.660 4.822 -12.680 1.00 0.00 C ATOM 0 H THR B 114 2.580 5.189 -12.968 1.00 0.00 H new ATOM 0 HA THR B 114 4.683 4.693 -10.951 1.00 0.00 H new ATOM 0 HB THR B 114 5.070 5.813 -13.690 1.00 0.00 H new ATOM 0 HG1 THR B 114 5.408 3.043 -13.419 1.00 0.00 H new ATOM 0 HG21 THR B 114 7.224 4.604 -13.587 1.00 0.00 H new ATOM 0 HG22 THR B 114 7.022 5.752 -12.242 1.00 0.00 H new ATOM 0 HG23 THR B 114 6.792 4.009 -11.966 1.00 0.00 H new ATOM 676 N LEU B 115 5.038 7.063 -10.340 1.00 0.00 N ATOM 677 CA LEU B 115 5.175 8.443 -9.901 1.00 0.00 C ATOM 678 C LEU B 115 6.618 8.757 -9.528 1.00 0.00 C ATOM 679 O LEU B 115 7.477 7.876 -9.531 1.00 0.00 O ATOM 680 CB LEU B 115 4.253 8.706 -8.710 1.00 0.00 C ATOM 681 CG LEU B 115 2.757 8.613 -9.022 1.00 0.00 C ATOM 682 CD1 LEU B 115 1.997 8.035 -7.838 1.00 0.00 C ATOM 683 CD2 LEU B 115 2.206 9.981 -9.395 1.00 0.00 C ATOM 0 H LEU B 115 5.467 6.377 -9.718 1.00 0.00 H new ATOM 0 HA LEU B 115 4.889 9.095 -10.726 1.00 0.00 H new ATOM 0 HB2 LEU B 115 4.490 7.993 -7.921 1.00 0.00 H new ATOM 0 HB3 LEU B 115 4.466 9.700 -8.316 1.00 0.00 H new ATOM 0 HG LEU B 115 2.624 7.944 -9.872 1.00 0.00 H new ATOM 0 HD11 LEU B 115 0.936 7.977 -8.080 1.00 0.00 H new ATOM 0 HD12 LEU B 115 2.374 7.036 -7.616 1.00 0.00 H new ATOM 0 HD13 LEU B 115 2.136 8.677 -6.968 1.00 0.00 H new ATOM 0 HD21 LEU B 115 1.141 9.897 -9.614 1.00 0.00 H new ATOM 0 HD22 LEU B 115 2.352 10.671 -8.564 1.00 0.00 H new ATOM 0 HD23 LEU B 115 2.729 10.356 -10.275 1.00 0.00 H new ATOM 695 N GLU B 116 6.876 10.019 -9.207 1.00 0.00 N ATOM 696 CA GLU B 116 8.212 10.457 -8.831 1.00 0.00 C ATOM 697 C GLU B 116 8.240 10.927 -7.383 1.00 0.00 C ATOM 698 O GLU B 116 7.603 11.918 -7.025 1.00 0.00 O ATOM 699 CB GLU B 116 8.685 11.580 -9.752 1.00 0.00 C ATOM 700 CG GLU B 116 10.169 11.886 -9.627 1.00 0.00 C ATOM 701 CD GLU B 116 10.824 12.153 -10.960 1.00 0.00 C ATOM 702 OE1 GLU B 116 10.290 12.982 -11.730 1.00 0.00 O ATOM 703 OE2 GLU B 116 11.870 11.533 -11.250 1.00 0.00 O ATOM 0 H GLU B 116 6.174 10.759 -9.200 1.00 0.00 H new ATOM 0 HA GLU B 116 8.887 9.607 -8.934 1.00 0.00 H new ATOM 0 HB2 GLU B 116 8.464 11.309 -10.784 1.00 0.00 H new ATOM 0 HB3 GLU B 116 8.116 12.483 -9.531 1.00 0.00 H new ATOM 0 HG2 GLU B 116 10.304 12.753 -8.981 1.00 0.00 H new ATOM 0 HG3 GLU B 116 10.669 11.047 -9.143 1.00 0.00 H new ATOM 710 N VAL B 117 8.985 10.207 -6.559 1.00 0.00 N ATOM 711 CA VAL B 117 9.112 10.532 -5.150 1.00 0.00 C ATOM 712 C VAL B 117 10.558 10.384 -4.708 1.00 0.00 C ATOM 713 O VAL B 117 11.431 10.078 -5.519 1.00 0.00 O ATOM 714 CB VAL B 117 8.224 9.624 -4.282 1.00 0.00 C ATOM 715 CG1 VAL B 117 6.752 9.890 -4.558 1.00 0.00 C ATOM 716 CG2 VAL B 117 8.565 8.161 -4.522 1.00 0.00 C ATOM 0 H VAL B 117 9.516 9.385 -6.848 1.00 0.00 H new ATOM 0 HA VAL B 117 8.787 11.564 -5.019 1.00 0.00 H new ATOM 0 HB VAL B 117 8.417 9.852 -3.234 1.00 0.00 H new ATOM 0 HG11 VAL B 117 6.141 9.238 -3.934 1.00 0.00 H new ATOM 0 HG12 VAL B 117 6.521 10.931 -4.330 1.00 0.00 H new ATOM 0 HG13 VAL B 117 6.537 9.693 -5.608 1.00 0.00 H new ATOM 0 HG21 VAL B 117 7.928 7.532 -3.900 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.402 7.917 -5.572 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.610 7.984 -4.266 1.00 0.00 H new ATOM 726 N GLU B 118 10.814 10.601 -3.425 1.00 0.00 N ATOM 727 CA GLU B 118 12.161 10.483 -2.898 1.00 0.00 C ATOM 728 C GLU B 118 12.198 9.520 -1.714 1.00 0.00 C ATOM 729 O GLU B 118 11.171 9.251 -1.092 1.00 0.00 O ATOM 730 CB GLU B 118 12.686 11.853 -2.471 1.00 0.00 C ATOM 731 CG GLU B 118 13.737 12.424 -3.408 1.00 0.00 C ATOM 732 CD GLU B 118 14.871 13.105 -2.666 1.00 0.00 C ATOM 733 OE1 GLU B 118 14.668 14.238 -2.182 1.00 0.00 O ATOM 734 OE2 GLU B 118 15.962 12.504 -2.569 1.00 0.00 O ATOM 0 H GLU B 118 10.108 10.858 -2.735 1.00 0.00 H new ATOM 0 HA GLU B 118 12.800 10.087 -3.687 1.00 0.00 H new ATOM 0 HB2 GLU B 118 11.850 12.550 -2.410 1.00 0.00 H new ATOM 0 HB3 GLU B 118 13.109 11.774 -1.470 1.00 0.00 H new ATOM 0 HG2 GLU B 118 14.142 11.622 -4.026 1.00 0.00 H new ATOM 0 HG3 GLU B 118 13.267 13.140 -4.082 1.00 0.00 H new ATOM 741 N PRO B 119 13.388 8.992 -1.382 1.00 0.00 N ATOM 742 CA PRO B 119 13.551 8.065 -0.262 1.00 0.00 C ATOM 743 C PRO B 119 13.541 8.777 1.088 1.00 0.00 C ATOM 744 O PRO B 119 13.606 8.137 2.137 1.00 0.00 O ATOM 745 CB PRO B 119 14.919 7.444 -0.528 1.00 0.00 C ATOM 746 CG PRO B 119 15.678 8.507 -1.243 1.00 0.00 C ATOM 747 CD PRO B 119 14.668 9.266 -2.064 1.00 0.00 C ATOM 0 HA PRO B 119 12.738 7.341 -0.204 1.00 0.00 H new ATOM 0 HB2 PRO B 119 15.413 7.160 0.401 1.00 0.00 H new ATOM 0 HB3 PRO B 119 14.834 6.541 -1.133 1.00 0.00 H new ATOM 0 HG2 PRO B 119 16.181 9.168 -0.537 1.00 0.00 H new ATOM 0 HG3 PRO B 119 16.450 8.073 -1.879 1.00 0.00 H new ATOM 0 HD2 PRO B 119 14.890 10.333 -2.086 1.00 0.00 H new ATOM 0 HD3 PRO B 119 14.653 8.922 -3.098 1.00 0.00 H new ATOM 755 N SER B 120 13.458 10.104 1.053 1.00 0.00 N ATOM 756 CA SER B 120 13.438 10.900 2.273 1.00 0.00 C ATOM 757 C SER B 120 12.047 11.475 2.524 1.00 0.00 C ATOM 758 O SER B 120 11.709 11.838 3.651 1.00 0.00 O ATOM 759 CB SER B 120 14.462 12.033 2.185 1.00 0.00 C ATOM 760 OG SER B 120 15.086 12.256 3.438 1.00 0.00 O ATOM 0 H SER B 120 13.404 10.649 0.193 1.00 0.00 H new ATOM 0 HA SER B 120 13.699 10.248 3.107 1.00 0.00 H new ATOM 0 HB2 SER B 120 15.217 11.788 1.438 1.00 0.00 H new ATOM 0 HB3 SER B 120 13.970 12.947 1.853 1.00 0.00 H new ATOM 0 HG SER B 120 15.737 12.984 3.354 1.00 0.00 H new ATOM 766 N ASP B 121 11.243 11.555 1.467 1.00 0.00 N ATOM 767 CA ASP B 121 9.891 12.085 1.574 1.00 0.00 C ATOM 768 C ASP B 121 9.072 11.286 2.585 1.00 0.00 C ATOM 769 O ASP B 121 9.621 10.510 3.366 1.00 0.00 O ATOM 770 CB ASP B 121 9.203 12.062 0.207 1.00 0.00 C ATOM 771 CG ASP B 121 8.370 13.304 -0.041 1.00 0.00 C ATOM 772 OD1 ASP B 121 7.965 13.955 0.945 1.00 0.00 O ATOM 773 OD2 ASP B 121 8.121 13.625 -1.222 1.00 0.00 O ATOM 0 H ASP B 121 11.507 11.259 0.527 1.00 0.00 H new ATOM 0 HA ASP B 121 9.957 13.116 1.922 1.00 0.00 H new ATOM 0 HB2 ASP B 121 9.957 11.971 -0.575 1.00 0.00 H new ATOM 0 HB3 ASP B 121 8.565 11.181 0.139 1.00 0.00 H new ATOM 778 N THR B 122 7.758 11.480 2.563 1.00 0.00 N ATOM 779 CA THR B 122 6.866 10.778 3.473 1.00 0.00 C ATOM 780 C THR B 122 5.708 10.150 2.709 1.00 0.00 C ATOM 781 O THR B 122 5.391 10.562 1.593 1.00 0.00 O ATOM 782 CB THR B 122 6.333 11.737 4.538 1.00 0.00 C ATOM 783 OG1 THR B 122 5.684 12.843 3.937 1.00 0.00 O ATOM 784 CG2 THR B 122 7.412 12.279 5.450 1.00 0.00 C ATOM 0 H THR B 122 7.288 12.120 1.923 1.00 0.00 H new ATOM 0 HA THR B 122 7.430 9.985 3.963 1.00 0.00 H new ATOM 0 HB THR B 122 5.638 11.147 5.135 1.00 0.00 H new ATOM 0 HG1 THR B 122 5.490 13.519 4.620 1.00 0.00 H new ATOM 0 HG21 THR B 122 6.966 12.952 6.182 1.00 0.00 H new ATOM 0 HG22 THR B 122 7.900 11.453 5.967 1.00 0.00 H new ATOM 0 HG23 THR B 122 8.149 12.823 4.859 1.00 0.00 H new ATOM 792 N ILE B 123 5.079 9.152 3.315 1.00 0.00 N ATOM 793 CA ILE B 123 3.954 8.468 2.688 1.00 0.00 C ATOM 794 C ILE B 123 2.836 9.448 2.354 1.00 0.00 C ATOM 795 O ILE B 123 2.095 9.255 1.390 1.00 0.00 O ATOM 796 CB ILE B 123 3.390 7.354 3.592 1.00 0.00 C ATOM 797 CG1 ILE B 123 4.516 6.448 4.096 1.00 0.00 C ATOM 798 CG2 ILE B 123 2.346 6.541 2.842 1.00 0.00 C ATOM 799 CD1 ILE B 123 5.363 5.860 2.987 1.00 0.00 C ATOM 0 H ILE B 123 5.327 8.798 4.239 1.00 0.00 H new ATOM 0 HA ILE B 123 4.332 8.019 1.769 1.00 0.00 H new ATOM 0 HB ILE B 123 2.913 7.818 4.455 1.00 0.00 H new ATOM 0 HG12 ILE B 123 5.157 7.019 4.768 1.00 0.00 H new ATOM 0 HG13 ILE B 123 4.084 5.636 4.681 1.00 0.00 H new ATOM 0 HG21 ILE B 123 1.957 5.758 3.494 1.00 0.00 H new ATOM 0 HG22 ILE B 123 1.530 7.194 2.532 1.00 0.00 H new ATOM 0 HG23 ILE B 123 2.802 6.087 1.962 1.00 0.00 H new ATOM 0 HD11 ILE B 123 6.140 5.229 3.418 1.00 0.00 H new ATOM 0 HD12 ILE B 123 4.735 5.262 2.328 1.00 0.00 H new ATOM 0 HD13 ILE B 123 5.825 6.665 2.416 1.00 0.00 H new ATOM 811 N GLU B 124 2.722 10.503 3.155 1.00 0.00 N ATOM 812 CA GLU B 124 1.696 11.515 2.942 1.00 0.00 C ATOM 813 C GLU B 124 1.902 12.218 1.603 1.00 0.00 C ATOM 814 O GLU B 124 0.942 12.637 0.957 1.00 0.00 O ATOM 815 CB GLU B 124 1.703 12.530 4.089 1.00 0.00 C ATOM 816 CG GLU B 124 2.846 13.533 4.021 1.00 0.00 C ATOM 817 CD GLU B 124 2.385 14.916 3.605 1.00 0.00 C ATOM 818 OE1 GLU B 124 2.369 15.194 2.388 1.00 0.00 O ATOM 819 OE2 GLU B 124 2.040 15.720 4.496 1.00 0.00 O ATOM 0 H GLU B 124 3.328 10.678 3.957 1.00 0.00 H new ATOM 0 HA GLU B 124 0.724 11.021 2.922 1.00 0.00 H new ATOM 0 HB2 GLU B 124 0.757 13.072 4.087 1.00 0.00 H new ATOM 0 HB3 GLU B 124 1.760 11.993 5.036 1.00 0.00 H new ATOM 0 HG2 GLU B 124 3.330 13.593 4.996 1.00 0.00 H new ATOM 0 HG3 GLU B 124 3.596 13.176 3.315 1.00 0.00 H new ATOM 826 N ASN B 125 3.160 12.335 1.190 1.00 0.00 N ATOM 827 CA ASN B 125 3.490 12.976 -0.074 1.00 0.00 C ATOM 828 C ASN B 125 3.175 12.043 -1.237 1.00 0.00 C ATOM 829 O ASN B 125 2.695 12.477 -2.284 1.00 0.00 O ATOM 830 CB ASN B 125 4.967 13.374 -0.099 1.00 0.00 C ATOM 831 CG ASN B 125 5.174 14.846 0.202 1.00 0.00 C ATOM 832 OD1 ASN B 125 6.187 15.440 -0.417 1.00 0.00 O flip ATOM 833 ND2 ASN B 125 4.432 15.441 0.983 1.00 0.00 N flip ATOM 0 H ASN B 125 3.966 11.994 1.713 1.00 0.00 H new ATOM 0 HA ASN B 125 2.885 13.877 -0.175 1.00 0.00 H new ATOM 0 HB2 ASN B 125 5.514 12.776 0.630 1.00 0.00 H new ATOM 0 HB3 ASN B 125 5.386 13.144 -1.079 1.00 0.00 H new ATOM 0 HD21 ASN B 125 3.665 14.944 1.437 1.00 0.00 H new ATOM 0 HD22 ASN B 125 4.584 16.431 1.177 1.00 0.00 H new ATOM 840 N VAL B 126 3.439 10.756 -1.038 1.00 0.00 N ATOM 841 CA VAL B 126 3.172 9.756 -2.062 1.00 0.00 C ATOM 842 C VAL B 126 1.671 9.601 -2.274 1.00 0.00 C ATOM 843 O VAL B 126 1.203 9.466 -3.405 1.00 0.00 O ATOM 844 CB VAL B 126 3.773 8.388 -1.683 1.00 0.00 C ATOM 845 CG1 VAL B 126 3.571 7.384 -2.807 1.00 0.00 C ATOM 846 CG2 VAL B 126 5.250 8.531 -1.344 1.00 0.00 C ATOM 0 H VAL B 126 3.838 10.382 -0.177 1.00 0.00 H new ATOM 0 HA VAL B 126 3.641 10.100 -2.984 1.00 0.00 H new ATOM 0 HB VAL B 126 3.254 8.016 -0.800 1.00 0.00 H new ATOM 0 HG11 VAL B 126 4.002 6.425 -2.520 1.00 0.00 H new ATOM 0 HG12 VAL B 126 2.505 7.260 -2.997 1.00 0.00 H new ATOM 0 HG13 VAL B 126 4.061 7.746 -3.711 1.00 0.00 H new ATOM 0 HG21 VAL B 126 5.658 7.556 -1.079 1.00 0.00 H new ATOM 0 HG22 VAL B 126 5.785 8.926 -2.208 1.00 0.00 H new ATOM 0 HG23 VAL B 126 5.366 9.214 -0.502 1.00 0.00 H new ATOM 856 N LYS B 127 0.922 9.633 -1.176 1.00 0.00 N ATOM 857 CA LYS B 127 -0.528 9.508 -1.237 1.00 0.00 C ATOM 858 C LYS B 127 -1.138 10.751 -1.870 1.00 0.00 C ATOM 859 O LYS B 127 -2.089 10.663 -2.647 1.00 0.00 O ATOM 860 CB LYS B 127 -1.101 9.292 0.166 1.00 0.00 C ATOM 861 CG LYS B 127 -1.902 8.008 0.305 1.00 0.00 C ATOM 862 CD LYS B 127 -1.002 6.817 0.596 1.00 0.00 C ATOM 863 CE LYS B 127 -1.606 5.907 1.653 1.00 0.00 C ATOM 864 NZ LYS B 127 -0.569 5.348 2.564 1.00 0.00 N ATOM 0 H LYS B 127 1.296 9.744 -0.234 1.00 0.00 H new ATOM 0 HA LYS B 127 -0.778 8.644 -1.853 1.00 0.00 H new ATOM 0 HB2 LYS B 127 -0.282 9.279 0.886 1.00 0.00 H new ATOM 0 HB3 LYS B 127 -1.739 10.138 0.423 1.00 0.00 H new ATOM 0 HG2 LYS B 127 -2.632 8.118 1.107 1.00 0.00 H new ATOM 0 HG3 LYS B 127 -2.462 7.826 -0.612 1.00 0.00 H new ATOM 0 HD2 LYS B 127 -0.837 6.252 -0.321 1.00 0.00 H new ATOM 0 HD3 LYS B 127 -0.027 7.170 0.932 1.00 0.00 H new ATOM 0 HE2 LYS B 127 -2.339 6.465 2.236 1.00 0.00 H new ATOM 0 HE3 LYS B 127 -2.140 5.091 1.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 127 -0.930 4.480 3.010 1.00 0.00 H new ATOM 0 HZ2 LYS B 127 0.289 5.126 2.019 1.00 0.00 H new ATOM 0 HZ3 LYS B 127 -0.341 6.046 3.300 1.00 0.00 H new ATOM 878 N ALA B 128 -0.575 11.910 -1.542 1.00 0.00 N ATOM 879 CA ALA B 128 -1.055 13.170 -2.090 1.00 0.00 C ATOM 880 C ALA B 128 -0.851 13.205 -3.600 1.00 0.00 C ATOM 881 O ALA B 128 -1.610 13.843 -4.328 1.00 0.00 O ATOM 882 CB ALA B 128 -0.342 14.340 -1.429 1.00 0.00 C ATOM 0 H ALA B 128 0.213 12.001 -0.900 1.00 0.00 H new ATOM 0 HA ALA B 128 -2.122 13.254 -1.884 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -0.711 15.276 -1.849 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -0.533 14.323 -0.356 1.00 0.00 H new ATOM 0 HB3 ALA B 128 0.730 14.261 -1.608 1.00 0.00 H new ATOM 888 N LYS B 129 0.180 12.503 -4.061 1.00 0.00 N ATOM 889 CA LYS B 129 0.491 12.437 -5.482 1.00 0.00 C ATOM 890 C LYS B 129 -0.534 11.581 -6.214 1.00 0.00 C ATOM 891 O LYS B 129 -1.120 12.008 -7.209 1.00 0.00 O ATOM 892 CB LYS B 129 1.892 11.862 -5.687 1.00 0.00 C ATOM 893 CG LYS B 129 2.685 12.567 -6.772 1.00 0.00 C ATOM 894 CD LYS B 129 4.168 12.245 -6.670 1.00 0.00 C ATOM 895 CE LYS B 129 5.028 13.435 -7.062 1.00 0.00 C ATOM 896 NZ LYS B 129 5.705 13.224 -8.372 1.00 0.00 N ATOM 0 H LYS B 129 0.816 11.970 -3.467 1.00 0.00 H new ATOM 0 HA LYS B 129 0.457 13.447 -5.890 1.00 0.00 H new ATOM 0 HB2 LYS B 129 2.442 11.924 -4.748 1.00 0.00 H new ATOM 0 HB3 LYS B 129 1.809 10.805 -5.938 1.00 0.00 H new ATOM 0 HG2 LYS B 129 2.312 12.267 -7.751 1.00 0.00 H new ATOM 0 HG3 LYS B 129 2.538 13.644 -6.691 1.00 0.00 H new ATOM 0 HD2 LYS B 129 4.406 11.944 -5.650 1.00 0.00 H new ATOM 0 HD3 LYS B 129 4.402 11.398 -7.315 1.00 0.00 H new ATOM 0 HE2 LYS B 129 4.408 14.330 -7.114 1.00 0.00 H new ATOM 0 HE3 LYS B 129 5.777 13.611 -6.290 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 6.054 14.135 -8.733 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 6.505 12.571 -8.248 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 5.029 12.819 -9.051 1.00 0.00 H new ATOM 910 N ILE B 130 -0.751 10.371 -5.708 1.00 0.00 N ATOM 911 CA ILE B 130 -1.713 9.454 -6.306 1.00 0.00 C ATOM 912 C ILE B 130 -3.100 10.087 -6.360 1.00 0.00 C ATOM 913 O ILE B 130 -3.932 9.716 -7.188 1.00 0.00 O ATOM 914 CB ILE B 130 -1.789 8.128 -5.523 1.00 0.00 C ATOM 915 CG1 ILE B 130 -0.397 7.506 -5.391 1.00 0.00 C ATOM 916 CG2 ILE B 130 -2.742 7.160 -6.207 1.00 0.00 C ATOM 917 CD1 ILE B 130 -0.219 6.686 -4.132 1.00 0.00 C ATOM 0 H ILE B 130 -0.273 10.003 -4.885 1.00 0.00 H new ATOM 0 HA ILE B 130 -1.371 9.243 -7.319 1.00 0.00 H new ATOM 0 HB ILE B 130 -2.170 8.338 -4.524 1.00 0.00 H new ATOM 0 HG12 ILE B 130 -0.207 6.873 -6.257 1.00 0.00 H new ATOM 0 HG13 ILE B 130 0.350 8.300 -5.407 1.00 0.00 H new ATOM 0 HG21 ILE B 130 -2.784 6.229 -5.641 1.00 0.00 H new ATOM 0 HG22 ILE B 130 -3.738 7.601 -6.253 1.00 0.00 H new ATOM 0 HG23 ILE B 130 -2.389 6.955 -7.218 1.00 0.00 H new ATOM 0 HD11 ILE B 130 0.790 6.276 -4.105 1.00 0.00 H new ATOM 0 HD12 ILE B 130 -0.377 7.320 -3.260 1.00 0.00 H new ATOM 0 HD13 ILE B 130 -0.942 5.871 -4.124 1.00 0.00 H new ATOM 929 N GLN B 131 -3.338 11.050 -5.474 1.00 0.00 N ATOM 930 CA GLN B 131 -4.621 11.741 -5.423 1.00 0.00 C ATOM 931 C GLN B 131 -4.731 12.750 -6.561 1.00 0.00 C ATOM 932 O GLN B 131 -5.758 12.837 -7.232 1.00 0.00 O ATOM 933 CB GLN B 131 -4.789 12.451 -4.078 1.00 0.00 C ATOM 934 CG GLN B 131 -6.202 12.377 -3.524 1.00 0.00 C ATOM 935 CD GLN B 131 -6.973 13.668 -3.717 1.00 0.00 C ATOM 936 OE1 GLN B 131 -7.097 14.169 -4.835 1.00 0.00 O ATOM 937 NE2 GLN B 131 -7.495 14.215 -2.626 1.00 0.00 N ATOM 0 H GLN B 131 -2.659 11.369 -4.782 1.00 0.00 H new ATOM 0 HA GLN B 131 -5.413 11.001 -5.534 1.00 0.00 H new ATOM 0 HB2 GLN B 131 -4.101 12.011 -3.356 1.00 0.00 H new ATOM 0 HB3 GLN B 131 -4.506 13.498 -4.191 1.00 0.00 H new ATOM 0 HG2 GLN B 131 -6.737 11.562 -4.012 1.00 0.00 H new ATOM 0 HG3 GLN B 131 -6.159 12.139 -2.461 1.00 0.00 H new ATOM 0 HE21 GLN B 131 -7.368 13.766 -1.719 1.00 0.00 H new ATOM 0 HE22 GLN B 131 -8.023 15.085 -2.694 1.00 0.00 H new ATOM 946 N ASP B 132 -3.661 13.507 -6.775 1.00 0.00 N ATOM 947 CA ASP B 132 -3.633 14.507 -7.835 1.00 0.00 C ATOM 948 C ASP B 132 -3.734 13.849 -9.209 1.00 0.00 C ATOM 949 O ASP B 132 -4.101 14.495 -10.190 1.00 0.00 O ATOM 950 CB ASP B 132 -2.351 15.336 -7.747 1.00 0.00 C ATOM 951 CG ASP B 132 -2.576 16.790 -8.109 1.00 0.00 C ATOM 952 OD1 ASP B 132 -3.017 17.057 -9.247 1.00 0.00 O ATOM 953 OD2 ASP B 132 -2.313 17.663 -7.255 1.00 0.00 O ATOM 0 H ASP B 132 -2.802 13.447 -6.229 1.00 0.00 H new ATOM 0 HA ASP B 132 -4.493 15.164 -7.704 1.00 0.00 H new ATOM 0 HB2 ASP B 132 -1.951 15.274 -6.735 1.00 0.00 H new ATOM 0 HB3 ASP B 132 -1.600 14.911 -8.413 1.00 0.00 H new ATOM 958 N LYS B 133 -3.403 12.561 -9.274 1.00 0.00 N ATOM 959 CA LYS B 133 -3.454 11.822 -10.530 1.00 0.00 C ATOM 960 C LYS B 133 -4.792 11.107 -10.690 1.00 0.00 C ATOM 961 O LYS B 133 -5.400 11.149 -11.760 1.00 0.00 O ATOM 962 CB LYS B 133 -2.307 10.809 -10.590 1.00 0.00 C ATOM 963 CG LYS B 133 -1.367 11.028 -11.760 1.00 0.00 C ATOM 964 CD LYS B 133 -0.848 9.709 -12.310 1.00 0.00 C ATOM 965 CE LYS B 133 -0.226 9.887 -13.690 1.00 0.00 C ATOM 966 NZ LYS B 133 -0.083 8.590 -14.410 1.00 0.00 N ATOM 0 H LYS B 133 -3.097 12.010 -8.472 1.00 0.00 H new ATOM 0 HA LYS B 133 -3.348 12.534 -11.349 1.00 0.00 H new ATOM 0 HB2 LYS B 133 -1.738 10.861 -9.662 1.00 0.00 H new ATOM 0 HB3 LYS B 133 -2.724 9.804 -10.652 1.00 0.00 H new ATOM 0 HG2 LYS B 133 -1.886 11.573 -12.548 1.00 0.00 H new ATOM 0 HG3 LYS B 133 -0.528 11.647 -11.443 1.00 0.00 H new ATOM 0 HD2 LYS B 133 -0.107 9.294 -11.626 1.00 0.00 H new ATOM 0 HD3 LYS B 133 -1.666 8.990 -12.368 1.00 0.00 H new ATOM 0 HE2 LYS B 133 -0.843 10.564 -14.281 1.00 0.00 H new ATOM 0 HE3 LYS B 133 0.753 10.355 -13.589 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 0.344 8.756 -15.344 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 0.527 7.953 -13.859 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 -1.020 8.155 -14.530 1.00 0.00 H new ATOM 980 N GLU B 134 -5.244 10.445 -9.634 1.00 0.00 N ATOM 981 CA GLU B 134 -6.508 9.716 -9.671 1.00 0.00 C ATOM 982 C GLU B 134 -7.581 10.431 -8.854 1.00 0.00 C ATOM 983 O GLU B 134 -8.692 10.657 -9.335 1.00 0.00 O ATOM 984 CB GLU B 134 -6.311 8.292 -9.146 1.00 0.00 C ATOM 985 CG GLU B 134 -6.428 7.225 -10.220 1.00 0.00 C ATOM 986 CD GLU B 134 -7.070 5.950 -9.713 1.00 0.00 C ATOM 987 OE1 GLU B 134 -6.384 5.180 -9.009 1.00 0.00 O ATOM 988 OE2 GLU B 134 -8.260 5.722 -10.010 1.00 0.00 O ATOM 0 H GLU B 134 -4.755 10.397 -8.740 1.00 0.00 H new ATOM 0 HA GLU B 134 -6.843 9.673 -10.707 1.00 0.00 H new ATOM 0 HB2 GLU B 134 -5.329 8.219 -8.679 1.00 0.00 H new ATOM 0 HB3 GLU B 134 -7.049 8.095 -8.369 1.00 0.00 H new ATOM 0 HG2 GLU B 134 -7.014 7.616 -11.052 1.00 0.00 H new ATOM 0 HG3 GLU B 134 -5.436 6.997 -10.609 1.00 0.00 H new ATOM 995 N GLY B 135 -7.244 10.782 -7.618 1.00 0.00 N ATOM 996 CA GLY B 135 -8.192 11.464 -6.756 1.00 0.00 C ATOM 997 C GLY B 135 -8.672 10.588 -5.616 1.00 0.00 C ATOM 998 O GLY B 135 -9.810 10.713 -5.165 1.00 0.00 O ATOM 0 H GLY B 135 -6.331 10.607 -7.197 1.00 0.00 H new ATOM 0 HA2 GLY B 135 -7.728 12.362 -6.349 1.00 0.00 H new ATOM 0 HA3 GLY B 135 -9.049 11.788 -7.347 1.00 0.00 H new ATOM 1002 N ILE B 136 -7.801 9.699 -5.151 1.00 0.00 N ATOM 1003 CA ILE B 136 -8.140 8.797 -4.058 1.00 0.00 C ATOM 1004 C ILE B 136 -7.699 9.374 -2.713 1.00 0.00 C ATOM 1005 O ILE B 136 -6.565 9.833 -2.570 1.00 0.00 O ATOM 1006 CB ILE B 136 -7.486 7.416 -4.250 1.00 0.00 C ATOM 1007 CG1 ILE B 136 -7.756 6.891 -5.661 1.00 0.00 C ATOM 1008 CG2 ILE B 136 -8.001 6.435 -3.207 1.00 0.00 C ATOM 1009 CD1 ILE B 136 -7.129 5.541 -5.934 1.00 0.00 C ATOM 0 H ILE B 136 -6.855 9.584 -5.514 1.00 0.00 H new ATOM 0 HA ILE B 136 -9.224 8.683 -4.064 1.00 0.00 H new ATOM 0 HB ILE B 136 -6.409 7.521 -4.121 1.00 0.00 H new ATOM 0 HG12 ILE B 136 -8.833 6.820 -5.814 1.00 0.00 H new ATOM 0 HG13 ILE B 136 -7.378 7.611 -6.386 1.00 0.00 H new ATOM 0 HG21 ILE B 136 -7.529 5.464 -3.357 1.00 0.00 H new ATOM 0 HG22 ILE B 136 -7.762 6.805 -2.210 1.00 0.00 H new ATOM 0 HG23 ILE B 136 -9.082 6.332 -3.306 1.00 0.00 H new ATOM 0 HD11 ILE B 136 -7.362 5.231 -6.953 1.00 0.00 H new ATOM 0 HD12 ILE B 136 -6.048 5.611 -5.814 1.00 0.00 H new ATOM 0 HD13 ILE B 136 -7.525 4.807 -5.232 1.00 0.00 H new ATOM 1021 N PRO B 137 -8.589 9.357 -1.703 1.00 0.00 N ATOM 1022 CA PRO B 137 -8.276 9.882 -0.369 1.00 0.00 C ATOM 1023 C PRO B 137 -7.113 9.142 0.286 1.00 0.00 C ATOM 1024 O PRO B 137 -6.970 7.930 0.126 1.00 0.00 O ATOM 1025 CB PRO B 137 -9.567 9.656 0.429 1.00 0.00 C ATOM 1026 CG PRO B 137 -10.320 8.625 -0.336 1.00 0.00 C ATOM 1027 CD PRO B 137 -9.961 8.829 -1.778 1.00 0.00 C ATOM 0 HA PRO B 137 -7.967 10.927 -0.411 1.00 0.00 H new ATOM 0 HB2 PRO B 137 -9.350 9.315 1.441 1.00 0.00 H new ATOM 0 HB3 PRO B 137 -10.141 10.578 0.519 1.00 0.00 H new ATOM 0 HG2 PRO B 137 -10.051 7.622 -0.006 1.00 0.00 H new ATOM 0 HG3 PRO B 137 -11.394 8.734 -0.183 1.00 0.00 H new ATOM 0 HD2 PRO B 137 -10.005 7.897 -2.341 1.00 0.00 H new ATOM 0 HD3 PRO B 137 -10.637 9.530 -2.268 1.00 0.00 H new ATOM 1035 N PRO B 138 -6.266 9.862 1.042 1.00 0.00 N ATOM 1036 CA PRO B 138 -5.116 9.264 1.727 1.00 0.00 C ATOM 1037 C PRO B 138 -5.542 8.367 2.878 1.00 0.00 C ATOM 1038 O PRO B 138 -4.903 7.356 3.169 1.00 0.00 O ATOM 1039 CB PRO B 138 -4.351 10.476 2.258 1.00 0.00 C ATOM 1040 CG PRO B 138 -5.383 11.537 2.410 1.00 0.00 C ATOM 1041 CD PRO B 138 -6.367 11.312 1.296 1.00 0.00 C ATOM 0 HA PRO B 138 -4.529 8.629 1.064 1.00 0.00 H new ATOM 0 HB2 PRO B 138 -3.868 10.254 3.210 1.00 0.00 H new ATOM 0 HB3 PRO B 138 -3.566 10.783 1.567 1.00 0.00 H new ATOM 0 HG2 PRO B 138 -5.871 11.472 3.382 1.00 0.00 H new ATOM 0 HG3 PRO B 138 -4.937 12.529 2.343 1.00 0.00 H new ATOM 0 HD2 PRO B 138 -7.377 11.600 1.587 1.00 0.00 H new ATOM 0 HD3 PRO B 138 -6.112 11.894 0.410 1.00 0.00 H new ATOM 1049 N ASP B 139 -6.630 8.752 3.529 1.00 0.00 N ATOM 1050 CA ASP B 139 -7.160 7.994 4.656 1.00 0.00 C ATOM 1051 C ASP B 139 -7.683 6.638 4.198 1.00 0.00 C ATOM 1052 O ASP B 139 -7.640 5.659 4.943 1.00 0.00 O ATOM 1053 CB ASP B 139 -8.277 8.779 5.346 1.00 0.00 C ATOM 1054 CG ASP B 139 -7.742 9.810 6.321 1.00 0.00 C ATOM 1055 OD1 ASP B 139 -6.729 9.523 6.992 1.00 0.00 O ATOM 1056 OD2 ASP B 139 -8.336 10.905 6.412 1.00 0.00 O ATOM 0 H ASP B 139 -7.166 9.588 3.296 1.00 0.00 H new ATOM 0 HA ASP B 139 -6.350 7.831 5.367 1.00 0.00 H new ATOM 0 HB2 ASP B 139 -8.886 9.278 4.592 1.00 0.00 H new ATOM 0 HB3 ASP B 139 -8.930 8.086 5.876 1.00 0.00 H new ATOM 1061 N GLN B 140 -8.177 6.589 2.966 1.00 0.00 N ATOM 1062 CA GLN B 140 -8.708 5.354 2.404 1.00 0.00 C ATOM 1063 C GLN B 140 -7.630 4.595 1.635 1.00 0.00 C ATOM 1064 O GLN B 140 -7.722 3.380 1.456 1.00 0.00 O ATOM 1065 CB GLN B 140 -9.890 5.659 1.481 1.00 0.00 C ATOM 1066 CG GLN B 140 -11.020 4.652 1.590 1.00 0.00 C ATOM 1067 CD GLN B 140 -12.190 4.989 0.683 1.00 0.00 C ATOM 1068 OE1 GLN B 140 -12.390 4.354 -0.352 1.00 0.00 O ATOM 1069 NE2 GLN B 140 -12.960 5.995 1.068 1.00 0.00 N ATOM 0 H GLN B 140 -8.221 7.391 2.337 1.00 0.00 H new ATOM 0 HA GLN B 140 -9.049 4.726 3.228 1.00 0.00 H new ATOM 0 HB2 GLN B 140 -10.275 6.652 1.713 1.00 0.00 H new ATOM 0 HB3 GLN B 140 -9.538 5.687 0.450 1.00 0.00 H new ATOM 0 HG2 GLN B 140 -10.644 3.660 1.339 1.00 0.00 H new ATOM 0 HG3 GLN B 140 -11.366 4.609 2.623 1.00 0.00 H new ATOM 0 HE21 GLN B 140 -12.754 6.492 1.935 1.00 0.00 H new ATOM 0 HE22 GLN B 140 -13.759 6.273 0.498 1.00 0.00 H new ATOM 1078 N GLN B 141 -6.609 5.317 1.181 1.00 0.00 N ATOM 1079 CA GLN B 141 -5.517 4.706 0.431 1.00 0.00 C ATOM 1080 C GLN B 141 -4.633 3.859 1.342 1.00 0.00 C ATOM 1081 O GLN B 141 -4.201 4.312 2.401 1.00 0.00 O ATOM 1082 CB GLN B 141 -4.677 5.785 -0.256 1.00 0.00 C ATOM 1083 CG GLN B 141 -5.221 6.210 -1.610 1.00 0.00 C ATOM 1084 CD GLN B 141 -4.354 7.255 -2.284 1.00 0.00 C ATOM 1085 OE1 GLN B 141 -3.599 6.950 -3.208 1.00 0.00 O ATOM 1086 NE2 GLN B 141 -4.457 8.497 -1.825 1.00 0.00 N ATOM 0 H GLN B 141 -6.516 6.323 1.319 1.00 0.00 H new ATOM 0 HA GLN B 141 -5.952 4.055 -0.327 1.00 0.00 H new ATOM 0 HB2 GLN B 141 -4.621 6.658 0.394 1.00 0.00 H new ATOM 0 HB3 GLN B 141 -3.659 5.416 -0.382 1.00 0.00 H new ATOM 0 HG2 GLN B 141 -5.299 5.336 -2.257 1.00 0.00 H new ATOM 0 HG3 GLN B 141 -6.229 6.605 -1.485 1.00 0.00 H new ATOM 0 HE21 GLN B 141 -5.095 8.706 -1.057 1.00 0.00 H new ATOM 0 HE22 GLN B 141 -3.898 9.242 -2.240 1.00 0.00 H new ATOM 1095 N ARG B 142 -4.367 2.627 0.918 1.00 0.00 N ATOM 1096 CA ARG B 142 -3.532 1.713 1.688 1.00 0.00 C ATOM 1097 C ARG B 142 -2.369 1.210 0.839 1.00 0.00 C ATOM 1098 O ARG B 142 -2.542 0.350 -0.024 1.00 0.00 O ATOM 1099 CB ARG B 142 -4.364 0.531 2.195 1.00 0.00 C ATOM 1100 CG ARG B 142 -4.593 0.550 3.698 1.00 0.00 C ATOM 1101 CD ARG B 142 -5.514 1.687 4.110 1.00 0.00 C ATOM 1102 NE ARG B 142 -4.978 2.442 5.240 1.00 0.00 N ATOM 1103 CZ ARG B 142 -5.718 3.201 6.045 1.00 0.00 C ATOM 1104 NH1 ARG B 142 -7.026 3.313 5.847 1.00 0.00 N ATOM 1105 NH2 ARG B 142 -5.149 3.852 7.050 1.00 0.00 N ATOM 0 H ARG B 142 -4.719 2.239 0.043 1.00 0.00 H new ATOM 0 HA ARG B 142 -3.130 2.253 2.545 1.00 0.00 H new ATOM 0 HB2 ARG B 142 -5.329 0.533 1.689 1.00 0.00 H new ATOM 0 HB3 ARG B 142 -3.863 -0.398 1.924 1.00 0.00 H new ATOM 0 HG2 ARG B 142 -5.024 -0.400 4.013 1.00 0.00 H new ATOM 0 HG3 ARG B 142 -3.637 0.652 4.211 1.00 0.00 H new ATOM 0 HD2 ARG B 142 -5.663 2.358 3.264 1.00 0.00 H new ATOM 0 HD3 ARG B 142 -6.492 1.284 4.374 1.00 0.00 H new ATOM 0 HE ARG B 142 -3.976 2.384 5.423 1.00 0.00 H new ATOM 0 HH11 ARG B 142 -7.469 2.816 5.075 1.00 0.00 H new ATOM 0 HH12 ARG B 142 -7.588 3.896 6.467 1.00 0.00 H new ATOM 0 HH21 ARG B 142 -4.144 3.771 7.206 1.00 0.00 H new ATOM 0 HH22 ARG B 142 -5.716 4.434 7.667 1.00 0.00 H new ATOM 1119 N LEU B 143 -1.185 1.759 1.086 1.00 0.00 N ATOM 1120 CA LEU B 143 0.006 1.374 0.339 1.00 0.00 C ATOM 1121 C LEU B 143 0.674 0.147 0.952 1.00 0.00 C ATOM 1122 O LEU B 143 1.133 0.179 2.094 1.00 0.00 O ATOM 1123 CB LEU B 143 0.998 2.538 0.287 1.00 0.00 C ATOM 1124 CG LEU B 143 0.441 3.836 -0.300 1.00 0.00 C ATOM 1125 CD1 LEU B 143 1.524 4.901 -0.365 1.00 0.00 C ATOM 1126 CD2 LEU B 143 -0.146 3.586 -1.681 1.00 0.00 C ATOM 0 H LEU B 143 -1.025 2.472 1.798 1.00 0.00 H new ATOM 0 HA LEU B 143 -0.304 1.120 -0.675 1.00 0.00 H new ATOM 0 HB2 LEU B 143 1.354 2.737 1.298 1.00 0.00 H new ATOM 0 HB3 LEU B 143 1.863 2.232 -0.302 1.00 0.00 H new ATOM 0 HG LEU B 143 -0.354 4.196 0.353 1.00 0.00 H new ATOM 0 HD11 LEU B 143 1.109 5.817 -0.785 1.00 0.00 H new ATOM 0 HD12 LEU B 143 1.899 5.100 0.639 1.00 0.00 H new ATOM 0 HD13 LEU B 143 2.341 4.551 -0.995 1.00 0.00 H new ATOM 0 HD21 LEU B 143 -0.538 4.520 -2.084 1.00 0.00 H new ATOM 0 HD22 LEU B 143 0.631 3.203 -2.343 1.00 0.00 H new ATOM 0 HD23 LEU B 143 -0.952 2.856 -1.607 1.00 0.00 H new ATOM 1138 N ILE B 144 0.727 -0.929 0.177 1.00 0.00 N ATOM 1139 CA ILE B 144 1.340 -2.175 0.623 1.00 0.00 C ATOM 1140 C ILE B 144 2.790 -2.258 0.155 1.00 0.00 C ATOM 1141 O ILE B 144 3.086 -1.999 -1.011 1.00 0.00 O ATOM 1142 CB ILE B 144 0.568 -3.395 0.085 1.00 0.00 C ATOM 1143 CG1 ILE B 144 -0.936 -3.221 0.326 1.00 0.00 C ATOM 1144 CG2 ILE B 144 1.078 -4.678 0.725 1.00 0.00 C ATOM 1145 CD1 ILE B 144 -1.347 -3.367 1.775 1.00 0.00 C ATOM 0 H ILE B 144 0.350 -0.964 -0.770 1.00 0.00 H new ATOM 0 HA ILE B 144 1.307 -2.184 1.712 1.00 0.00 H new ATOM 0 HB ILE B 144 0.736 -3.467 -0.990 1.00 0.00 H new ATOM 0 HG12 ILE B 144 -1.239 -2.236 -0.030 1.00 0.00 H new ATOM 0 HG13 ILE B 144 -1.477 -3.956 -0.270 1.00 0.00 H new ATOM 0 HG21 ILE B 144 0.520 -5.528 0.332 1.00 0.00 H new ATOM 0 HG22 ILE B 144 2.137 -4.802 0.497 1.00 0.00 H new ATOM 0 HG23 ILE B 144 0.943 -4.624 1.805 1.00 0.00 H new ATOM 0 HD11 ILE B 144 -2.425 -3.230 1.863 1.00 0.00 H new ATOM 0 HD12 ILE B 144 -1.077 -4.361 2.131 1.00 0.00 H new ATOM 0 HD13 ILE B 144 -0.836 -2.615 2.376 1.00 0.00 H new ATOM 1157 N PHE B 145 3.694 -2.609 1.066 1.00 0.00 N ATOM 1158 CA PHE B 145 5.109 -2.707 0.720 1.00 0.00 C ATOM 1159 C PHE B 145 5.790 -3.881 1.421 1.00 0.00 C ATOM 1160 O PHE B 145 6.035 -3.844 2.627 1.00 0.00 O ATOM 1161 CB PHE B 145 5.829 -1.404 1.070 1.00 0.00 C ATOM 1162 CG PHE B 145 7.253 -1.359 0.594 1.00 0.00 C ATOM 1163 CD1 PHE B 145 7.541 -1.215 -0.754 1.00 0.00 C ATOM 1164 CD2 PHE B 145 8.302 -1.459 1.493 1.00 0.00 C ATOM 1165 CE1 PHE B 145 8.850 -1.174 -1.196 1.00 0.00 C ATOM 1166 CE2 PHE B 145 9.613 -1.418 1.057 1.00 0.00 C ATOM 1167 CZ PHE B 145 9.887 -1.275 -0.289 1.00 0.00 C ATOM 0 H PHE B 145 3.476 -2.828 2.038 1.00 0.00 H new ATOM 0 HA PHE B 145 5.170 -2.882 -0.354 1.00 0.00 H new ATOM 0 HB2 PHE B 145 5.282 -0.568 0.634 1.00 0.00 H new ATOM 0 HB3 PHE B 145 5.811 -1.268 2.151 1.00 0.00 H new ATOM 0 HD1 PHE B 145 6.734 -1.134 -1.467 1.00 0.00 H new ATOM 0 HD2 PHE B 145 8.093 -1.570 2.547 1.00 0.00 H new ATOM 0 HE1 PHE B 145 9.062 -1.063 -2.249 1.00 0.00 H new ATOM 0 HE2 PHE B 145 10.422 -1.498 1.768 1.00 0.00 H new ATOM 0 HZ PHE B 145 10.911 -1.242 -0.632 1.00 0.00 H new ATOM 1177 N ALA B 146 6.110 -4.911 0.641 1.00 0.00 N ATOM 1178 CA ALA B 146 6.787 -6.103 1.149 1.00 0.00 C ATOM 1179 C ALA B 146 6.241 -6.562 2.501 1.00 0.00 C ATOM 1180 O ALA B 146 7.007 -6.886 3.408 1.00 0.00 O ATOM 1181 CB ALA B 146 8.284 -5.846 1.248 1.00 0.00 C ATOM 0 H ALA B 146 5.908 -4.944 -0.358 1.00 0.00 H new ATOM 0 HA ALA B 146 6.595 -6.908 0.440 1.00 0.00 H new ATOM 0 HB1 ALA B 146 8.782 -6.738 1.627 1.00 0.00 H new ATOM 0 HB2 ALA B 146 8.677 -5.603 0.261 1.00 0.00 H new ATOM 0 HB3 ALA B 146 8.466 -5.013 1.927 1.00 0.00 H new ATOM 1187 N GLY B 147 4.919 -6.604 2.630 1.00 0.00 N ATOM 1188 CA GLY B 147 4.319 -7.042 3.871 1.00 0.00 C ATOM 1189 C GLY B 147 4.244 -5.944 4.909 1.00 0.00 C ATOM 1190 O GLY B 147 4.333 -6.209 6.108 1.00 0.00 O ATOM 0 H GLY B 147 4.257 -6.343 1.899 1.00 0.00 H new ATOM 0 HA2 GLY B 147 3.315 -7.415 3.671 1.00 0.00 H new ATOM 0 HA3 GLY B 147 4.895 -7.876 4.273 1.00 0.00 H new ATOM 1194 N LYS B 148 4.082 -4.709 4.456 1.00 0.00 N ATOM 1195 CA LYS B 148 3.998 -3.583 5.362 1.00 0.00 C ATOM 1196 C LYS B 148 3.055 -2.517 4.829 1.00 0.00 C ATOM 1197 O LYS B 148 3.048 -2.213 3.636 1.00 0.00 O ATOM 1198 CB LYS B 148 5.377 -2.979 5.575 1.00 0.00 C ATOM 1199 CG LYS B 148 6.353 -3.912 6.274 1.00 0.00 C ATOM 1200 CD LYS B 148 7.693 -3.235 6.515 1.00 0.00 C ATOM 1201 CE LYS B 148 8.414 -3.837 7.711 1.00 0.00 C ATOM 1202 NZ LYS B 148 8.931 -5.202 7.419 1.00 0.00 N ATOM 0 H LYS B 148 4.007 -4.466 3.468 1.00 0.00 H new ATOM 0 HA LYS B 148 3.607 -3.947 6.312 1.00 0.00 H new ATOM 0 HB2 LYS B 148 5.791 -2.692 4.608 1.00 0.00 H new ATOM 0 HB3 LYS B 148 5.277 -2.066 6.162 1.00 0.00 H new ATOM 0 HG2 LYS B 148 5.931 -4.236 7.225 1.00 0.00 H new ATOM 0 HG3 LYS B 148 6.499 -4.807 5.669 1.00 0.00 H new ATOM 0 HD2 LYS B 148 8.316 -3.333 5.626 1.00 0.00 H new ATOM 0 HD3 LYS B 148 7.539 -2.169 6.681 1.00 0.00 H new ATOM 0 HE2 LYS B 148 9.242 -3.189 7.999 1.00 0.00 H new ATOM 0 HE3 LYS B 148 7.733 -3.881 8.561 1.00 0.00 H new ATOM 0 HZ1 LYS B 148 9.416 -5.577 8.259 1.00 0.00 H new ATOM 0 HZ2 LYS B 148 8.138 -5.827 7.169 1.00 0.00 H new ATOM 0 HZ3 LYS B 148 9.601 -5.157 6.625 1.00 0.00 H new ATOM 1216 N GLN B 149 2.273 -1.943 5.728 1.00 0.00 N ATOM 1217 CA GLN B 149 1.331 -0.892 5.364 1.00 0.00 C ATOM 1218 C GLN B 149 1.939 0.480 5.646 1.00 0.00 C ATOM 1219 O GLN B 149 2.193 0.831 6.798 1.00 0.00 O ATOM 1220 CB GLN B 149 0.016 -1.057 6.134 1.00 0.00 C ATOM 1221 CG GLN B 149 0.132 -0.767 7.623 1.00 0.00 C ATOM 1222 CD GLN B 149 -1.111 -1.165 8.394 1.00 0.00 C ATOM 1223 OE1 GLN B 149 -1.676 -0.364 9.139 1.00 0.00 O ATOM 1224 NE2 GLN B 149 -1.544 -2.407 8.219 1.00 0.00 N ATOM 0 H GLN B 149 2.270 -2.186 6.719 1.00 0.00 H new ATOM 0 HA GLN B 149 1.119 -0.971 4.298 1.00 0.00 H new ATOM 0 HB2 GLN B 149 -0.732 -0.393 5.702 1.00 0.00 H new ATOM 0 HB3 GLN B 149 -0.347 -2.076 6.000 1.00 0.00 H new ATOM 0 HG2 GLN B 149 0.992 -1.301 8.027 1.00 0.00 H new ATOM 0 HG3 GLN B 149 0.320 0.297 7.768 1.00 0.00 H new ATOM 0 HE21 GLN B 149 -1.045 -3.038 7.592 1.00 0.00 H new ATOM 0 HE22 GLN B 149 -2.376 -2.731 8.712 1.00 0.00 H new ATOM 1233 N LEU B 150 2.183 1.248 4.590 1.00 0.00 N ATOM 1234 CA LEU B 150 2.775 2.574 4.734 1.00 0.00 C ATOM 1235 C LEU B 150 1.897 3.478 5.593 1.00 0.00 C ATOM 1236 O LEU B 150 0.671 3.362 5.584 1.00 0.00 O ATOM 1237 CB LEU B 150 2.995 3.208 3.359 1.00 0.00 C ATOM 1238 CG LEU B 150 3.656 2.296 2.324 1.00 0.00 C ATOM 1239 CD1 LEU B 150 3.970 3.069 1.052 1.00 0.00 C ATOM 1240 CD2 LEU B 150 4.922 1.670 2.893 1.00 0.00 C ATOM 0 H LEU B 150 1.981 0.977 3.628 1.00 0.00 H new ATOM 0 HA LEU B 150 3.738 2.461 5.233 1.00 0.00 H new ATOM 0 HB2 LEU B 150 2.032 3.536 2.969 1.00 0.00 H new ATOM 0 HB3 LEU B 150 3.610 4.099 3.481 1.00 0.00 H new ATOM 0 HG LEU B 150 2.957 1.497 2.077 1.00 0.00 H new ATOM 0 HD11 LEU B 150 4.440 2.403 0.328 1.00 0.00 H new ATOM 0 HD12 LEU B 150 3.047 3.469 0.632 1.00 0.00 H new ATOM 0 HD13 LEU B 150 4.649 3.890 1.283 1.00 0.00 H new ATOM 0 HD21 LEU B 150 5.378 1.025 2.142 1.00 0.00 H new ATOM 0 HD22 LEU B 150 5.624 2.456 3.170 1.00 0.00 H new ATOM 0 HD23 LEU B 150 4.672 1.080 3.775 1.00 0.00 H new ATOM 1252 N GLU B 151 2.534 4.379 6.337 1.00 0.00 N ATOM 1253 CA GLU B 151 1.816 5.304 7.203 1.00 0.00 C ATOM 1254 C GLU B 151 2.146 6.749 6.850 1.00 0.00 C ATOM 1255 O GLU B 151 3.266 7.065 6.450 1.00 0.00 O ATOM 1256 CB GLU B 151 2.154 5.035 8.670 1.00 0.00 C ATOM 1257 CG GLU B 151 0.940 5.046 9.586 1.00 0.00 C ATOM 1258 CD GLU B 151 1.310 5.254 11.041 1.00 0.00 C ATOM 1259 OE1 GLU B 151 1.505 6.420 11.443 1.00 0.00 O ATOM 1260 OE2 GLU B 151 1.405 4.250 11.779 1.00 0.00 O ATOM 0 H GLU B 151 3.548 4.486 6.356 1.00 0.00 H new ATOM 0 HA GLU B 151 0.748 5.146 7.050 1.00 0.00 H new ATOM 0 HB2 GLU B 151 2.649 4.067 8.749 1.00 0.00 H new ATOM 0 HB3 GLU B 151 2.865 5.786 9.014 1.00 0.00 H new ATOM 0 HG2 GLU B 151 0.259 5.837 9.271 1.00 0.00 H new ATOM 0 HG3 GLU B 151 0.403 4.103 9.483 1.00 0.00 H new ATOM 1267 N ASP B 152 1.156 7.616 7.002 1.00 0.00 N ATOM 1268 CA ASP B 152 1.312 9.034 6.702 1.00 0.00 C ATOM 1269 C ASP B 152 2.332 9.697 7.627 1.00 0.00 C ATOM 1270 O ASP B 152 2.800 10.803 7.352 1.00 0.00 O ATOM 1271 CB ASP B 152 -0.039 9.740 6.831 1.00 0.00 C ATOM 1272 CG ASP B 152 -0.271 10.763 5.737 1.00 0.00 C ATOM 1273 OD1 ASP B 152 -0.538 10.352 4.589 1.00 0.00 O ATOM 1274 OD2 ASP B 152 -0.190 11.974 6.030 1.00 0.00 O ATOM 0 H ASP B 152 0.226 7.360 7.335 1.00 0.00 H new ATOM 0 HA ASP B 152 1.680 9.122 5.680 1.00 0.00 H new ATOM 0 HB2 ASP B 152 -0.836 8.997 6.803 1.00 0.00 H new ATOM 0 HB3 ASP B 152 -0.096 10.233 7.802 1.00 0.00 H new ATOM 1279 N GLY B 153 2.668 9.028 8.726 1.00 0.00 N ATOM 1280 CA GLY B 153 3.621 9.587 9.668 1.00 0.00 C ATOM 1281 C GLY B 153 5.025 9.030 9.508 1.00 0.00 C ATOM 1282 O GLY B 153 5.931 9.408 10.250 1.00 0.00 O ATOM 0 H GLY B 153 2.299 8.112 8.980 1.00 0.00 H new ATOM 0 HA2 GLY B 153 3.651 10.669 9.544 1.00 0.00 H new ATOM 0 HA3 GLY B 153 3.274 9.392 10.683 1.00 0.00 H new ATOM 1286 N ARG B 154 5.214 8.128 8.547 1.00 0.00 N ATOM 1287 CA ARG B 154 6.513 7.530 8.314 1.00 0.00 C ATOM 1288 C ARG B 154 7.164 8.102 7.065 1.00 0.00 C ATOM 1289 O ARG B 154 6.671 9.061 6.469 1.00 0.00 O ATOM 1290 CB ARG B 154 6.379 6.019 8.177 1.00 0.00 C ATOM 1291 CG ARG B 154 6.912 5.248 9.373 1.00 0.00 C ATOM 1292 CD ARG B 154 7.542 3.928 8.956 1.00 0.00 C ATOM 1293 NE ARG B 154 6.742 2.782 9.381 1.00 0.00 N ATOM 1294 CZ ARG B 154 7.175 1.523 9.351 1.00 0.00 C ATOM 1295 NH1 ARG B 154 8.399 1.246 8.918 1.00 0.00 N ATOM 1296 NH2 ARG B 154 6.383 0.540 9.756 1.00 0.00 N ATOM 0 H ARG B 154 4.479 7.800 7.920 1.00 0.00 H new ATOM 0 HA ARG B 154 7.147 7.761 9.170 1.00 0.00 H new ATOM 0 HB2 ARG B 154 5.328 5.768 8.033 1.00 0.00 H new ATOM 0 HB3 ARG B 154 6.910 5.696 7.282 1.00 0.00 H new ATOM 0 HG2 ARG B 154 7.651 5.854 9.897 1.00 0.00 H new ATOM 0 HG3 ARG B 154 6.100 5.058 10.075 1.00 0.00 H new ATOM 0 HD2 ARG B 154 7.658 3.908 7.872 1.00 0.00 H new ATOM 0 HD3 ARG B 154 8.541 3.852 9.385 1.00 0.00 H new ATOM 0 HE ARG B 154 5.796 2.956 9.721 1.00 0.00 H new ATOM 0 HH11 ARG B 154 9.012 1.999 8.606 1.00 0.00 H new ATOM 0 HH12 ARG B 154 8.726 0.280 8.897 1.00 0.00 H new ATOM 0 HH21 ARG B 154 5.442 0.748 10.090 1.00 0.00 H new ATOM 0 HH22 ARG B 154 6.715 -0.424 9.733 1.00 0.00 H new ATOM 1310 N THR B 155 8.275 7.498 6.680 1.00 0.00 N ATOM 1311 CA THR B 155 9.018 7.925 5.501 1.00 0.00 C ATOM 1312 C THR B 155 9.235 6.757 4.543 1.00 0.00 C ATOM 1313 O THR B 155 9.163 5.594 4.940 1.00 0.00 O ATOM 1314 CB THR B 155 10.364 8.526 5.910 1.00 0.00 C ATOM 1315 OG1 THR B 155 10.757 8.057 7.187 1.00 0.00 O ATOM 1316 CG2 THR B 155 10.353 10.039 5.962 1.00 0.00 C ATOM 0 H THR B 155 8.687 6.704 7.170 1.00 0.00 H new ATOM 0 HA THR B 155 8.431 8.687 4.987 1.00 0.00 H new ATOM 0 HB THR B 155 11.066 8.209 5.139 1.00 0.00 H new ATOM 0 HG1 THR B 155 11.621 8.452 7.429 1.00 0.00 H new ATOM 0 HG21 THR B 155 11.338 10.400 6.258 1.00 0.00 H new ATOM 0 HG22 THR B 155 10.102 10.435 4.978 1.00 0.00 H new ATOM 0 HG23 THR B 155 9.611 10.373 6.687 1.00 0.00 H new ATOM 1324 N LEU B 156 9.503 7.076 3.281 1.00 0.00 N ATOM 1325 CA LEU B 156 9.733 6.058 2.264 1.00 0.00 C ATOM 1326 C LEU B 156 10.904 5.161 2.653 1.00 0.00 C ATOM 1327 O LEU B 156 10.828 3.937 2.541 1.00 0.00 O ATOM 1328 CB LEU B 156 10.001 6.719 0.910 1.00 0.00 C ATOM 1329 CG LEU B 156 8.802 6.763 -0.039 1.00 0.00 C ATOM 1330 CD1 LEU B 156 9.205 7.359 -1.379 1.00 0.00 C ATOM 1331 CD2 LEU B 156 8.215 5.370 -0.226 1.00 0.00 C ATOM 0 H LEU B 156 9.566 8.035 2.938 1.00 0.00 H new ATOM 0 HA LEU B 156 8.839 5.440 2.186 1.00 0.00 H new ATOM 0 HB2 LEU B 156 10.346 7.739 1.083 1.00 0.00 H new ATOM 0 HB3 LEU B 156 10.815 6.187 0.418 1.00 0.00 H new ATOM 0 HG LEU B 156 8.036 7.400 0.404 1.00 0.00 H new ATOM 0 HD11 LEU B 156 8.340 7.383 -2.042 1.00 0.00 H new ATOM 0 HD12 LEU B 156 9.575 8.373 -1.229 1.00 0.00 H new ATOM 0 HD13 LEU B 156 9.989 6.749 -1.828 1.00 0.00 H new ATOM 0 HD21 LEU B 156 7.363 5.422 -0.904 1.00 0.00 H new ATOM 0 HD22 LEU B 156 8.973 4.709 -0.646 1.00 0.00 H new ATOM 0 HD23 LEU B 156 7.888 4.981 0.738 1.00 0.00 H new ATOM 1343 N SER B 157 11.981 5.780 3.121 1.00 0.00 N ATOM 1344 CA SER B 157 13.165 5.044 3.540 1.00 0.00 C ATOM 1345 C SER B 157 12.896 4.313 4.851 1.00 0.00 C ATOM 1346 O SER B 157 13.540 3.309 5.155 1.00 0.00 O ATOM 1347 CB SER B 157 14.357 5.994 3.692 1.00 0.00 C ATOM 1348 OG SER B 157 15.276 5.518 4.662 1.00 0.00 O ATOM 0 H SER B 157 12.058 6.792 3.220 1.00 0.00 H new ATOM 0 HA SER B 157 13.406 4.307 2.774 1.00 0.00 H new ATOM 0 HB2 SER B 157 14.862 6.103 2.732 1.00 0.00 H new ATOM 0 HB3 SER B 157 14.002 6.983 3.980 1.00 0.00 H new ATOM 0 HG SER B 157 16.027 6.144 4.736 1.00 0.00 H new ATOM 1354 N ASP B 158 11.929 4.814 5.617 1.00 0.00 N ATOM 1355 CA ASP B 158 11.567 4.195 6.883 1.00 0.00 C ATOM 1356 C ASP B 158 11.057 2.781 6.640 1.00 0.00 C ATOM 1357 O ASP B 158 11.304 1.871 7.431 1.00 0.00 O ATOM 1358 CB ASP B 158 10.496 5.024 7.594 1.00 0.00 C ATOM 1359 CG ASP B 158 10.936 5.480 8.971 1.00 0.00 C ATOM 1360 OD1 ASP B 158 12.159 5.591 9.198 1.00 0.00 O ATOM 1361 OD2 ASP B 158 10.057 5.726 9.824 1.00 0.00 O ATOM 0 H ASP B 158 11.386 5.644 5.381 1.00 0.00 H new ATOM 0 HA ASP B 158 12.452 4.151 7.518 1.00 0.00 H new ATOM 0 HB2 ASP B 158 10.253 5.896 6.986 1.00 0.00 H new ATOM 0 HB3 ASP B 158 9.584 4.434 7.684 1.00 0.00 H new ATOM 1366 N TYR B 159 10.348 2.610 5.529 1.00 0.00 N ATOM 1367 CA TYR B 159 9.802 1.319 5.158 1.00 0.00 C ATOM 1368 C TYR B 159 10.772 0.556 4.256 1.00 0.00 C ATOM 1369 O TYR B 159 10.561 -0.621 3.969 1.00 0.00 O ATOM 1370 CB TYR B 159 8.463 1.514 4.452 1.00 0.00 C ATOM 1371 CG TYR B 159 7.290 1.597 5.403 1.00 0.00 C ATOM 1372 CD1 TYR B 159 6.704 0.448 5.918 1.00 0.00 C ATOM 1373 CD2 TYR B 159 6.773 2.827 5.790 1.00 0.00 C ATOM 1374 CE1 TYR B 159 5.635 0.522 6.791 1.00 0.00 C ATOM 1375 CE2 TYR B 159 5.705 2.910 6.663 1.00 0.00 C ATOM 1376 CZ TYR B 159 5.140 1.755 7.160 1.00 0.00 C ATOM 1377 OH TYR B 159 4.078 1.834 8.031 1.00 0.00 O ATOM 0 H TYR B 159 10.140 3.359 4.868 1.00 0.00 H new ATOM 0 HA TYR B 159 9.650 0.730 6.062 1.00 0.00 H new ATOM 0 HB2 TYR B 159 8.504 2.426 3.857 1.00 0.00 H new ATOM 0 HB3 TYR B 159 8.302 0.688 3.759 1.00 0.00 H new ATOM 0 HD1 TYR B 159 7.090 -0.519 5.632 1.00 0.00 H new ATOM 0 HD2 TYR B 159 7.213 3.734 5.402 1.00 0.00 H new ATOM 0 HE1 TYR B 159 5.190 -0.381 7.182 1.00 0.00 H new ATOM 0 HE2 TYR B 159 5.315 3.874 6.954 1.00 0.00 H new ATOM 0 HH TYR B 159 3.246 1.936 7.524 1.00 0.00 H new ATOM 1387 N ASN B 160 11.837 1.240 3.818 1.00 0.00 N ATOM 1388 CA ASN B 160 12.857 0.646 2.954 1.00 0.00 C ATOM 1389 C ASN B 160 12.416 0.652 1.496 1.00 0.00 C ATOM 1390 O ASN B 160 12.374 -0.389 0.840 1.00 0.00 O ATOM 1391 CB ASN B 160 13.194 -0.778 3.401 1.00 0.00 C ATOM 1392 CG ASN B 160 14.313 -1.393 2.584 1.00 0.00 C ATOM 1393 OD1 ASN B 160 15.372 -0.789 2.408 1.00 0.00 O ATOM 1394 ND2 ASN B 160 14.084 -2.600 2.081 1.00 0.00 N ATOM 0 H ASN B 160 12.013 2.217 4.053 1.00 0.00 H new ATOM 0 HA ASN B 160 13.756 1.256 3.041 1.00 0.00 H new ATOM 0 HB2 ASN B 160 13.480 -0.767 4.453 1.00 0.00 H new ATOM 0 HB3 ASN B 160 12.304 -1.401 3.319 1.00 0.00 H new ATOM 0 HD21 ASN B 160 14.801 -3.064 1.523 1.00 0.00 H new ATOM 0 HD22 ASN B 160 13.191 -3.063 2.252 1.00 0.00 H new ATOM 1401 N ILE B 161 12.100 1.839 0.994 1.00 0.00 N ATOM 1402 CA ILE B 161 11.674 2.000 -0.389 1.00 0.00 C ATOM 1403 C ILE B 161 12.829 2.522 -1.241 1.00 0.00 C ATOM 1404 O ILE B 161 13.597 3.378 -0.802 1.00 0.00 O ATOM 1405 CB ILE B 161 10.465 2.960 -0.486 1.00 0.00 C ATOM 1406 CG1 ILE B 161 9.189 2.244 -0.037 1.00 0.00 C ATOM 1407 CG2 ILE B 161 10.300 3.499 -1.902 1.00 0.00 C ATOM 1408 CD1 ILE B 161 9.032 2.172 1.466 1.00 0.00 C ATOM 0 H ILE B 161 12.131 2.708 1.527 1.00 0.00 H new ATOM 0 HA ILE B 161 11.368 1.024 -0.766 1.00 0.00 H new ATOM 0 HB ILE B 161 10.650 3.807 0.175 1.00 0.00 H new ATOM 0 HG12 ILE B 161 8.326 2.758 -0.460 1.00 0.00 H new ATOM 0 HG13 ILE B 161 9.188 1.232 -0.443 1.00 0.00 H new ATOM 0 HG21 ILE B 161 9.442 4.171 -1.938 1.00 0.00 H new ATOM 0 HG22 ILE B 161 11.199 4.043 -2.191 1.00 0.00 H new ATOM 0 HG23 ILE B 161 10.140 2.669 -2.591 1.00 0.00 H new ATOM 0 HD11 ILE B 161 8.106 1.652 1.711 1.00 0.00 H new ATOM 0 HD12 ILE B 161 9.876 1.632 1.895 1.00 0.00 H new ATOM 0 HD13 ILE B 161 9.001 3.181 1.877 1.00 0.00 H new ATOM 1420 N GLN B 162 12.954 1.995 -2.455 1.00 0.00 N ATOM 1421 CA GLN B 162 14.026 2.408 -3.355 1.00 0.00 C ATOM 1422 C GLN B 162 13.473 2.877 -4.697 1.00 0.00 C ATOM 1423 O GLN B 162 12.261 2.933 -4.899 1.00 0.00 O ATOM 1424 CB GLN B 162 15.009 1.256 -3.571 1.00 0.00 C ATOM 1425 CG GLN B 162 16.142 1.225 -2.558 1.00 0.00 C ATOM 1426 CD GLN B 162 15.932 0.181 -1.479 1.00 0.00 C ATOM 1427 OE1 GLN B 162 16.371 -0.961 -1.611 1.00 0.00 O ATOM 1428 NE2 GLN B 162 15.256 0.569 -0.404 1.00 0.00 N ATOM 0 H GLN B 162 12.330 1.285 -2.837 1.00 0.00 H new ATOM 0 HA GLN B 162 14.548 3.245 -2.891 1.00 0.00 H new ATOM 0 HB2 GLN B 162 14.466 0.312 -3.525 1.00 0.00 H new ATOM 0 HB3 GLN B 162 15.431 1.332 -4.573 1.00 0.00 H new ATOM 0 HG2 GLN B 162 17.081 1.024 -3.075 1.00 0.00 H new ATOM 0 HG3 GLN B 162 16.237 2.207 -2.095 1.00 0.00 H new ATOM 0 HE21 GLN B 162 14.910 1.526 -0.337 1.00 0.00 H new ATOM 0 HE22 GLN B 162 15.082 -0.090 0.355 1.00 0.00 H new ATOM 1437 N LYS B 163 14.374 3.217 -5.613 1.00 0.00 N ATOM 1438 CA LYS B 163 13.981 3.685 -6.936 1.00 0.00 C ATOM 1439 C LYS B 163 13.318 2.571 -7.739 1.00 0.00 C ATOM 1440 O LYS B 163 13.762 1.423 -7.714 1.00 0.00 O ATOM 1441 CB LYS B 163 15.198 4.217 -7.699 1.00 0.00 C ATOM 1442 CG LYS B 163 16.167 5.010 -6.834 1.00 0.00 C ATOM 1443 CD LYS B 163 17.535 4.348 -6.770 1.00 0.00 C ATOM 1444 CE LYS B 163 17.767 3.675 -5.426 1.00 0.00 C ATOM 1445 NZ LYS B 163 19.217 3.522 -5.125 1.00 0.00 N ATOM 0 H LYS B 163 15.382 3.177 -5.463 1.00 0.00 H new ATOM 0 HA LYS B 163 13.260 4.492 -6.802 1.00 0.00 H new ATOM 0 HB2 LYS B 163 15.729 3.378 -8.147 1.00 0.00 H new ATOM 0 HB3 LYS B 163 14.854 4.850 -8.517 1.00 0.00 H new ATOM 0 HG2 LYS B 163 16.269 6.019 -7.233 1.00 0.00 H new ATOM 0 HG3 LYS B 163 15.761 5.105 -5.827 1.00 0.00 H new ATOM 0 HD2 LYS B 163 17.621 3.610 -7.567 1.00 0.00 H new ATOM 0 HD3 LYS B 163 18.310 5.095 -6.943 1.00 0.00 H new ATOM 0 HE2 LYS B 163 17.293 4.262 -4.639 1.00 0.00 H new ATOM 0 HE3 LYS B 163 17.290 2.695 -5.424 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 19.333 3.059 -4.201 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 19.665 2.941 -5.862 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 19.668 4.459 -5.102 1.00 0.00 H new ATOM 1459 N GLU B 164 12.257 2.922 -8.458 1.00 0.00 N ATOM 1460 CA GLU B 164 11.531 1.962 -9.279 1.00 0.00 C ATOM 1461 C GLU B 164 10.887 0.874 -8.425 1.00 0.00 C ATOM 1462 O GLU B 164 10.756 -0.271 -8.859 1.00 0.00 O ATOM 1463 CB GLU B 164 12.474 1.333 -10.300 1.00 0.00 C ATOM 1464 CG GLU B 164 12.093 1.631 -11.740 1.00 0.00 C ATOM 1465 CD GLU B 164 11.491 0.432 -12.450 1.00 0.00 C ATOM 1466 OE1 GLU B 164 11.826 -0.710 -12.070 1.00 0.00 O ATOM 1467 OE2 GLU B 164 10.684 0.635 -13.380 1.00 0.00 O ATOM 0 H GLU B 164 11.880 3.869 -8.488 1.00 0.00 H new ATOM 0 HA GLU B 164 10.736 2.496 -9.799 1.00 0.00 H new ATOM 0 HB2 GLU B 164 13.486 1.694 -10.118 1.00 0.00 H new ATOM 0 HB3 GLU B 164 12.489 0.253 -10.152 1.00 0.00 H new ATOM 0 HG2 GLU B 164 11.379 2.455 -11.759 1.00 0.00 H new ATOM 0 HG3 GLU B 164 12.977 1.963 -12.284 1.00 0.00 H new ATOM 1474 N SER B 165 10.480 1.233 -7.212 1.00 0.00 N ATOM 1475 CA SER B 165 9.848 0.286 -6.312 1.00 0.00 C ATOM 1476 C SER B 165 8.520 -0.202 -6.886 1.00 0.00 C ATOM 1477 O SER B 165 8.069 0.273 -7.928 1.00 0.00 O ATOM 1478 CB SER B 165 9.625 0.934 -4.947 1.00 0.00 C ATOM 1479 OG SER B 165 9.945 2.312 -4.972 1.00 0.00 O ATOM 0 H SER B 165 10.578 2.175 -6.833 1.00 0.00 H new ATOM 0 HA SER B 165 10.507 -0.574 -6.196 1.00 0.00 H new ATOM 0 HB2 SER B 165 8.585 0.806 -4.647 1.00 0.00 H new ATOM 0 HB3 SER B 165 10.237 0.430 -4.199 1.00 0.00 H new ATOM 0 HG SER B 165 10.832 2.449 -4.579 1.00 0.00 H new ATOM 1485 N THR B 166 7.901 -1.151 -6.195 1.00 0.00 N ATOM 1486 CA THR B 166 6.625 -1.707 -6.628 1.00 0.00 C ATOM 1487 C THR B 166 5.695 -1.918 -5.438 1.00 0.00 C ATOM 1488 O THR B 166 5.812 -2.907 -4.714 1.00 0.00 O ATOM 1489 CB THR B 166 6.843 -3.031 -7.362 1.00 0.00 C ATOM 1490 OG1 THR B 166 7.878 -2.909 -8.321 1.00 0.00 O ATOM 1491 CG2 THR B 166 5.607 -3.528 -8.081 1.00 0.00 C ATOM 0 H THR B 166 8.263 -1.553 -5.330 1.00 0.00 H new ATOM 0 HA THR B 166 6.159 -0.996 -7.310 1.00 0.00 H new ATOM 0 HB THR B 166 7.106 -3.750 -6.587 1.00 0.00 H new ATOM 0 HG1 THR B 166 8.003 -3.767 -8.778 1.00 0.00 H new ATOM 0 HG21 THR B 166 5.831 -4.471 -8.580 1.00 0.00 H new ATOM 0 HG22 THR B 166 4.804 -3.681 -7.360 1.00 0.00 H new ATOM 0 HG23 THR B 166 5.295 -2.791 -8.821 1.00 0.00 H new ATOM 1499 N LEU B 167 4.771 -0.984 -5.241 1.00 0.00 N ATOM 1500 CA LEU B 167 3.823 -1.070 -4.138 1.00 0.00 C ATOM 1501 C LEU B 167 2.426 -1.401 -4.648 1.00 0.00 C ATOM 1502 O LEU B 167 2.188 -1.444 -5.855 1.00 0.00 O ATOM 1503 CB LEU B 167 3.796 0.245 -3.359 1.00 0.00 C ATOM 1504 CG LEU B 167 5.166 0.744 -2.889 1.00 0.00 C ATOM 1505 CD1 LEU B 167 5.630 1.915 -3.742 1.00 0.00 C ATOM 1506 CD2 LEU B 167 5.118 1.140 -1.421 1.00 0.00 C ATOM 0 H LEU B 167 4.659 -0.159 -5.831 1.00 0.00 H new ATOM 0 HA LEU B 167 4.147 -1.871 -3.474 1.00 0.00 H new ATOM 0 HB2 LEU B 167 3.341 1.012 -3.985 1.00 0.00 H new ATOM 0 HB3 LEU B 167 3.152 0.122 -2.488 1.00 0.00 H new ATOM 0 HG LEU B 167 5.883 -0.069 -3.002 1.00 0.00 H new ATOM 0 HD11 LEU B 167 6.605 2.256 -3.393 1.00 0.00 H new ATOM 0 HD12 LEU B 167 5.707 1.599 -4.782 1.00 0.00 H new ATOM 0 HD13 LEU B 167 4.911 2.730 -3.663 1.00 0.00 H new ATOM 0 HD21 LEU B 167 6.101 1.492 -1.107 1.00 0.00 H new ATOM 0 HD22 LEU B 167 4.386 1.936 -1.283 1.00 0.00 H new ATOM 0 HD23 LEU B 167 4.832 0.276 -0.820 1.00 0.00 H new ATOM 1518 N HIS B 168 1.505 -1.634 -3.720 1.00 0.00 N ATOM 1519 CA HIS B 168 0.131 -1.961 -4.076 1.00 0.00 C ATOM 1520 C HIS B 168 -0.852 -1.068 -3.326 1.00 0.00 C ATOM 1521 O HIS B 168 -0.903 -1.079 -2.096 1.00 0.00 O ATOM 1522 CB HIS B 168 -0.163 -3.431 -3.769 1.00 0.00 C ATOM 1523 CG HIS B 168 0.904 -4.366 -4.247 1.00 0.00 C ATOM 1524 ND1 HIS B 168 0.764 -5.159 -5.367 1.00 0.00 N ATOM 1525 CD2 HIS B 168 2.136 -4.634 -3.751 1.00 0.00 C ATOM 1526 CE1 HIS B 168 1.862 -5.874 -5.538 1.00 0.00 C ATOM 1527 NE2 HIS B 168 2.709 -5.573 -4.572 1.00 0.00 N ATOM 0 H HIS B 168 1.685 -1.602 -2.717 1.00 0.00 H new ATOM 0 HA HIS B 168 0.009 -1.789 -5.145 1.00 0.00 H new ATOM 0 HB2 HIS B 168 -0.285 -3.552 -2.693 1.00 0.00 H new ATOM 0 HB3 HIS B 168 -1.111 -3.708 -4.230 1.00 0.00 H new ATOM 0 HD2 HIS B 168 2.584 -4.191 -2.873 1.00 0.00 H new ATOM 0 HE1 HIS B 168 2.036 -6.584 -6.333 1.00 0.00 H new ATOM 0 HE2 HIS B 168 3.640 -5.974 -4.454 1.00 0.00 H new ATOM 1536 N LEU B 169 -1.631 -0.295 -4.075 1.00 0.00 N ATOM 1537 CA LEU B 169 -2.611 0.603 -3.482 1.00 0.00 C ATOM 1538 C LEU B 169 -3.926 -0.125 -3.239 1.00 0.00 C ATOM 1539 O LEU B 169 -4.360 -0.938 -4.055 1.00 0.00 O ATOM 1540 CB LEU B 169 -2.832 1.809 -4.394 1.00 0.00 C ATOM 1541 CG LEU B 169 -3.983 2.732 -3.996 1.00 0.00 C ATOM 1542 CD1 LEU B 169 -3.542 3.709 -2.914 1.00 0.00 C ATOM 1543 CD2 LEU B 169 -4.498 3.475 -5.217 1.00 0.00 C ATOM 0 H LEU B 169 -1.602 -0.273 -5.094 1.00 0.00 H new ATOM 0 HA LEU B 169 -2.230 0.951 -2.522 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -1.913 2.394 -4.422 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.012 1.449 -5.407 1.00 0.00 H new ATOM 0 HG LEU B 169 -4.793 2.126 -3.589 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -4.377 4.356 -2.646 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -3.216 3.154 -2.034 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -2.717 4.316 -3.286 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -5.318 4.131 -4.925 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -3.693 4.071 -5.647 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -4.853 2.757 -5.957 1.00 0.00 H new ATOM 1555 N VAL B 170 -4.546 0.165 -2.104 1.00 0.00 N ATOM 1556 CA VAL B 170 -5.802 -0.468 -1.740 1.00 0.00 C ATOM 1557 C VAL B 170 -6.729 0.512 -1.024 1.00 0.00 C ATOM 1558 O VAL B 170 -6.298 1.265 -0.151 1.00 0.00 O ATOM 1559 CB VAL B 170 -5.541 -1.697 -0.844 1.00 0.00 C ATOM 1560 CG1 VAL B 170 -6.797 -2.119 -0.094 1.00 0.00 C ATOM 1561 CG2 VAL B 170 -4.998 -2.849 -1.675 1.00 0.00 C ATOM 0 H VAL B 170 -4.198 0.836 -1.419 1.00 0.00 H new ATOM 0 HA VAL B 170 -6.292 -0.791 -2.658 1.00 0.00 H new ATOM 0 HB VAL B 170 -4.795 -1.418 -0.100 1.00 0.00 H new ATOM 0 HG11 VAL B 170 -6.576 -2.987 0.527 1.00 0.00 H new ATOM 0 HG12 VAL B 170 -7.137 -1.298 0.538 1.00 0.00 H new ATOM 0 HG13 VAL B 170 -7.579 -2.374 -0.809 1.00 0.00 H new ATOM 0 HG21 VAL B 170 -4.818 -3.709 -1.031 1.00 0.00 H new ATOM 0 HG22 VAL B 170 -5.723 -3.116 -2.444 1.00 0.00 H new ATOM 0 HG23 VAL B 170 -4.063 -2.548 -2.147 1.00 0.00 H new ATOM 1571 N LEU B 171 -8.003 0.494 -1.400 1.00 0.00 N ATOM 1572 CA LEU B 171 -8.993 1.371 -0.799 1.00 0.00 C ATOM 1573 C LEU B 171 -9.650 0.702 0.404 1.00 0.00 C ATOM 1574 O LEU B 171 -10.290 -0.340 0.272 1.00 0.00 O ATOM 1575 CB LEU B 171 -10.050 1.741 -1.836 1.00 0.00 C ATOM 1576 CG LEU B 171 -9.746 3.000 -2.648 1.00 0.00 C ATOM 1577 CD1 LEU B 171 -10.830 3.239 -3.688 1.00 0.00 C ATOM 1578 CD2 LEU B 171 -9.608 4.205 -1.730 1.00 0.00 C ATOM 0 H LEU B 171 -8.373 -0.123 -2.123 1.00 0.00 H new ATOM 0 HA LEU B 171 -8.493 2.276 -0.454 1.00 0.00 H new ATOM 0 HB2 LEU B 171 -10.171 0.904 -2.524 1.00 0.00 H new ATOM 0 HB3 LEU B 171 -11.004 1.877 -1.327 1.00 0.00 H new ATOM 0 HG LEU B 171 -8.799 2.855 -3.168 1.00 0.00 H new ATOM 0 HD11 LEU B 171 -10.597 4.139 -4.256 1.00 0.00 H new ATOM 0 HD12 LEU B 171 -10.880 2.386 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU B 171 -11.791 3.363 -3.190 1.00 0.00 H new ATOM 0 HD21 LEU B 171 -9.392 5.093 -2.325 1.00 0.00 H new ATOM 0 HD22 LEU B 171 -10.538 4.353 -1.182 1.00 0.00 H new ATOM 0 HD23 LEU B 171 -8.795 4.034 -1.025 1.00 0.00 H new ATOM 1590 N ARG B 172 -9.484 1.304 1.576 1.00 0.00 N ATOM 1591 CA ARG B 172 -10.060 0.764 2.802 1.00 0.00 C ATOM 1592 C ARG B 172 -11.250 1.593 3.252 1.00 0.00 C ATOM 1593 O ARG B 172 -11.100 2.709 3.747 1.00 0.00 O ATOM 1594 CB ARG B 172 -9.008 0.723 3.911 1.00 0.00 C ATOM 1595 CG ARG B 172 -9.319 -0.283 5.008 1.00 0.00 C ATOM 1596 CD ARG B 172 -10.090 0.360 6.150 1.00 0.00 C ATOM 1597 NE ARG B 172 -9.209 0.777 7.238 1.00 0.00 N ATOM 1598 CZ ARG B 172 -9.644 1.222 8.415 1.00 0.00 C ATOM 1599 NH1 ARG B 172 -10.940 1.309 8.659 1.00 0.00 N ATOM 1600 NH2 ARG B 172 -8.776 1.581 9.350 1.00 0.00 N ATOM 0 H ARG B 172 -8.955 2.167 1.703 1.00 0.00 H new ATOM 0 HA ARG B 172 -10.401 -0.250 2.596 1.00 0.00 H new ATOM 0 HB2 ARG B 172 -8.039 0.482 3.473 1.00 0.00 H new ATOM 0 HB3 ARG B 172 -8.920 1.715 4.354 1.00 0.00 H new ATOM 0 HG2 ARG B 172 -9.900 -1.107 4.594 1.00 0.00 H new ATOM 0 HG3 ARG B 172 -8.390 -0.708 5.388 1.00 0.00 H new ATOM 0 HD2 ARG B 172 -10.638 1.225 5.776 1.00 0.00 H new ATOM 0 HD3 ARG B 172 -10.828 -0.345 6.531 1.00 0.00 H new ATOM 0 HE ARG B 172 -8.202 0.724 7.087 1.00 0.00 H new ATOM 0 HH11 ARG B 172 -11.613 1.034 7.944 1.00 0.00 H new ATOM 0 HH12 ARG B 172 -11.267 1.651 9.563 1.00 0.00 H new ATOM 0 HH21 ARG B 172 -7.774 1.516 9.168 1.00 0.00 H new ATOM 0 HH22 ARG B 172 -9.110 1.922 10.252 1.00 0.00 H new ATOM 1614 N LEU B 173 -12.450 1.040 3.075 1.00 0.00 N ATOM 1615 CA LEU B 173 -13.670 1.722 3.458 1.00 0.00 C ATOM 1616 C LEU B 173 -14.760 0.720 3.817 1.00 0.00 C ATOM 1617 O LEU B 173 -14.540 -0.490 3.800 1.00 0.00 O ATOM 1618 CB LEU B 173 -14.140 2.629 2.324 1.00 0.00 C ATOM 1619 CG LEU B 173 -14.220 1.966 0.946 1.00 0.00 C ATOM 1620 CD1 LEU B 173 -15.050 2.810 -0.007 1.00 0.00 C ATOM 1621 CD2 LEU B 173 -12.820 1.746 0.384 1.00 0.00 C ATOM 0 H LEU B 173 -12.595 0.117 2.666 1.00 0.00 H new ATOM 0 HA LEU B 173 -13.463 2.331 4.338 1.00 0.00 H new ATOM 0 HB2 LEU B 173 -15.125 3.020 2.578 1.00 0.00 H new ATOM 0 HB3 LEU B 173 -13.465 3.482 2.260 1.00 0.00 H new ATOM 0 HG LEU B 173 -14.707 0.997 1.056 1.00 0.00 H new ATOM 0 HD11 LEU B 173 -15.095 2.322 -0.981 1.00 0.00 H new ATOM 0 HD12 LEU B 173 -16.059 2.921 0.390 1.00 0.00 H new ATOM 0 HD13 LEU B 173 -14.592 3.793 -0.115 1.00 0.00 H new ATOM 0 HD21 LEU B 173 -12.891 1.274 -0.596 1.00 0.00 H new ATOM 0 HD22 LEU B 173 -12.311 2.705 0.289 1.00 0.00 H new ATOM 0 HD23 LEU B 173 -12.255 1.101 1.057 1.00 0.00 H new ATOM 1633 N ARG B 174 -15.950 1.232 4.141 1.00 0.00 N ATOM 1634 CA ARG B 174 -17.070 0.381 4.504 1.00 0.00 C ATOM 1635 C ARG B 174 -17.420 -0.572 3.365 1.00 0.00 C ATOM 1636 O ARG B 174 -17.140 -0.292 2.200 1.00 0.00 O ATOM 1637 CB ARG B 174 -18.290 1.236 4.861 1.00 0.00 C ATOM 1638 CG ARG B 174 -18.760 2.127 3.724 1.00 0.00 C ATOM 1639 CD ARG B 174 -20.280 2.208 3.672 1.00 0.00 C ATOM 1640 NE ARG B 174 -20.760 2.645 2.363 1.00 0.00 N ATOM 1641 CZ ARG B 174 -20.650 1.921 1.252 1.00 0.00 C ATOM 1642 NH1 ARG B 174 -20.070 0.726 1.286 1.00 0.00 N ATOM 1643 NH2 ARG B 174 -21.110 2.393 0.103 1.00 0.00 N ATOM 0 H ARG B 174 -16.156 2.231 4.157 1.00 0.00 H new ATOM 0 HA ARG B 174 -16.780 -0.210 5.373 1.00 0.00 H new ATOM 0 HB2 ARG B 174 -19.108 0.581 5.160 1.00 0.00 H new ATOM 0 HB3 ARG B 174 -18.048 1.858 5.723 1.00 0.00 H new ATOM 0 HG2 ARG B 174 -18.345 3.127 3.848 1.00 0.00 H new ATOM 0 HG3 ARG B 174 -18.382 1.741 2.777 1.00 0.00 H new ATOM 0 HD2 ARG B 174 -20.703 1.231 3.906 1.00 0.00 H new ATOM 0 HD3 ARG B 174 -20.633 2.900 4.437 1.00 0.00 H new ATOM 0 HE ARG B 174 -21.206 3.560 2.297 1.00 0.00 H new ATOM 0 HH11 ARG B 174 -19.707 0.360 2.166 1.00 0.00 H new ATOM 0 HH12 ARG B 174 -19.988 0.174 0.432 1.00 0.00 H new ATOM 0 HH21 ARG B 174 -21.549 3.313 0.069 1.00 0.00 H new ATOM 0 HH22 ARG B 174 -21.025 1.837 -0.748 1.00 0.00 H new ATOM 1657 N GLY B 175 -18.040 -1.698 3.710 1.00 0.00 N ATOM 1658 CA GLY B 175 -18.420 -2.674 2.706 1.00 0.00 C ATOM 1659 C GLY B 175 -19.190 -3.843 3.292 1.00 0.00 C ATOM 1660 O GLY B 175 -19.000 -4.194 4.457 1.00 0.00 O ATOM 0 H GLY B 175 -18.285 -1.951 4.667 1.00 0.00 H new ATOM 0 HA2 GLY B 175 -19.029 -2.188 1.944 1.00 0.00 H new ATOM 0 HA3 GLY B 175 -17.524 -3.046 2.209 1.00 0.00 H new ATOM 1664 N GLY B 176 -20.050 -4.446 2.483 1.00 0.00 N ATOM 1665 CA GLY B 176 -20.840 -5.575 2.946 1.00 0.00 C ATOM 1666 C GLY B 176 -22.200 -5.643 2.287 1.00 0.00 C ATOM 1667 O GLY B 176 -22.940 -6.616 2.548 1.00 0.00 O ATOM 1668 OXT GLY B 176 -22.530 -4.722 1.510 1.00 0.00 O ATOM 0 H GLY B 176 -20.217 -4.175 1.514 1.00 0.00 H new ATOM 0 HA2 GLY B 176 -20.297 -6.499 2.747 1.00 0.00 H new ATOM 0 HA3 GLY B 176 -20.967 -5.506 4.026 1.00 0.00 H new TER 1672 GLY B 176 HETATM 1673 ZN ZN A 32 -5.693 -7.434 0.981 1.00 0.00 ZN