USER MOD reduce.3.24.130724 H: found=0, std=0, add=1183, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1185 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 170 GLN :FLIP amide:sc= -1.72 F(o=-1.3,f=-0.44) USER MOD Set 1.2: A 173 THR OG1 : rot 42:sc= 1.28 USER MOD Set 2.1: A 46 SER OG : rot 180:sc= -0.284 USER MOD Set 2.2: A 143 ASN : amide:sc= 0 X(o=-0.28,f=-0.28) USER MOD Set 3.1: A 34 ASN : amide:sc= -0.0868 X(o=-1.5,f=-1.6) USER MOD Set 3.2: A 35 GLN : amide:sc= -1.38 K(o=-1.5,f=-4!) USER MOD Set 4.1: A 15 SER OG : rot -131:sc= -0.518 USER MOD Set 4.2: A 178 HIS :FLIP no HD1:sc= 0.604 F(o=-1.2,f=0.086) USER MOD Single : A 7 CYS SG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0.0898 USER MOD Single : A 39 CYS SG : rot -22:sc= 0.0834 USER MOD Single : A 40 HIS : no HD1:sc= -0.414 X(o=-0.41,f=-0.69) USER MOD Single : A 43 THR OG1 : rot -170:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -1.87 K(o=-1.9,f=-3.8!) USER MOD Single : A 55 GLN : amide:sc= -0.0169 X(o=-0.017,f=-0.017) USER MOD Single : A 57 HIS : no HD1:sc= -0.374 K(o=-0.37,f=-1.4) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HD1:sc= -0.0226 X(o=-0.023,f=-0.096) USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 HIS : no HD1:sc= -3.26 X(o=-3.3,f=-3.5!) USER MOD Single : A 84 SER OG : rot 180:sc=-0.00732 USER MOD Single : A 86 GLN :FLIP amide:sc= -0.137 F(o=-0.78,f=-0.14) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -1.85 X(o=-1.8,f=-1.5) USER MOD Single : A 99 CYS SG : rot 180:sc= -0.32 USER MOD Single : A 100 GLN : amide:sc= -0.682 K(o=-0.68,f=-2.4) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.0044) USER MOD Single : A 110 GLN : amide:sc= -1.69 K(o=-1.7,f=-2.8) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HD1:sc= -1.13 X(o=-1.1,f=-0.76) USER MOD Single : A 126 GLN : amide:sc= -0.888 K(o=-0.89,f=-2.8!) USER MOD Single : A 133 GLN : amide:sc= -0.292 K(o=-0.29,f=-1.3) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 THR OG1 : rot 180:sc= -0.0026 USER MOD Single : A 144 GLN :FLIP amide:sc= 0.904 F(o=0,f=0.9) USER MOD Single : A 164 SER OG : rot 180:sc=-0.00198 USER MOD Single : A 174 SER OG : rot -140:sc= -0.853 USER MOD Single : A 176 THR OG1 : rot 62:sc= 0.503 USER MOD ----------------------------------------------------------------- ATOM 63 N ARG A 5 3.757 16.647 -6.313 1.00 0.00 N ATOM 64 CA ARG A 5 4.477 16.728 -5.046 1.00 0.00 C ATOM 65 C ARG A 5 5.090 15.377 -4.693 1.00 0.00 C ATOM 66 O ARG A 5 4.452 14.540 -4.050 1.00 0.00 O ATOM 67 CB ARG A 5 3.546 17.194 -3.924 1.00 0.00 C ATOM 68 CG ARG A 5 4.233 17.324 -2.572 1.00 0.00 C ATOM 69 CD ARG A 5 3.264 17.070 -1.427 1.00 0.00 C ATOM 70 NE ARG A 5 3.760 17.604 -0.159 1.00 0.00 N ATOM 71 CZ ARG A 5 3.704 18.894 0.181 1.00 0.00 C ATOM 72 NH1 ARG A 5 3.183 19.791 -0.654 1.00 0.00 N ATOM 73 NH2 ARG A 5 4.172 19.289 1.360 1.00 0.00 N ATOM 0 HA ARG A 5 5.279 17.458 -5.157 1.00 0.00 H new ATOM 0 HB2 ARG A 5 3.116 18.158 -4.197 1.00 0.00 H new ATOM 0 HB3 ARG A 5 2.719 16.490 -3.835 1.00 0.00 H new ATOM 0 HG2 ARG A 5 5.060 16.617 -2.514 1.00 0.00 H new ATOM 0 HG3 ARG A 5 4.660 18.322 -2.474 1.00 0.00 H new ATOM 0 HD2 ARG A 5 2.301 17.525 -1.660 1.00 0.00 H new ATOM 0 HD3 ARG A 5 3.094 15.998 -1.327 1.00 0.00 H new ATOM 0 HE ARG A 5 4.174 16.951 0.506 1.00 0.00 H new ATOM 0 HH11 ARG A 5 2.823 19.495 -1.561 1.00 0.00 H new ATOM 0 HH12 ARG A 5 3.144 20.775 -0.386 1.00 0.00 H new ATOM 0 HH21 ARG A 5 4.573 18.607 2.004 1.00 0.00 H new ATOM 0 HH22 ARG A 5 4.130 20.274 1.621 1.00 0.00 H new ATOM 87 N ASP A 6 6.330 15.171 -5.123 1.00 0.00 N ATOM 88 CA ASP A 6 7.040 13.922 -4.860 1.00 0.00 C ATOM 89 C ASP A 6 7.763 13.976 -3.514 1.00 0.00 C ATOM 90 O ASP A 6 8.390 14.980 -3.174 1.00 0.00 O ATOM 91 CB ASP A 6 8.036 13.622 -5.985 1.00 0.00 C ATOM 92 CG ASP A 6 9.064 14.724 -6.172 1.00 0.00 C ATOM 93 OD1 ASP A 6 8.704 15.782 -6.730 1.00 0.00 O ATOM 94 OD2 ASP A 6 10.225 14.528 -5.757 1.00 0.00 O ATOM 0 H ASP A 6 6.867 15.854 -5.657 1.00 0.00 H new ATOM 0 HA ASP A 6 6.304 13.119 -4.821 1.00 0.00 H new ATOM 0 HB2 ASP A 6 8.550 12.685 -5.769 1.00 0.00 H new ATOM 0 HB3 ASP A 6 7.491 13.478 -6.918 1.00 0.00 H new ATOM 99 N CYS A 7 7.665 12.888 -2.753 1.00 0.00 N ATOM 100 CA CYS A 7 8.302 12.806 -1.442 1.00 0.00 C ATOM 101 C CYS A 7 9.460 11.807 -1.451 1.00 0.00 C ATOM 102 O CYS A 7 9.397 10.775 -2.125 1.00 0.00 O ATOM 103 CB CYS A 7 7.272 12.401 -0.384 1.00 0.00 C ATOM 104 SG CYS A 7 6.548 13.795 0.513 1.00 0.00 S ATOM 0 H CYS A 7 7.150 12.050 -3.023 1.00 0.00 H new ATOM 0 HA CYS A 7 8.704 13.790 -1.199 1.00 0.00 H new ATOM 0 HB2 CYS A 7 6.473 11.839 -0.867 1.00 0.00 H new ATOM 0 HB3 CYS A 7 7.747 11.729 0.331 1.00 0.00 H new ATOM 0 HG CYS A 7 5.689 13.352 1.382 1.00 0.00 H new ATOM 110 N PRO A 8 10.538 12.101 -0.695 1.00 0.00 N ATOM 111 CA PRO A 8 11.716 11.226 -0.610 1.00 0.00 C ATOM 112 C PRO A 8 11.435 9.944 0.172 1.00 0.00 C ATOM 113 O PRO A 8 10.858 9.985 1.261 1.00 0.00 O ATOM 114 CB PRO A 8 12.745 12.086 0.128 1.00 0.00 C ATOM 115 CG PRO A 8 11.930 13.032 0.941 1.00 0.00 C ATOM 116 CD PRO A 8 10.690 13.311 0.139 1.00 0.00 C ATOM 0 HA PRO A 8 12.045 10.892 -1.594 1.00 0.00 H new ATOM 0 HB2 PRO A 8 13.392 11.476 0.759 1.00 0.00 H new ATOM 0 HB3 PRO A 8 13.391 12.618 -0.570 1.00 0.00 H new ATOM 0 HG2 PRO A 8 11.679 12.597 1.908 1.00 0.00 H new ATOM 0 HG3 PRO A 8 12.481 13.951 1.138 1.00 0.00 H new ATOM 0 HD2 PRO A 8 9.823 13.467 0.781 1.00 0.00 H new ATOM 0 HD3 PRO A 8 10.800 14.208 -0.471 1.00 0.00 H new ATOM 124 N LEU A 9 11.846 8.807 -0.388 1.00 0.00 N ATOM 125 CA LEU A 9 11.640 7.513 0.257 1.00 0.00 C ATOM 126 C LEU A 9 12.976 6.865 0.615 1.00 0.00 C ATOM 127 O LEU A 9 13.738 6.466 -0.268 1.00 0.00 O ATOM 128 CB LEU A 9 10.828 6.587 -0.653 1.00 0.00 C ATOM 129 CG LEU A 9 9.442 6.213 -0.124 1.00 0.00 C ATOM 130 CD1 LEU A 9 8.387 7.171 -0.665 1.00 0.00 C ATOM 131 CD2 LEU A 9 9.101 4.774 -0.488 1.00 0.00 C ATOM 0 H LEU A 9 12.324 8.757 -1.288 1.00 0.00 H new ATOM 0 HA LEU A 9 11.082 7.677 1.179 1.00 0.00 H new ATOM 0 HB2 LEU A 9 10.712 7.067 -1.625 1.00 0.00 H new ATOM 0 HB3 LEU A 9 11.397 5.672 -0.816 1.00 0.00 H new ATOM 0 HG LEU A 9 9.454 6.296 0.963 1.00 0.00 H new ATOM 0 HD11 LEU A 9 7.408 6.890 -0.278 1.00 0.00 H new ATOM 0 HD12 LEU A 9 8.623 8.188 -0.350 1.00 0.00 H new ATOM 0 HD13 LEU A 9 8.375 7.122 -1.754 1.00 0.00 H new ATOM 0 HD21 LEU A 9 8.112 4.526 -0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 9 9.107 4.662 -1.572 1.00 0.00 H new ATOM 0 HD23 LEU A 9 9.839 4.103 -0.049 1.00 0.00 H new ATOM 143 N PHE A 10 13.249 6.767 1.918 1.00 0.00 N ATOM 144 CA PHE A 10 14.490 6.169 2.413 1.00 0.00 C ATOM 145 C PHE A 10 15.715 6.864 1.817 1.00 0.00 C ATOM 146 O PHE A 10 16.591 6.216 1.238 1.00 0.00 O ATOM 147 CB PHE A 10 14.526 4.668 2.104 1.00 0.00 C ATOM 148 CG PHE A 10 13.804 3.824 3.116 1.00 0.00 C ATOM 149 CD1 PHE A 10 12.437 3.960 3.304 1.00 0.00 C ATOM 150 CD2 PHE A 10 14.493 2.895 3.880 1.00 0.00 C ATOM 151 CE1 PHE A 10 11.771 3.186 4.234 1.00 0.00 C ATOM 152 CE2 PHE A 10 13.831 2.118 4.812 1.00 0.00 C ATOM 153 CZ PHE A 10 12.469 2.264 4.990 1.00 0.00 C ATOM 0 H PHE A 10 12.623 7.096 2.653 1.00 0.00 H new ATOM 0 HA PHE A 10 14.517 6.304 3.494 1.00 0.00 H new ATOM 0 HB2 PHE A 10 14.085 4.498 1.122 1.00 0.00 H new ATOM 0 HB3 PHE A 10 15.565 4.343 2.048 1.00 0.00 H new ATOM 0 HD1 PHE A 10 11.887 4.680 2.716 1.00 0.00 H new ATOM 0 HD2 PHE A 10 15.558 2.777 3.746 1.00 0.00 H new ATOM 0 HE1 PHE A 10 10.706 3.301 4.370 1.00 0.00 H new ATOM 0 HE2 PHE A 10 14.378 1.397 5.401 1.00 0.00 H new ATOM 0 HZ PHE A 10 11.951 1.659 5.719 1.00 0.00 H new ATOM 163 N GLY A 11 15.771 8.186 1.964 1.00 0.00 N ATOM 164 CA GLY A 11 16.895 8.948 1.442 1.00 0.00 C ATOM 165 C GLY A 11 16.652 9.516 0.050 1.00 0.00 C ATOM 166 O GLY A 11 17.374 10.415 -0.384 1.00 0.00 O ATOM 0 H GLY A 11 15.058 8.743 2.435 1.00 0.00 H new ATOM 0 HA2 GLY A 11 17.117 9.767 2.126 1.00 0.00 H new ATOM 0 HA3 GLY A 11 17.776 8.307 1.415 1.00 0.00 H new ATOM 170 N GLY A 12 15.641 9.000 -0.651 1.00 0.00 N ATOM 171 CA GLY A 12 15.336 9.482 -1.990 1.00 0.00 C ATOM 172 C GLY A 12 15.468 8.408 -3.059 1.00 0.00 C ATOM 173 O GLY A 12 15.742 8.717 -4.219 1.00 0.00 O ATOM 0 H GLY A 12 15.028 8.257 -0.315 1.00 0.00 H new ATOM 0 HA2 GLY A 12 14.320 9.877 -2.004 1.00 0.00 H new ATOM 0 HA3 GLY A 12 16.003 10.310 -2.232 1.00 0.00 H new ATOM 177 N ALA A 13 15.260 7.144 -2.677 1.00 0.00 N ATOM 178 CA ALA A 13 15.346 6.032 -3.625 1.00 0.00 C ATOM 179 C ALA A 13 14.051 5.907 -4.426 1.00 0.00 C ATOM 180 O ALA A 13 14.064 5.508 -5.592 1.00 0.00 O ATOM 181 CB ALA A 13 15.650 4.728 -2.896 1.00 0.00 C ATOM 0 H ALA A 13 15.032 6.867 -1.722 1.00 0.00 H new ATOM 0 HA ALA A 13 16.161 6.237 -4.319 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.710 3.913 -3.618 1.00 0.00 H new ATOM 0 HB2 ALA A 13 16.601 4.818 -2.370 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.857 4.519 -2.178 1.00 0.00 H new ATOM 187 N PHE A 14 12.934 6.264 -3.788 1.00 0.00 N ATOM 188 CA PHE A 14 11.624 6.210 -4.428 1.00 0.00 C ATOM 189 C PHE A 14 10.926 7.564 -4.330 1.00 0.00 C ATOM 190 O PHE A 14 11.245 8.374 -3.455 1.00 0.00 O ATOM 191 CB PHE A 14 10.758 5.131 -3.779 1.00 0.00 C ATOM 192 CG PHE A 14 11.079 3.736 -4.236 1.00 0.00 C ATOM 193 CD1 PHE A 14 10.835 3.347 -5.544 1.00 0.00 C ATOM 194 CD2 PHE A 14 11.622 2.813 -3.357 1.00 0.00 C ATOM 195 CE1 PHE A 14 11.128 2.065 -5.965 1.00 0.00 C ATOM 196 CE2 PHE A 14 11.915 1.529 -3.772 1.00 0.00 C ATOM 197 CZ PHE A 14 11.667 1.153 -5.078 1.00 0.00 C ATOM 0 H PHE A 14 12.914 6.595 -2.823 1.00 0.00 H new ATOM 0 HA PHE A 14 11.767 5.963 -5.480 1.00 0.00 H new ATOM 0 HB2 PHE A 14 10.878 5.185 -2.697 1.00 0.00 H new ATOM 0 HB3 PHE A 14 9.710 5.341 -3.995 1.00 0.00 H new ATOM 0 HD1 PHE A 14 10.411 4.054 -6.241 1.00 0.00 H new ATOM 0 HD2 PHE A 14 11.818 3.101 -2.335 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.936 1.775 -6.987 1.00 0.00 H new ATOM 0 HE2 PHE A 14 12.338 0.819 -3.076 1.00 0.00 H new ATOM 0 HZ PHE A 14 11.894 0.149 -5.405 1.00 0.00 H new ATOM 207 N SER A 15 9.968 7.799 -5.223 1.00 0.00 N ATOM 208 CA SER A 15 9.220 9.051 -5.235 1.00 0.00 C ATOM 209 C SER A 15 7.744 8.790 -4.971 1.00 0.00 C ATOM 210 O SER A 15 7.075 8.115 -5.756 1.00 0.00 O ATOM 211 CB SER A 15 9.397 9.773 -6.572 1.00 0.00 C ATOM 212 OG SER A 15 8.954 8.969 -7.657 1.00 0.00 O ATOM 0 H SER A 15 9.692 7.137 -5.948 1.00 0.00 H new ATOM 0 HA SER A 15 9.611 9.690 -4.443 1.00 0.00 H new ATOM 0 HB2 SER A 15 8.839 10.709 -6.559 1.00 0.00 H new ATOM 0 HB3 SER A 15 10.447 10.030 -6.712 1.00 0.00 H new ATOM 0 HG SER A 15 9.640 8.957 -8.357 1.00 0.00 H new ATOM 218 N ALA A 16 7.241 9.322 -3.858 1.00 0.00 N ATOM 219 CA ALA A 16 5.844 9.132 -3.485 1.00 0.00 C ATOM 220 C ALA A 16 5.005 10.369 -3.779 1.00 0.00 C ATOM 221 O ALA A 16 5.415 11.499 -3.511 1.00 0.00 O ATOM 222 CB ALA A 16 5.738 8.755 -2.015 1.00 0.00 C ATOM 0 H ALA A 16 7.780 9.886 -3.201 1.00 0.00 H new ATOM 0 HA ALA A 16 5.448 8.318 -4.092 1.00 0.00 H new ATOM 0 HB1 ALA A 16 4.690 8.616 -1.750 1.00 0.00 H new ATOM 0 HB2 ALA A 16 6.283 7.828 -1.837 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.165 9.550 -1.404 1.00 0.00 H new ATOM 228 N ILE A 17 3.819 10.135 -4.333 1.00 0.00 N ATOM 229 CA ILE A 17 2.895 11.211 -4.676 1.00 0.00 C ATOM 230 C ILE A 17 1.953 11.508 -3.512 1.00 0.00 C ATOM 231 O ILE A 17 1.329 10.600 -2.960 1.00 0.00 O ATOM 232 CB ILE A 17 2.064 10.851 -5.923 1.00 0.00 C ATOM 233 CG1 ILE A 17 2.969 10.312 -7.040 1.00 0.00 C ATOM 234 CG2 ILE A 17 1.274 12.056 -6.411 1.00 0.00 C ATOM 235 CD1 ILE A 17 3.969 11.326 -7.557 1.00 0.00 C ATOM 0 H ILE A 17 3.473 9.202 -4.555 1.00 0.00 H new ATOM 0 HA ILE A 17 3.492 12.097 -4.891 1.00 0.00 H new ATOM 0 HB ILE A 17 1.357 10.069 -5.646 1.00 0.00 H new ATOM 0 HG12 ILE A 17 3.508 9.440 -6.670 1.00 0.00 H new ATOM 0 HG13 ILE A 17 2.346 9.974 -7.868 1.00 0.00 H new ATOM 0 HG21 ILE A 17 0.695 11.779 -7.292 1.00 0.00 H new ATOM 0 HG22 ILE A 17 0.599 12.392 -5.624 1.00 0.00 H new ATOM 0 HG23 ILE A 17 1.961 12.862 -6.668 1.00 0.00 H new ATOM 0 HD11 ILE A 17 4.573 10.873 -8.344 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.438 12.189 -7.959 1.00 0.00 H new ATOM 0 HD13 ILE A 17 4.617 11.646 -6.741 1.00 0.00 H new ATOM 247 N LEU A 18 1.856 12.784 -3.145 1.00 0.00 N ATOM 248 CA LEU A 18 0.992 13.209 -2.044 1.00 0.00 C ATOM 249 C LEU A 18 0.167 14.436 -2.435 1.00 0.00 C ATOM 250 O LEU A 18 0.713 15.524 -2.626 1.00 0.00 O ATOM 251 CB LEU A 18 1.827 13.520 -0.796 1.00 0.00 C ATOM 252 CG LEU A 18 2.142 12.319 0.104 1.00 0.00 C ATOM 253 CD1 LEU A 18 0.872 11.553 0.445 1.00 0.00 C ATOM 254 CD2 LEU A 18 3.160 11.402 -0.561 1.00 0.00 C ATOM 0 H LEU A 18 2.366 13.544 -3.595 1.00 0.00 H new ATOM 0 HA LEU A 18 0.309 12.390 -1.821 1.00 0.00 H new ATOM 0 HB2 LEU A 18 2.767 13.971 -1.113 1.00 0.00 H new ATOM 0 HB3 LEU A 18 1.299 14.267 -0.204 1.00 0.00 H new ATOM 0 HG LEU A 18 2.573 12.693 1.032 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.119 10.705 1.084 1.00 0.00 H new ATOM 0 HD12 LEU A 18 0.179 12.212 0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.407 11.192 -0.473 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.370 10.556 0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.759 11.038 -1.507 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.081 11.955 -0.746 1.00 0.00 H new ATOM 266 N PRO A 19 -1.169 14.277 -2.558 1.00 0.00 N ATOM 267 CA PRO A 19 -2.069 15.378 -2.927 1.00 0.00 C ATOM 268 C PRO A 19 -2.292 16.365 -1.780 1.00 0.00 C ATOM 269 O PRO A 19 -1.793 16.165 -0.670 1.00 0.00 O ATOM 270 CB PRO A 19 -3.375 14.657 -3.270 1.00 0.00 C ATOM 271 CG PRO A 19 -3.348 13.417 -2.443 1.00 0.00 C ATOM 272 CD PRO A 19 -1.903 13.012 -2.346 1.00 0.00 C ATOM 0 HA PRO A 19 -1.664 15.980 -3.741 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -4.242 15.273 -3.032 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.432 14.423 -4.333 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.769 13.599 -1.454 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -3.944 12.629 -2.903 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -1.674 12.574 -1.374 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.644 12.268 -3.099 1.00 0.00 H new ATOM 280 N MET A 20 -3.052 17.427 -2.054 1.00 0.00 N ATOM 281 CA MET A 20 -3.345 18.439 -1.040 1.00 0.00 C ATOM 282 C MET A 20 -4.345 17.903 -0.012 1.00 0.00 C ATOM 283 O MET A 20 -5.557 17.931 -0.232 1.00 0.00 O ATOM 284 CB MET A 20 -3.874 19.732 -1.684 1.00 0.00 C ATOM 285 CG MET A 20 -5.171 19.569 -2.469 1.00 0.00 C ATOM 286 SD MET A 20 -5.364 20.822 -3.753 1.00 0.00 S ATOM 287 CE MET A 20 -6.963 21.513 -3.331 1.00 0.00 C ATOM 0 H MET A 20 -3.473 17.607 -2.965 1.00 0.00 H new ATOM 0 HA MET A 20 -2.414 18.675 -0.525 1.00 0.00 H new ATOM 0 HB2 MET A 20 -4.030 20.474 -0.901 1.00 0.00 H new ATOM 0 HB3 MET A 20 -3.109 20.129 -2.351 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.194 18.579 -2.925 1.00 0.00 H new ATOM 0 HG3 MET A 20 -6.016 19.623 -1.783 1.00 0.00 H new ATOM 0 HE1 MET A 20 -7.217 22.302 -4.039 1.00 0.00 H new ATOM 0 HE2 MET A 20 -7.720 20.730 -3.373 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.926 21.928 -2.324 1.00 0.00 H new ATOM 297 N GLY A 21 -3.822 17.407 1.110 1.00 0.00 N ATOM 298 CA GLY A 21 -4.676 16.864 2.154 1.00 0.00 C ATOM 299 C GLY A 21 -3.960 15.854 3.033 1.00 0.00 C ATOM 300 O GLY A 21 -4.199 15.797 4.240 1.00 0.00 O ATOM 0 H GLY A 21 -2.823 17.372 1.313 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -5.048 17.680 2.774 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.545 16.390 1.697 1.00 0.00 H new ATOM 304 N ALA A 22 -3.086 15.053 2.426 1.00 0.00 N ATOM 305 CA ALA A 22 -2.333 14.033 3.157 1.00 0.00 C ATOM 306 C ALA A 22 -1.442 14.656 4.231 1.00 0.00 C ATOM 307 O ALA A 22 -0.605 15.512 3.938 1.00 0.00 O ATOM 308 CB ALA A 22 -1.501 13.198 2.192 1.00 0.00 C ATOM 0 H ALA A 22 -2.881 15.090 1.428 1.00 0.00 H new ATOM 0 HA ALA A 22 -3.050 13.384 3.659 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -0.946 12.443 2.749 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -2.159 12.708 1.474 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -0.802 13.844 1.661 1.00 0.00 H new ATOM 314 N ILE A 23 -1.632 14.218 5.476 1.00 0.00 N ATOM 315 CA ILE A 23 -0.853 14.728 6.600 1.00 0.00 C ATOM 316 C ILE A 23 -0.188 13.587 7.374 1.00 0.00 C ATOM 317 O ILE A 23 -0.833 12.586 7.699 1.00 0.00 O ATOM 318 CB ILE A 23 -1.736 15.575 7.549 1.00 0.00 C ATOM 319 CG1 ILE A 23 -0.870 16.408 8.506 1.00 0.00 C ATOM 320 CG2 ILE A 23 -2.714 14.697 8.323 1.00 0.00 C ATOM 321 CD1 ILE A 23 -0.255 15.616 9.643 1.00 0.00 C ATOM 0 H ILE A 23 -2.321 13.510 5.730 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.070 15.368 6.193 1.00 0.00 H new ATOM 0 HB ILE A 23 -2.319 16.262 6.936 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -0.071 16.881 7.935 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -1.480 17.209 8.925 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.320 15.320 8.981 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.363 14.170 7.623 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -2.159 13.972 8.919 1.00 0.00 H new ATOM 0 HD11 ILE A 23 0.340 16.281 10.270 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -1.046 15.165 10.242 1.00 0.00 H new ATOM 0 HD13 ILE A 23 0.384 14.832 9.236 1.00 0.00 H new ATOM 333 N ASP A 24 1.106 13.744 7.657 1.00 0.00 N ATOM 334 CA ASP A 24 1.869 12.729 8.384 1.00 0.00 C ATOM 335 C ASP A 24 1.348 12.561 9.809 1.00 0.00 C ATOM 336 O ASP A 24 1.677 13.350 10.698 1.00 0.00 O ATOM 337 CB ASP A 24 3.356 13.095 8.410 1.00 0.00 C ATOM 338 CG ASP A 24 4.143 12.413 7.305 1.00 0.00 C ATOM 339 OD1 ASP A 24 3.800 12.614 6.122 1.00 0.00 O ATOM 340 OD2 ASP A 24 5.101 11.681 7.625 1.00 0.00 O ATOM 0 H ASP A 24 1.648 14.566 7.393 1.00 0.00 H new ATOM 0 HA ASP A 24 1.744 11.781 7.861 1.00 0.00 H new ATOM 0 HB2 ASP A 24 3.462 14.175 8.314 1.00 0.00 H new ATOM 0 HB3 ASP A 24 3.778 12.818 9.376 1.00 0.00 H new ATOM 345 N VAL A 25 0.537 11.524 10.022 1.00 0.00 N ATOM 346 CA VAL A 25 -0.027 11.251 11.342 1.00 0.00 C ATOM 347 C VAL A 25 0.999 10.590 12.279 1.00 0.00 C ATOM 348 O VAL A 25 0.696 10.317 13.439 1.00 0.00 O ATOM 349 CB VAL A 25 -1.293 10.369 11.242 1.00 0.00 C ATOM 350 CG1 VAL A 25 -0.957 8.978 10.723 1.00 0.00 C ATOM 351 CG2 VAL A 25 -1.998 10.290 12.590 1.00 0.00 C ATOM 0 H VAL A 25 0.257 10.862 9.299 1.00 0.00 H new ATOM 0 HA VAL A 25 -0.304 12.215 11.768 1.00 0.00 H new ATOM 0 HB VAL A 25 -1.971 10.834 10.526 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.868 8.382 10.664 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -0.510 9.058 9.732 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -0.252 8.497 11.401 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.887 9.665 12.500 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -1.323 9.857 13.329 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -2.289 11.291 12.907 1.00 0.00 H new ATOM 361 N SER A 26 2.217 10.349 11.777 1.00 0.00 N ATOM 362 CA SER A 26 3.280 9.740 12.580 1.00 0.00 C ATOM 363 C SER A 26 3.549 10.556 13.846 1.00 0.00 C ATOM 364 O SER A 26 3.861 10.000 14.900 1.00 0.00 O ATOM 365 CB SER A 26 4.570 9.614 11.765 1.00 0.00 C ATOM 366 OG SER A 26 4.627 10.592 10.740 1.00 0.00 O ATOM 0 H SER A 26 2.489 10.567 10.818 1.00 0.00 H new ATOM 0 HA SER A 26 2.944 8.745 12.871 1.00 0.00 H new ATOM 0 HB2 SER A 26 5.431 9.723 12.424 1.00 0.00 H new ATOM 0 HB3 SER A 26 4.629 8.619 11.325 1.00 0.00 H new ATOM 0 HG SER A 26 5.461 10.490 10.236 1.00 0.00 H new ATOM 372 N ASP A 27 3.418 11.881 13.732 1.00 0.00 N ATOM 373 CA ASP A 27 3.635 12.778 14.867 1.00 0.00 C ATOM 374 C ASP A 27 2.571 12.563 15.945 1.00 0.00 C ATOM 375 O ASP A 27 2.821 12.792 17.129 1.00 0.00 O ATOM 376 CB ASP A 27 3.626 14.240 14.405 1.00 0.00 C ATOM 377 CG ASP A 27 5.024 14.806 14.219 1.00 0.00 C ATOM 378 OD1 ASP A 27 5.901 14.076 13.708 1.00 0.00 O ATOM 379 OD2 ASP A 27 5.241 15.981 14.582 1.00 0.00 O ATOM 0 H ASP A 27 3.163 12.354 12.865 1.00 0.00 H new ATOM 0 HA ASP A 27 4.611 12.549 15.295 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.080 14.316 13.465 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.088 14.844 15.136 1.00 0.00 H new ATOM 384 N LEU A 28 1.385 12.124 15.524 1.00 0.00 N ATOM 385 CA LEU A 28 0.280 11.874 16.443 1.00 0.00 C ATOM 386 C LEU A 28 0.256 10.411 16.910 1.00 0.00 C ATOM 387 O LEU A 28 -0.208 10.116 18.013 1.00 0.00 O ATOM 388 CB LEU A 28 -1.049 12.236 15.771 1.00 0.00 C ATOM 389 CG LEU A 28 -2.029 13.027 16.642 1.00 0.00 C ATOM 390 CD1 LEU A 28 -1.667 14.507 16.654 1.00 0.00 C ATOM 391 CD2 LEU A 28 -3.455 12.830 16.148 1.00 0.00 C ATOM 0 H LEU A 28 1.166 11.934 14.546 1.00 0.00 H new ATOM 0 HA LEU A 28 0.424 12.501 17.323 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.837 12.816 14.873 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.536 11.316 15.448 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.961 12.652 17.663 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.376 15.050 17.279 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.661 14.632 17.054 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -1.705 14.899 15.638 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.140 13.398 16.777 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -3.535 13.178 15.118 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.713 11.772 16.194 1.00 0.00 H new ATOM 403 N ARG A 29 0.749 9.499 16.064 1.00 0.00 N ATOM 404 CA ARG A 29 0.773 8.072 16.393 1.00 0.00 C ATOM 405 C ARG A 29 2.083 7.419 15.931 1.00 0.00 C ATOM 406 O ARG A 29 2.515 7.628 14.798 1.00 0.00 O ATOM 407 CB ARG A 29 -0.421 7.367 15.742 1.00 0.00 C ATOM 408 CG ARG A 29 -1.048 6.289 16.610 1.00 0.00 C ATOM 409 CD ARG A 29 -2.058 6.878 17.584 1.00 0.00 C ATOM 410 NE ARG A 29 -2.367 5.961 18.680 1.00 0.00 N ATOM 411 CZ ARG A 29 -2.948 6.334 19.823 1.00 0.00 C ATOM 412 NH1 ARG A 29 -3.289 7.605 20.028 1.00 0.00 N ATOM 413 NH2 ARG A 29 -3.190 5.432 20.766 1.00 0.00 N ATOM 0 H ARG A 29 1.136 9.725 15.148 1.00 0.00 H new ATOM 0 HA ARG A 29 0.707 7.971 17.476 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -1.180 8.110 15.498 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -0.098 6.920 14.802 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.539 5.550 15.977 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -0.268 5.766 17.164 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.666 7.810 17.992 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -2.975 7.125 17.049 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.124 4.977 18.565 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -3.107 8.304 19.308 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -3.732 7.879 20.905 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -2.932 4.456 20.617 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -3.634 5.714 21.640 1.00 0.00 H new ATOM 427 N PRO A 30 2.735 6.621 16.808 1.00 0.00 N ATOM 428 CA PRO A 30 4.005 5.938 16.488 1.00 0.00 C ATOM 429 C PRO A 30 3.912 5.062 15.232 1.00 0.00 C ATOM 430 O PRO A 30 2.910 4.379 15.019 1.00 0.00 O ATOM 431 CB PRO A 30 4.264 5.067 17.723 1.00 0.00 C ATOM 432 CG PRO A 30 3.502 5.721 18.824 1.00 0.00 C ATOM 433 CD PRO A 30 2.286 6.326 18.185 1.00 0.00 C ATOM 0 HA PRO A 30 4.799 6.653 16.273 1.00 0.00 H new ATOM 0 HB2 PRO A 30 3.925 4.044 17.562 1.00 0.00 H new ATOM 0 HB3 PRO A 30 5.328 5.017 17.955 1.00 0.00 H new ATOM 0 HG2 PRO A 30 3.221 4.996 19.588 1.00 0.00 H new ATOM 0 HG3 PRO A 30 4.105 6.485 19.315 1.00 0.00 H new ATOM 0 HD2 PRO A 30 1.442 5.636 18.194 1.00 0.00 H new ATOM 0 HD3 PRO A 30 1.965 7.229 18.705 1.00 0.00 H new ATOM 441 N VAL A 31 4.962 5.091 14.403 1.00 0.00 N ATOM 442 CA VAL A 31 4.995 4.304 13.164 1.00 0.00 C ATOM 443 C VAL A 31 6.407 3.793 12.864 1.00 0.00 C ATOM 444 O VAL A 31 7.381 4.536 12.998 1.00 0.00 O ATOM 445 CB VAL A 31 4.502 5.135 11.958 1.00 0.00 C ATOM 446 CG1 VAL A 31 4.342 4.260 10.722 1.00 0.00 C ATOM 447 CG2 VAL A 31 3.193 5.840 12.286 1.00 0.00 C ATOM 0 H VAL A 31 5.799 5.650 14.567 1.00 0.00 H new ATOM 0 HA VAL A 31 4.329 3.455 13.316 1.00 0.00 H new ATOM 0 HB VAL A 31 5.256 5.893 11.743 1.00 0.00 H new ATOM 0 HG11 VAL A 31 3.994 4.869 9.888 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.302 3.810 10.468 1.00 0.00 H new ATOM 0 HG13 VAL A 31 3.615 3.473 10.925 1.00 0.00 H new ATOM 0 HG21 VAL A 31 2.865 6.419 11.423 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.433 5.099 12.536 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.342 6.507 13.135 1.00 0.00 H new ATOM 457 N PRO A 32 6.537 2.511 12.446 1.00 0.00 N ATOM 458 CA PRO A 32 7.842 1.905 12.121 1.00 0.00 C ATOM 459 C PRO A 32 8.595 2.672 11.032 1.00 0.00 C ATOM 460 O PRO A 32 8.058 3.603 10.428 1.00 0.00 O ATOM 461 CB PRO A 32 7.476 0.503 11.624 1.00 0.00 C ATOM 462 CG PRO A 32 6.132 0.226 12.198 1.00 0.00 C ATOM 463 CD PRO A 32 5.430 1.555 12.259 1.00 0.00 C ATOM 0 HA PRO A 32 8.509 1.908 12.983 1.00 0.00 H new ATOM 0 HB2 PRO A 32 7.455 0.464 10.535 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.206 -0.236 11.955 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.580 -0.480 11.577 1.00 0.00 H new ATOM 0 HG3 PRO A 32 6.215 -0.218 13.190 1.00 0.00 H new ATOM 0 HD2 PRO A 32 4.872 1.758 11.345 1.00 0.00 H new ATOM 0 HD3 PRO A 32 4.718 1.597 13.083 1.00 0.00 H new ATOM 471 N ASP A 33 9.845 2.270 10.792 1.00 0.00 N ATOM 472 CA ASP A 33 10.690 2.916 9.785 1.00 0.00 C ATOM 473 C ASP A 33 10.339 2.466 8.363 1.00 0.00 C ATOM 474 O ASP A 33 10.535 3.218 7.408 1.00 0.00 O ATOM 475 CB ASP A 33 12.168 2.629 10.066 1.00 0.00 C ATOM 476 CG ASP A 33 12.792 3.659 10.990 1.00 0.00 C ATOM 477 OD1 ASP A 33 12.295 3.817 12.126 1.00 0.00 O ATOM 478 OD2 ASP A 33 13.777 4.306 10.578 1.00 0.00 O ATOM 0 H ASP A 33 10.296 1.498 11.283 1.00 0.00 H new ATOM 0 HA ASP A 33 10.505 3.988 9.851 1.00 0.00 H new ATOM 0 HB2 ASP A 33 12.265 1.639 10.512 1.00 0.00 H new ATOM 0 HB3 ASP A 33 12.717 2.610 9.125 1.00 0.00 H new ATOM 483 N ASN A 34 9.830 1.240 8.223 1.00 0.00 N ATOM 484 CA ASN A 34 9.464 0.709 6.908 1.00 0.00 C ATOM 485 C ASN A 34 7.974 0.903 6.611 1.00 0.00 C ATOM 486 O ASN A 34 7.378 0.125 5.861 1.00 0.00 O ATOM 487 CB ASN A 34 9.840 -0.777 6.803 1.00 0.00 C ATOM 488 CG ASN A 34 9.309 -1.604 7.959 1.00 0.00 C ATOM 489 OD1 ASN A 34 10.055 -1.972 8.865 1.00 0.00 O ATOM 490 ND2 ASN A 34 8.016 -1.902 7.933 1.00 0.00 N ATOM 0 H ASN A 34 9.663 0.600 8.999 1.00 0.00 H new ATOM 0 HA ASN A 34 10.026 1.270 6.161 1.00 0.00 H new ATOM 0 HB2 ASN A 34 9.452 -1.179 5.867 1.00 0.00 H new ATOM 0 HB3 ASN A 34 10.925 -0.870 6.765 1.00 0.00 H new ATOM 0 HD21 ASN A 34 7.605 -2.457 8.684 1.00 0.00 H new ATOM 0 HD22 ASN A 34 7.433 -1.576 7.162 1.00 0.00 H new ATOM 497 N GLN A 35 7.375 1.945 7.191 1.00 0.00 N ATOM 498 CA GLN A 35 5.959 2.232 6.974 1.00 0.00 C ATOM 499 C GLN A 35 5.737 3.718 6.705 1.00 0.00 C ATOM 500 O GLN A 35 6.555 4.558 7.084 1.00 0.00 O ATOM 501 CB GLN A 35 5.124 1.799 8.186 1.00 0.00 C ATOM 502 CG GLN A 35 5.534 0.458 8.779 1.00 0.00 C ATOM 503 CD GLN A 35 4.771 -0.710 8.180 1.00 0.00 C ATOM 504 OE1 GLN A 35 5.221 -1.326 7.215 1.00 0.00 O ATOM 505 NE2 GLN A 35 3.613 -1.020 8.753 1.00 0.00 N ATOM 0 H GLN A 35 7.848 2.601 7.812 1.00 0.00 H new ATOM 0 HA GLN A 35 5.639 1.665 6.100 1.00 0.00 H new ATOM 0 HB2 GLN A 35 5.201 2.564 8.958 1.00 0.00 H new ATOM 0 HB3 GLN A 35 4.076 1.748 7.892 1.00 0.00 H new ATOM 0 HG2 GLN A 35 6.602 0.308 8.621 1.00 0.00 H new ATOM 0 HG3 GLN A 35 5.371 0.478 9.857 1.00 0.00 H new ATOM 0 HE21 GLN A 35 3.279 -0.481 9.552 1.00 0.00 H new ATOM 0 HE22 GLN A 35 3.058 -1.797 8.394 1.00 0.00 H new ATOM 514 N GLU A 36 4.618 4.035 6.053 1.00 0.00 N ATOM 515 CA GLU A 36 4.277 5.422 5.734 1.00 0.00 C ATOM 516 C GLU A 36 2.815 5.713 6.066 1.00 0.00 C ATOM 517 O GLU A 36 1.906 5.169 5.437 1.00 0.00 O ATOM 518 CB GLU A 36 4.539 5.708 4.254 1.00 0.00 C ATOM 519 CG GLU A 36 4.824 7.174 3.956 1.00 0.00 C ATOM 520 CD GLU A 36 6.284 7.552 4.145 1.00 0.00 C ATOM 521 OE1 GLU A 36 6.934 7.002 5.061 1.00 0.00 O ATOM 522 OE2 GLU A 36 6.776 8.408 3.380 1.00 0.00 O ATOM 0 H GLU A 36 3.932 3.350 5.735 1.00 0.00 H new ATOM 0 HA GLU A 36 4.908 6.072 6.340 1.00 0.00 H new ATOM 0 HB2 GLU A 36 5.385 5.107 3.921 1.00 0.00 H new ATOM 0 HB3 GLU A 36 3.674 5.390 3.673 1.00 0.00 H new ATOM 0 HG2 GLU A 36 4.529 7.393 2.930 1.00 0.00 H new ATOM 0 HG3 GLU A 36 4.208 7.796 4.605 1.00 0.00 H new ATOM 529 N VAL A 37 2.592 6.572 7.058 1.00 0.00 N ATOM 530 CA VAL A 37 1.234 6.929 7.468 1.00 0.00 C ATOM 531 C VAL A 37 0.812 8.288 6.910 1.00 0.00 C ATOM 532 O VAL A 37 1.549 9.270 7.009 1.00 0.00 O ATOM 533 CB VAL A 37 1.081 6.943 9.005 1.00 0.00 C ATOM 534 CG1 VAL A 37 1.148 5.530 9.563 1.00 0.00 C ATOM 535 CG2 VAL A 37 2.136 7.833 9.651 1.00 0.00 C ATOM 0 H VAL A 37 3.330 7.032 7.591 1.00 0.00 H new ATOM 0 HA VAL A 37 0.582 6.158 7.056 1.00 0.00 H new ATOM 0 HB VAL A 37 0.102 7.358 9.244 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.038 5.561 10.647 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.345 4.931 9.134 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.109 5.083 9.308 1.00 0.00 H new ATOM 0 HG21 VAL A 37 2.006 7.825 10.733 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.129 7.459 9.402 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.029 8.852 9.280 1.00 0.00 H new ATOM 545 N PHE A 38 -0.384 8.332 6.322 1.00 0.00 N ATOM 546 CA PHE A 38 -0.917 9.562 5.742 1.00 0.00 C ATOM 547 C PHE A 38 -2.421 9.683 5.995 1.00 0.00 C ATOM 548 O PHE A 38 -3.212 8.900 5.470 1.00 0.00 O ATOM 549 CB PHE A 38 -0.638 9.598 4.238 1.00 0.00 C ATOM 550 CG PHE A 38 0.703 10.180 3.889 1.00 0.00 C ATOM 551 CD1 PHE A 38 0.905 11.550 3.918 1.00 0.00 C ATOM 552 CD2 PHE A 38 1.760 9.357 3.532 1.00 0.00 C ATOM 553 CE1 PHE A 38 2.136 12.090 3.598 1.00 0.00 C ATOM 554 CE2 PHE A 38 2.993 9.892 3.211 1.00 0.00 C ATOM 555 CZ PHE A 38 3.181 11.258 3.244 1.00 0.00 C ATOM 0 H PHE A 38 -1.003 7.526 6.235 1.00 0.00 H new ATOM 0 HA PHE A 38 -0.420 10.405 6.222 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -0.699 8.585 3.841 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -1.417 10.181 3.746 1.00 0.00 H new ATOM 0 HD1 PHE A 38 0.091 12.204 4.194 1.00 0.00 H new ATOM 0 HD2 PHE A 38 1.618 8.287 3.504 1.00 0.00 H new ATOM 0 HE1 PHE A 38 2.281 13.160 3.624 1.00 0.00 H new ATOM 0 HE2 PHE A 38 3.809 9.241 2.934 1.00 0.00 H new ATOM 0 HZ PHE A 38 4.144 11.677 2.993 1.00 0.00 H new ATOM 565 N CYS A 39 -2.806 10.674 6.800 1.00 0.00 N ATOM 566 CA CYS A 39 -4.215 10.901 7.122 1.00 0.00 C ATOM 567 C CYS A 39 -4.785 12.057 6.302 1.00 0.00 C ATOM 568 O CYS A 39 -4.038 12.853 5.731 1.00 0.00 O ATOM 569 CB CYS A 39 -4.377 11.192 8.617 1.00 0.00 C ATOM 570 SG CYS A 39 -5.749 10.311 9.398 1.00 0.00 S ATOM 0 H CYS A 39 -2.163 11.332 7.240 1.00 0.00 H new ATOM 0 HA CYS A 39 -4.769 9.996 6.871 1.00 0.00 H new ATOM 0 HB2 CYS A 39 -3.452 10.928 9.130 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -4.523 12.264 8.754 1.00 0.00 H new ATOM 0 HG CYS A 39 -6.611 9.960 8.491 1.00 0.00 H new ATOM 576 N HIS A 40 -6.112 12.140 6.248 1.00 0.00 N ATOM 577 CA HIS A 40 -6.789 13.198 5.500 1.00 0.00 C ATOM 578 C HIS A 40 -7.822 13.906 6.372 1.00 0.00 C ATOM 579 O HIS A 40 -8.932 13.410 6.549 1.00 0.00 O ATOM 580 CB HIS A 40 -7.475 12.621 4.256 1.00 0.00 C ATOM 581 CG HIS A 40 -6.558 11.833 3.372 1.00 0.00 C ATOM 582 ND1 HIS A 40 -6.826 10.544 2.965 1.00 0.00 N ATOM 583 CD2 HIS A 40 -5.368 12.160 2.817 1.00 0.00 C ATOM 584 CE1 HIS A 40 -5.843 10.111 2.199 1.00 0.00 C ATOM 585 NE2 HIS A 40 -4.946 11.073 2.093 1.00 0.00 N ATOM 0 H HIS A 40 -6.741 11.486 6.714 1.00 0.00 H new ATOM 0 HA HIS A 40 -6.036 13.923 5.190 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -8.300 11.982 4.571 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -7.908 13.438 3.679 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -4.848 13.100 2.924 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -5.783 9.136 1.738 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -4.079 11.018 1.559 1.00 0.00 H new ATOM 594 N PRO A 41 -7.471 15.081 6.931 1.00 0.00 N ATOM 595 CA PRO A 41 -8.382 15.853 7.789 1.00 0.00 C ATOM 596 C PRO A 41 -9.617 16.368 7.045 1.00 0.00 C ATOM 597 O PRO A 41 -10.609 16.741 7.669 1.00 0.00 O ATOM 598 CB PRO A 41 -7.521 17.028 8.266 1.00 0.00 C ATOM 599 CG PRO A 41 -6.428 17.144 7.259 1.00 0.00 C ATOM 600 CD PRO A 41 -6.164 15.748 6.773 1.00 0.00 C ATOM 0 HA PRO A 41 -8.781 15.238 8.596 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.105 17.947 8.322 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.120 16.844 9.263 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -6.723 17.795 6.436 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -5.532 17.579 7.703 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -5.831 15.740 5.735 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -5.388 15.257 7.361 1.00 0.00 H new ATOM 608 N VAL A 42 -9.552 16.392 5.712 1.00 0.00 N ATOM 609 CA VAL A 42 -10.668 16.868 4.897 1.00 0.00 C ATOM 610 C VAL A 42 -11.794 15.833 4.844 1.00 0.00 C ATOM 611 O VAL A 42 -12.913 16.100 5.283 1.00 0.00 O ATOM 612 CB VAL A 42 -10.214 17.205 3.459 1.00 0.00 C ATOM 613 CG1 VAL A 42 -11.339 17.868 2.678 1.00 0.00 C ATOM 614 CG2 VAL A 42 -8.977 18.094 3.479 1.00 0.00 C ATOM 0 H VAL A 42 -8.739 16.088 5.176 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.041 17.777 5.370 1.00 0.00 H new ATOM 0 HB VAL A 42 -9.956 16.272 2.958 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.996 18.096 1.669 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.193 17.193 2.627 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.634 18.790 3.178 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -8.674 18.319 2.456 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -9.205 19.022 4.003 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.166 17.577 3.992 1.00 0.00 H new ATOM 624 N THR A 43 -11.488 14.654 4.303 1.00 0.00 N ATOM 625 CA THR A 43 -12.471 13.573 4.186 1.00 0.00 C ATOM 626 C THR A 43 -12.444 12.640 5.404 1.00 0.00 C ATOM 627 O THR A 43 -13.239 11.701 5.483 1.00 0.00 O ATOM 628 CB THR A 43 -12.202 12.758 2.913 1.00 0.00 C ATOM 629 OG1 THR A 43 -11.853 13.607 1.832 1.00 0.00 O ATOM 630 CG2 THR A 43 -13.381 11.913 2.471 1.00 0.00 C ATOM 0 H THR A 43 -10.565 14.421 3.937 1.00 0.00 H new ATOM 0 HA THR A 43 -13.458 14.032 4.135 1.00 0.00 H new ATOM 0 HB THR A 43 -11.380 12.092 3.174 1.00 0.00 H new ATOM 0 HG1 THR A 43 -11.841 13.089 1.000 1.00 0.00 H new ATOM 0 HG21 THR A 43 -13.117 11.366 1.566 1.00 0.00 H new ATOM 0 HG22 THR A 43 -13.639 11.207 3.260 1.00 0.00 H new ATOM 0 HG23 THR A 43 -14.236 12.558 2.269 1.00 0.00 H new ATOM 638 N ASP A 44 -11.526 12.890 6.344 1.00 0.00 N ATOM 639 CA ASP A 44 -11.394 12.062 7.545 1.00 0.00 C ATOM 640 C ASP A 44 -11.009 10.622 7.181 1.00 0.00 C ATOM 641 O ASP A 44 -11.359 9.677 7.890 1.00 0.00 O ATOM 642 CB ASP A 44 -12.699 12.070 8.349 1.00 0.00 C ATOM 643 CG ASP A 44 -13.111 13.468 8.776 1.00 0.00 C ATOM 644 OD1 ASP A 44 -13.567 14.243 7.909 1.00 0.00 O ATOM 645 OD2 ASP A 44 -12.974 13.786 9.974 1.00 0.00 O ATOM 0 H ASP A 44 -10.862 13.662 6.294 1.00 0.00 H new ATOM 0 HA ASP A 44 -10.599 12.486 8.158 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -13.494 11.628 7.749 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -12.581 11.444 9.233 1.00 0.00 H new ATOM 650 N GLN A 45 -10.284 10.465 6.070 1.00 0.00 N ATOM 651 CA GLN A 45 -9.852 9.146 5.609 1.00 0.00 C ATOM 652 C GLN A 45 -8.461 8.803 6.148 1.00 0.00 C ATOM 653 O GLN A 45 -7.707 9.690 6.553 1.00 0.00 O ATOM 654 CB GLN A 45 -9.847 9.096 4.078 1.00 0.00 C ATOM 655 CG GLN A 45 -11.155 8.608 3.475 1.00 0.00 C ATOM 656 CD GLN A 45 -10.943 7.817 2.197 1.00 0.00 C ATOM 657 OE1 GLN A 45 -10.080 6.943 2.134 1.00 0.00 O ATOM 658 NE2 GLN A 45 -11.730 8.119 1.169 1.00 0.00 N ATOM 0 H GLN A 45 -9.985 11.237 5.474 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.558 8.407 5.989 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -9.629 10.092 3.692 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -9.039 8.443 3.748 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -11.677 7.986 4.202 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -11.798 9.463 3.267 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -12.434 8.851 1.263 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -11.630 7.618 0.286 1.00 0.00 H new ATOM 667 N SER A 46 -8.128 7.510 6.149 1.00 0.00 N ATOM 668 CA SER A 46 -6.830 7.049 6.639 1.00 0.00 C ATOM 669 C SER A 46 -6.103 6.221 5.578 1.00 0.00 C ATOM 670 O SER A 46 -6.696 5.342 4.950 1.00 0.00 O ATOM 671 CB SER A 46 -7.013 6.221 7.916 1.00 0.00 C ATOM 672 OG SER A 46 -5.785 5.655 8.346 1.00 0.00 O ATOM 0 H SER A 46 -8.740 6.765 5.816 1.00 0.00 H new ATOM 0 HA SER A 46 -6.222 7.925 6.863 1.00 0.00 H new ATOM 0 HB2 SER A 46 -7.421 6.852 8.706 1.00 0.00 H new ATOM 0 HB3 SER A 46 -7.738 5.427 7.736 1.00 0.00 H new ATOM 0 HG SER A 46 -5.933 5.134 9.163 1.00 0.00 H new ATOM 678 N LEU A 47 -4.814 6.511 5.388 1.00 0.00 N ATOM 679 CA LEU A 47 -3.993 5.801 4.407 1.00 0.00 C ATOM 680 C LEU A 47 -2.629 5.438 5.000 1.00 0.00 C ATOM 681 O LEU A 47 -1.992 6.265 5.656 1.00 0.00 O ATOM 682 CB LEU A 47 -3.811 6.663 3.153 1.00 0.00 C ATOM 683 CG LEU A 47 -2.850 6.102 2.101 1.00 0.00 C ATOM 684 CD1 LEU A 47 -3.358 4.774 1.553 1.00 0.00 C ATOM 685 CD2 LEU A 47 -2.658 7.107 0.977 1.00 0.00 C ATOM 0 H LEU A 47 -4.315 7.236 5.904 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.504 4.878 4.134 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -4.786 6.808 2.688 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -3.454 7.647 3.458 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.886 5.922 2.577 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -2.658 4.396 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.445 4.054 2.367 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.335 4.920 1.092 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -1.973 6.697 0.235 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.619 7.315 0.507 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.244 8.031 1.382 1.00 0.00 H new ATOM 697 N ILE A 48 -2.185 4.199 4.766 1.00 0.00 N ATOM 698 CA ILE A 48 -0.896 3.731 5.284 1.00 0.00 C ATOM 699 C ILE A 48 -0.185 2.816 4.281 1.00 0.00 C ATOM 700 O ILE A 48 -0.788 1.889 3.735 1.00 0.00 O ATOM 701 CB ILE A 48 -1.067 2.966 6.618 1.00 0.00 C ATOM 702 CG1 ILE A 48 -1.910 3.778 7.608 1.00 0.00 C ATOM 703 CG2 ILE A 48 0.292 2.631 7.224 1.00 0.00 C ATOM 704 CD1 ILE A 48 -3.400 3.539 7.473 1.00 0.00 C ATOM 0 H ILE A 48 -2.698 3.504 4.223 1.00 0.00 H new ATOM 0 HA ILE A 48 -0.290 4.621 5.452 1.00 0.00 H new ATOM 0 HB ILE A 48 -1.591 2.033 6.408 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -1.601 3.531 8.624 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -1.706 4.839 7.462 1.00 0.00 H new ATOM 0 HG21 ILE A 48 0.150 2.093 8.161 1.00 0.00 H new ATOM 0 HG22 ILE A 48 0.856 2.008 6.530 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.843 3.552 7.414 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -3.934 4.146 8.204 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.723 3.813 6.469 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -3.617 2.485 7.649 1.00 0.00 H new ATOM 716 N VAL A 49 1.104 3.079 4.058 1.00 0.00 N ATOM 717 CA VAL A 49 1.913 2.281 3.134 1.00 0.00 C ATOM 718 C VAL A 49 2.764 1.267 3.908 1.00 0.00 C ATOM 719 O VAL A 49 3.326 1.589 4.958 1.00 0.00 O ATOM 720 CB VAL A 49 2.830 3.178 2.267 1.00 0.00 C ATOM 721 CG1 VAL A 49 3.490 2.371 1.157 1.00 0.00 C ATOM 722 CG2 VAL A 49 2.043 4.346 1.684 1.00 0.00 C ATOM 0 H VAL A 49 1.612 3.841 4.506 1.00 0.00 H new ATOM 0 HA VAL A 49 1.229 1.749 2.472 1.00 0.00 H new ATOM 0 HB VAL A 49 3.616 3.577 2.909 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.129 3.024 0.563 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.092 1.575 1.595 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.722 1.935 0.518 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.705 4.964 1.078 1.00 0.00 H new ATOM 0 HG22 VAL A 49 1.233 3.965 1.062 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.627 4.945 2.494 1.00 0.00 H new ATOM 732 N GLU A 50 2.850 0.040 3.389 1.00 0.00 N ATOM 733 CA GLU A 50 3.620 -1.018 4.040 1.00 0.00 C ATOM 734 C GLU A 50 4.771 -1.491 3.157 1.00 0.00 C ATOM 735 O GLU A 50 4.651 -1.542 1.931 1.00 0.00 O ATOM 736 CB GLU A 50 2.712 -2.208 4.373 1.00 0.00 C ATOM 737 CG GLU A 50 2.451 -2.391 5.860 1.00 0.00 C ATOM 738 CD GLU A 50 1.351 -1.483 6.381 1.00 0.00 C ATOM 739 OE1 GLU A 50 1.559 -0.254 6.409 1.00 0.00 O ATOM 740 OE2 GLU A 50 0.285 -2.003 6.765 1.00 0.00 O ATOM 0 H GLU A 50 2.396 -0.244 2.521 1.00 0.00 H new ATOM 0 HA GLU A 50 4.035 -0.605 4.959 1.00 0.00 H new ATOM 0 HB2 GLU A 50 1.759 -2.079 3.861 1.00 0.00 H new ATOM 0 HB3 GLU A 50 3.165 -3.118 3.979 1.00 0.00 H new ATOM 0 HG2 GLU A 50 2.180 -3.429 6.051 1.00 0.00 H new ATOM 0 HG3 GLU A 50 3.370 -2.195 6.412 1.00 0.00 H new ATOM 747 N LEU A 51 5.885 -1.853 3.791 1.00 0.00 N ATOM 748 CA LEU A 51 7.058 -2.339 3.072 1.00 0.00 C ATOM 749 C LEU A 51 7.704 -3.504 3.820 1.00 0.00 C ATOM 750 O LEU A 51 8.167 -3.347 4.950 1.00 0.00 O ATOM 751 CB LEU A 51 8.070 -1.211 2.872 1.00 0.00 C ATOM 752 CG LEU A 51 9.365 -1.615 2.157 1.00 0.00 C ATOM 753 CD1 LEU A 51 9.104 -1.871 0.680 1.00 0.00 C ATOM 754 CD2 LEU A 51 10.429 -0.541 2.332 1.00 0.00 C ATOM 0 H LEU A 51 5.998 -1.818 4.804 1.00 0.00 H new ATOM 0 HA LEU A 51 6.735 -2.694 2.093 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.593 -0.413 2.303 1.00 0.00 H new ATOM 0 HB3 LEU A 51 8.326 -0.797 3.847 1.00 0.00 H new ATOM 0 HG LEU A 51 9.730 -2.539 2.606 1.00 0.00 H new ATOM 0 HD11 LEU A 51 10.035 -2.156 0.190 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.376 -2.675 0.573 1.00 0.00 H new ATOM 0 HD13 LEU A 51 8.713 -0.965 0.217 1.00 0.00 H new ATOM 0 HD21 LEU A 51 11.341 -0.845 1.818 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.071 0.398 1.910 1.00 0.00 H new ATOM 0 HD23 LEU A 51 10.639 -0.406 3.393 1.00 0.00 H new ATOM 766 N LEU A 52 7.723 -4.669 3.178 1.00 0.00 N ATOM 767 CA LEU A 52 8.300 -5.871 3.775 1.00 0.00 C ATOM 768 C LEU A 52 9.071 -6.696 2.745 1.00 0.00 C ATOM 769 O LEU A 52 9.080 -6.377 1.555 1.00 0.00 O ATOM 770 CB LEU A 52 7.192 -6.725 4.398 1.00 0.00 C ATOM 771 CG LEU A 52 7.192 -6.774 5.925 1.00 0.00 C ATOM 772 CD1 LEU A 52 6.488 -5.555 6.504 1.00 0.00 C ATOM 773 CD2 LEU A 52 6.534 -8.057 6.413 1.00 0.00 C ATOM 0 H LEU A 52 7.344 -4.807 2.241 1.00 0.00 H new ATOM 0 HA LEU A 52 9.002 -5.557 4.548 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.228 -6.343 4.062 1.00 0.00 H new ATOM 0 HB3 LEU A 52 7.282 -7.742 4.017 1.00 0.00 H new ATOM 0 HG LEU A 52 8.226 -6.763 6.270 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.500 -5.611 7.593 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.003 -4.650 6.181 1.00 0.00 H new ATOM 0 HD13 LEU A 52 5.456 -5.530 6.153 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.541 -8.078 7.503 1.00 0.00 H new ATOM 0 HD22 LEU A 52 5.505 -8.097 6.056 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.084 -8.917 6.030 1.00 0.00 H new ATOM 785 N GLU A 53 9.710 -7.766 3.219 1.00 0.00 N ATOM 786 CA GLU A 53 10.479 -8.654 2.352 1.00 0.00 C ATOM 787 C GLU A 53 9.746 -9.980 2.158 1.00 0.00 C ATOM 788 O GLU A 53 9.188 -10.534 3.109 1.00 0.00 O ATOM 789 CB GLU A 53 11.871 -8.905 2.939 1.00 0.00 C ATOM 790 CG GLU A 53 12.594 -7.636 3.376 1.00 0.00 C ATOM 791 CD GLU A 53 13.043 -7.688 4.826 1.00 0.00 C ATOM 792 OE1 GLU A 53 12.180 -7.565 5.721 1.00 0.00 O ATOM 793 OE2 GLU A 53 14.258 -7.849 5.064 1.00 0.00 O ATOM 0 H GLU A 53 9.709 -8.038 4.202 1.00 0.00 H new ATOM 0 HA GLU A 53 10.590 -8.170 1.382 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.779 -9.572 3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 53 12.480 -9.421 2.197 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.462 -7.479 2.736 1.00 0.00 H new ATOM 0 HG3 GLU A 53 11.935 -6.780 3.234 1.00 0.00 H new ATOM 800 N LEU A 54 9.748 -10.478 0.921 1.00 0.00 N ATOM 801 CA LEU A 54 9.083 -11.739 0.579 1.00 0.00 C ATOM 802 C LEU A 54 9.457 -12.853 1.560 1.00 0.00 C ATOM 803 O LEU A 54 10.631 -13.196 1.705 1.00 0.00 O ATOM 804 CB LEU A 54 9.452 -12.157 -0.850 1.00 0.00 C ATOM 805 CG LEU A 54 8.268 -12.484 -1.763 1.00 0.00 C ATOM 806 CD1 LEU A 54 8.675 -12.359 -3.225 1.00 0.00 C ATOM 807 CD2 LEU A 54 7.739 -13.880 -1.469 1.00 0.00 C ATOM 0 H LEU A 54 10.207 -10.023 0.132 1.00 0.00 H new ATOM 0 HA LEU A 54 8.007 -11.578 0.645 1.00 0.00 H new ATOM 0 HB2 LEU A 54 10.031 -11.355 -1.307 1.00 0.00 H new ATOM 0 HB3 LEU A 54 10.102 -13.030 -0.799 1.00 0.00 H new ATOM 0 HG LEU A 54 7.470 -11.768 -1.567 1.00 0.00 H new ATOM 0 HD11 LEU A 54 7.822 -12.595 -3.862 1.00 0.00 H new ATOM 0 HD12 LEU A 54 9.006 -11.340 -3.425 1.00 0.00 H new ATOM 0 HD13 LEU A 54 9.489 -13.053 -3.437 1.00 0.00 H new ATOM 0 HD21 LEU A 54 6.897 -14.096 -2.127 1.00 0.00 H new ATOM 0 HD22 LEU A 54 8.529 -14.612 -1.638 1.00 0.00 H new ATOM 0 HD23 LEU A 54 7.411 -13.934 -0.431 1.00 0.00 H new ATOM 819 N GLN A 55 8.448 -13.412 2.232 1.00 0.00 N ATOM 820 CA GLN A 55 8.669 -14.484 3.201 1.00 0.00 C ATOM 821 C GLN A 55 8.245 -15.837 2.630 1.00 0.00 C ATOM 822 O GLN A 55 7.094 -16.016 2.229 1.00 0.00 O ATOM 823 CB GLN A 55 7.901 -14.202 4.493 1.00 0.00 C ATOM 824 CG GLN A 55 8.390 -12.967 5.234 1.00 0.00 C ATOM 825 CD GLN A 55 9.748 -13.170 5.881 1.00 0.00 C ATOM 826 OE1 GLN A 55 10.779 -12.823 5.304 1.00 0.00 O ATOM 827 NE2 GLN A 55 9.755 -13.734 7.083 1.00 0.00 N ATOM 0 H GLN A 55 7.471 -13.139 2.122 1.00 0.00 H new ATOM 0 HA GLN A 55 9.736 -14.521 3.421 1.00 0.00 H new ATOM 0 HB2 GLN A 55 6.844 -14.080 4.258 1.00 0.00 H new ATOM 0 HB3 GLN A 55 7.983 -15.067 5.151 1.00 0.00 H new ATOM 0 HG2 GLN A 55 8.445 -12.129 4.539 1.00 0.00 H new ATOM 0 HG3 GLN A 55 7.664 -12.697 6.001 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.876 -14.006 7.524 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.639 -13.895 7.565 1.00 0.00 H new ATOM 836 N ALA A 56 9.189 -16.781 2.602 1.00 0.00 N ATOM 837 CA ALA A 56 8.938 -18.129 2.089 1.00 0.00 C ATOM 838 C ALA A 56 8.585 -18.108 0.597 1.00 0.00 C ATOM 839 O ALA A 56 9.458 -18.295 -0.250 1.00 0.00 O ATOM 840 CB ALA A 56 7.853 -18.827 2.901 1.00 0.00 C ATOM 0 H ALA A 56 10.143 -16.634 2.932 1.00 0.00 H new ATOM 0 HA ALA A 56 9.860 -18.700 2.197 1.00 0.00 H new ATOM 0 HB1 ALA A 56 7.685 -19.827 2.500 1.00 0.00 H new ATOM 0 HB2 ALA A 56 8.169 -18.902 3.942 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.929 -18.253 2.843 1.00 0.00 H new ATOM 846 N HIS A 57 7.305 -17.882 0.279 1.00 0.00 N ATOM 847 CA HIS A 57 6.854 -17.841 -1.112 1.00 0.00 C ATOM 848 C HIS A 57 5.388 -17.409 -1.201 1.00 0.00 C ATOM 849 O HIS A 57 4.519 -18.194 -1.586 1.00 0.00 O ATOM 850 CB HIS A 57 7.045 -19.213 -1.779 1.00 0.00 C ATOM 851 CG HIS A 57 6.395 -20.346 -1.041 1.00 0.00 C ATOM 852 ND1 HIS A 57 6.893 -20.867 0.135 1.00 0.00 N ATOM 853 CD2 HIS A 57 5.276 -21.057 -1.321 1.00 0.00 C ATOM 854 CE1 HIS A 57 6.109 -21.848 0.546 1.00 0.00 C ATOM 855 NE2 HIS A 57 5.121 -21.981 -0.320 1.00 0.00 N ATOM 0 H HIS A 57 6.567 -17.725 0.966 1.00 0.00 H new ATOM 0 HA HIS A 57 7.459 -17.105 -1.641 1.00 0.00 H new ATOM 0 HB2 HIS A 57 6.641 -19.173 -2.791 1.00 0.00 H new ATOM 0 HB3 HIS A 57 8.112 -19.416 -1.869 1.00 0.00 H new ATOM 0 HD2 HIS A 57 4.627 -20.921 -2.174 1.00 0.00 H new ATOM 0 HE1 HIS A 57 6.252 -22.440 1.438 1.00 0.00 H new ATOM 0 HE2 HIS A 57 4.364 -22.662 -0.255 1.00 0.00 H new ATOM 864 N VAL A 58 5.121 -16.155 -0.837 1.00 0.00 N ATOM 865 CA VAL A 58 3.761 -15.620 -0.867 1.00 0.00 C ATOM 866 C VAL A 58 3.684 -14.327 -1.684 1.00 0.00 C ATOM 867 O VAL A 58 4.416 -13.373 -1.419 1.00 0.00 O ATOM 868 CB VAL A 58 3.234 -15.353 0.562 1.00 0.00 C ATOM 869 CG1 VAL A 58 1.733 -15.117 0.546 1.00 0.00 C ATOM 870 CG2 VAL A 58 3.584 -16.507 1.495 1.00 0.00 C ATOM 0 H VAL A 58 5.828 -15.492 -0.518 1.00 0.00 H new ATOM 0 HA VAL A 58 3.136 -16.375 -1.344 1.00 0.00 H new ATOM 0 HB VAL A 58 3.720 -14.452 0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.383 -14.931 1.561 1.00 0.00 H new ATOM 0 HG12 VAL A 58 1.507 -14.253 -0.079 1.00 0.00 H new ATOM 0 HG13 VAL A 58 1.231 -15.997 0.144 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.203 -16.296 2.494 1.00 0.00 H new ATOM 0 HG22 VAL A 58 3.133 -17.426 1.122 1.00 0.00 H new ATOM 0 HG23 VAL A 58 4.667 -16.625 1.537 1.00 0.00 H new ATOM 880 N ARG A 59 2.790 -14.303 -2.680 1.00 0.00 N ATOM 881 CA ARG A 59 2.613 -13.127 -3.540 1.00 0.00 C ATOM 882 C ARG A 59 1.235 -13.122 -4.207 1.00 0.00 C ATOM 883 O ARG A 59 0.683 -14.177 -4.523 1.00 0.00 O ATOM 884 CB ARG A 59 3.702 -13.067 -4.621 1.00 0.00 C ATOM 885 CG ARG A 59 3.968 -14.400 -5.309 1.00 0.00 C ATOM 886 CD ARG A 59 3.019 -14.626 -6.480 1.00 0.00 C ATOM 887 NE ARG A 59 3.672 -14.419 -7.774 1.00 0.00 N ATOM 888 CZ ARG A 59 3.218 -14.916 -8.929 1.00 0.00 C ATOM 889 NH1 ARG A 59 2.096 -15.631 -8.964 1.00 0.00 N ATOM 890 NH2 ARG A 59 3.881 -14.688 -10.058 1.00 0.00 N ATOM 0 H ARG A 59 2.178 -15.085 -2.910 1.00 0.00 H new ATOM 0 HA ARG A 59 2.694 -12.249 -2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 59 3.412 -12.333 -5.373 1.00 0.00 H new ATOM 0 HB3 ARG A 59 4.628 -12.712 -4.169 1.00 0.00 H new ATOM 0 HG2 ARG A 59 4.998 -14.428 -5.664 1.00 0.00 H new ATOM 0 HG3 ARG A 59 3.857 -15.210 -4.589 1.00 0.00 H new ATOM 0 HD2 ARG A 59 2.624 -15.641 -6.433 1.00 0.00 H new ATOM 0 HD3 ARG A 59 2.170 -13.949 -6.392 1.00 0.00 H new ATOM 0 HE ARG A 59 4.526 -13.861 -7.796 1.00 0.00 H new ATOM 0 HH11 ARG A 59 1.574 -15.804 -8.105 1.00 0.00 H new ATOM 0 HH12 ARG A 59 1.758 -16.006 -9.850 1.00 0.00 H new ATOM 0 HH21 ARG A 59 4.737 -14.133 -10.044 1.00 0.00 H new ATOM 0 HH22 ARG A 59 3.534 -15.068 -10.939 1.00 0.00 H new ATOM 904 N GLY A 60 0.700 -11.922 -4.433 1.00 0.00 N ATOM 905 CA GLY A 60 -0.595 -11.785 -5.078 1.00 0.00 C ATOM 906 C GLY A 60 -1.754 -12.157 -4.173 1.00 0.00 C ATOM 907 O GLY A 60 -1.837 -11.693 -3.033 1.00 0.00 O ATOM 0 H GLY A 60 1.144 -11.039 -4.179 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -0.720 -10.755 -5.413 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.620 -12.415 -5.967 1.00 0.00 H new ATOM 911 N GLU A 61 -2.654 -12.998 -4.688 1.00 0.00 N ATOM 912 CA GLU A 61 -3.824 -13.443 -3.928 1.00 0.00 C ATOM 913 C GLU A 61 -3.402 -14.077 -2.606 1.00 0.00 C ATOM 914 O GLU A 61 -4.080 -13.920 -1.588 1.00 0.00 O ATOM 915 CB GLU A 61 -4.647 -14.446 -4.745 1.00 0.00 C ATOM 916 CG GLU A 61 -6.048 -14.675 -4.191 1.00 0.00 C ATOM 917 CD GLU A 61 -6.695 -15.957 -4.690 1.00 0.00 C ATOM 918 OE1 GLU A 61 -5.962 -16.920 -5.005 1.00 0.00 O ATOM 919 OE2 GLU A 61 -7.941 -15.997 -4.761 1.00 0.00 O ATOM 0 H GLU A 61 -2.594 -13.385 -5.630 1.00 0.00 H new ATOM 0 HA GLU A 61 -4.439 -12.568 -3.716 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.725 -14.089 -5.772 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -4.117 -15.398 -4.777 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -6.000 -14.701 -3.102 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -6.680 -13.829 -4.462 1.00 0.00 H new ATOM 926 N ALA A 62 -2.274 -14.789 -2.629 1.00 0.00 N ATOM 927 CA ALA A 62 -1.748 -15.441 -1.435 1.00 0.00 C ATOM 928 C ALA A 62 -1.171 -14.413 -0.468 1.00 0.00 C ATOM 929 O ALA A 62 -1.365 -14.515 0.743 1.00 0.00 O ATOM 930 CB ALA A 62 -0.682 -16.463 -1.813 1.00 0.00 C ATOM 0 H ALA A 62 -1.708 -14.927 -3.466 1.00 0.00 H new ATOM 0 HA ALA A 62 -2.570 -15.958 -0.939 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -0.300 -16.941 -0.911 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -1.118 -17.219 -2.467 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.135 -15.962 -2.332 1.00 0.00 H new ATOM 936 N ALA A 63 -0.462 -13.422 -1.014 1.00 0.00 N ATOM 937 CA ALA A 63 0.150 -12.369 -0.203 1.00 0.00 C ATOM 938 C ALA A 63 -0.911 -11.506 0.477 1.00 0.00 C ATOM 939 O ALA A 63 -0.761 -11.127 1.640 1.00 0.00 O ATOM 940 CB ALA A 63 1.072 -11.508 -1.056 1.00 0.00 C ATOM 0 H ALA A 63 -0.298 -13.328 -2.016 1.00 0.00 H new ATOM 0 HA ALA A 63 0.742 -12.848 0.577 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.519 -10.730 -0.437 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.859 -12.130 -1.482 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.499 -11.047 -1.860 1.00 0.00 H new ATOM 946 N ALA A 64 -1.984 -11.199 -0.254 1.00 0.00 N ATOM 947 CA ALA A 64 -3.068 -10.383 0.283 1.00 0.00 C ATOM 948 C ALA A 64 -3.768 -11.092 1.437 1.00 0.00 C ATOM 949 O ALA A 64 -3.819 -10.573 2.549 1.00 0.00 O ATOM 950 CB ALA A 64 -4.068 -10.032 -0.811 1.00 0.00 C ATOM 0 H ALA A 64 -2.123 -11.504 -1.217 1.00 0.00 H new ATOM 0 HA ALA A 64 -2.634 -9.459 0.666 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -4.869 -9.423 -0.391 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -3.564 -9.474 -1.600 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.489 -10.948 -1.227 1.00 0.00 H new ATOM 956 N ARG A 65 -4.305 -12.284 1.164 1.00 0.00 N ATOM 957 CA ARG A 65 -5.005 -13.069 2.183 1.00 0.00 C ATOM 958 C ARG A 65 -4.102 -13.356 3.387 1.00 0.00 C ATOM 959 O ARG A 65 -4.559 -13.331 4.530 1.00 0.00 O ATOM 960 CB ARG A 65 -5.520 -14.383 1.586 1.00 0.00 C ATOM 961 CG ARG A 65 -6.630 -14.196 0.563 1.00 0.00 C ATOM 962 CD ARG A 65 -6.995 -15.510 -0.113 1.00 0.00 C ATOM 963 NE ARG A 65 -8.125 -16.171 0.542 1.00 0.00 N ATOM 964 CZ ARG A 65 -9.403 -15.835 0.349 1.00 0.00 C ATOM 965 NH1 ARG A 65 -9.725 -14.835 -0.470 1.00 0.00 N ATOM 966 NH2 ARG A 65 -10.366 -16.498 0.980 1.00 0.00 N ATOM 0 H ARG A 65 -4.268 -12.726 0.246 1.00 0.00 H new ATOM 0 HA ARG A 65 -5.853 -12.479 2.530 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.689 -14.908 1.115 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.884 -15.020 2.392 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -7.511 -13.781 1.053 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -6.314 -13.474 -0.190 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -7.241 -15.323 -1.158 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.131 -16.175 -0.103 1.00 0.00 H new ATOM 0 HE ARG A 65 -7.924 -16.936 1.186 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -8.992 -14.318 -0.956 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -10.704 -14.586 -0.611 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.129 -17.263 1.611 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -11.342 -16.242 0.833 1.00 0.00 H new ATOM 980 N TYR A 66 -2.821 -13.629 3.122 1.00 0.00 N ATOM 981 CA TYR A 66 -1.857 -13.921 4.184 1.00 0.00 C ATOM 982 C TYR A 66 -1.757 -12.760 5.177 1.00 0.00 C ATOM 983 O TYR A 66 -2.046 -12.922 6.363 1.00 0.00 O ATOM 984 CB TYR A 66 -0.479 -14.221 3.582 1.00 0.00 C ATOM 985 CG TYR A 66 0.596 -14.532 4.610 1.00 0.00 C ATOM 986 CD1 TYR A 66 0.347 -15.394 5.672 1.00 0.00 C ATOM 987 CD2 TYR A 66 1.860 -13.964 4.510 1.00 0.00 C ATOM 988 CE1 TYR A 66 1.328 -15.678 6.604 1.00 0.00 C ATOM 989 CE2 TYR A 66 2.845 -14.245 5.436 1.00 0.00 C ATOM 990 CZ TYR A 66 2.575 -15.103 6.481 1.00 0.00 C ATOM 991 OH TYR A 66 3.555 -15.386 7.405 1.00 0.00 O ATOM 0 H TYR A 66 -2.429 -13.654 2.181 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.209 -14.799 4.725 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -0.569 -15.067 2.900 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -0.160 -13.365 2.988 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -0.628 -15.849 5.770 1.00 0.00 H new ATOM 0 HD2 TYR A 66 2.076 -13.291 3.694 1.00 0.00 H new ATOM 0 HE1 TYR A 66 1.118 -16.348 7.425 1.00 0.00 H new ATOM 0 HE2 TYR A 66 3.822 -13.795 5.342 1.00 0.00 H new ATOM 0 HH TYR A 66 4.374 -14.901 7.172 1.00 0.00 H new ATOM 1001 N HIS A 67 -1.342 -11.590 4.687 1.00 0.00 N ATOM 1002 CA HIS A 67 -1.200 -10.408 5.540 1.00 0.00 C ATOM 1003 C HIS A 67 -2.559 -9.895 6.023 1.00 0.00 C ATOM 1004 O HIS A 67 -2.663 -9.328 7.113 1.00 0.00 O ATOM 1005 CB HIS A 67 -0.453 -9.294 4.798 1.00 0.00 C ATOM 1006 CG HIS A 67 1.032 -9.360 4.969 1.00 0.00 C ATOM 1007 ND1 HIS A 67 1.657 -9.212 6.190 1.00 0.00 N ATOM 1008 CD2 HIS A 67 2.022 -9.567 4.066 1.00 0.00 C ATOM 1009 CE1 HIS A 67 2.964 -9.323 6.032 1.00 0.00 C ATOM 1010 NE2 HIS A 67 3.211 -9.537 4.753 1.00 0.00 N ATOM 0 H HIS A 67 -1.099 -11.436 3.708 1.00 0.00 H new ATOM 0 HA HIS A 67 -0.621 -10.705 6.414 1.00 0.00 H new ATOM 0 HB2 HIS A 67 -0.692 -9.351 3.736 1.00 0.00 H new ATOM 0 HB3 HIS A 67 -0.810 -8.328 5.154 1.00 0.00 H new ATOM 0 HD2 HIS A 67 1.899 -9.726 3.005 1.00 0.00 H new ATOM 0 HE1 HIS A 67 3.704 -9.251 6.815 1.00 0.00 H new ATOM 0 HE2 HIS A 67 4.136 -9.660 4.341 1.00 0.00 H new ATOM 1019 N PHE A 68 -3.598 -10.101 5.213 1.00 0.00 N ATOM 1020 CA PHE A 68 -4.951 -9.667 5.561 1.00 0.00 C ATOM 1021 C PHE A 68 -5.428 -10.355 6.838 1.00 0.00 C ATOM 1022 O PHE A 68 -6.006 -9.717 7.720 1.00 0.00 O ATOM 1023 CB PHE A 68 -5.912 -9.972 4.404 1.00 0.00 C ATOM 1024 CG PHE A 68 -7.317 -9.468 4.610 1.00 0.00 C ATOM 1025 CD1 PHE A 68 -8.205 -10.157 5.421 1.00 0.00 C ATOM 1026 CD2 PHE A 68 -7.749 -8.308 3.984 1.00 0.00 C ATOM 1027 CE1 PHE A 68 -9.496 -9.700 5.601 1.00 0.00 C ATOM 1028 CE2 PHE A 68 -9.039 -7.848 4.161 1.00 0.00 C ATOM 1029 CZ PHE A 68 -9.913 -8.545 4.971 1.00 0.00 C ATOM 0 H PHE A 68 -3.528 -10.567 4.309 1.00 0.00 H new ATOM 0 HA PHE A 68 -4.935 -8.592 5.738 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.512 -9.532 3.490 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.945 -11.051 4.251 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -7.884 -11.061 5.918 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -7.069 -7.758 3.351 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -10.179 -10.246 6.235 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -9.364 -6.944 3.667 1.00 0.00 H new ATOM 0 HZ PHE A 68 -10.922 -8.187 5.112 1.00 0.00 H new ATOM 1039 N GLU A 69 -5.179 -11.662 6.929 1.00 0.00 N ATOM 1040 CA GLU A 69 -5.579 -12.443 8.097 1.00 0.00 C ATOM 1041 C GLU A 69 -4.696 -12.129 9.306 1.00 0.00 C ATOM 1042 O GLU A 69 -5.157 -12.189 10.446 1.00 0.00 O ATOM 1043 CB GLU A 69 -5.519 -13.940 7.783 1.00 0.00 C ATOM 1044 CG GLU A 69 -6.891 -14.590 7.671 1.00 0.00 C ATOM 1045 CD GLU A 69 -6.966 -15.926 8.382 1.00 0.00 C ATOM 1046 OE1 GLU A 69 -6.787 -15.951 9.618 1.00 0.00 O ATOM 1047 OE2 GLU A 69 -7.207 -16.946 7.704 1.00 0.00 O ATOM 0 H GLU A 69 -4.702 -12.201 6.207 1.00 0.00 H new ATOM 0 HA GLU A 69 -6.605 -12.169 8.344 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -4.979 -14.086 6.848 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.949 -14.445 8.563 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -7.642 -13.919 8.088 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.138 -14.729 6.618 1.00 0.00 H new ATOM 1054 N ASP A 70 -3.431 -11.796 9.055 1.00 0.00 N ATOM 1055 CA ASP A 70 -2.493 -11.477 10.131 1.00 0.00 C ATOM 1056 C ASP A 70 -2.924 -10.220 10.888 1.00 0.00 C ATOM 1057 O ASP A 70 -2.715 -10.113 12.098 1.00 0.00 O ATOM 1058 CB ASP A 70 -1.079 -11.291 9.576 1.00 0.00 C ATOM 1059 CG ASP A 70 -0.018 -11.801 10.533 1.00 0.00 C ATOM 1060 OD1 ASP A 70 0.129 -13.036 10.648 1.00 0.00 O ATOM 1061 OD2 ASP A 70 0.661 -10.967 11.166 1.00 0.00 O ATOM 0 H ASP A 70 -3.032 -11.740 8.118 1.00 0.00 H new ATOM 0 HA ASP A 70 -2.494 -12.315 10.828 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -0.991 -11.816 8.625 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -0.906 -10.234 9.373 1.00 0.00 H new ATOM 1066 N VAL A 71 -3.525 -9.271 10.172 1.00 0.00 N ATOM 1067 CA VAL A 71 -3.984 -8.024 10.776 1.00 0.00 C ATOM 1068 C VAL A 71 -5.373 -8.189 11.382 1.00 0.00 C ATOM 1069 O VAL A 71 -5.591 -7.870 12.552 1.00 0.00 O ATOM 1070 CB VAL A 71 -4.028 -6.883 9.744 1.00 0.00 C ATOM 1071 CG1 VAL A 71 -4.338 -5.555 10.421 1.00 0.00 C ATOM 1072 CG2 VAL A 71 -2.722 -6.804 8.964 1.00 0.00 C ATOM 0 H VAL A 71 -3.705 -9.344 9.171 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.270 -7.771 11.560 1.00 0.00 H new ATOM 0 HB VAL A 71 -4.829 -7.097 9.036 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.364 -4.763 9.673 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.306 -5.617 10.918 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -3.566 -5.333 11.158 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -2.778 -5.990 8.241 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -1.897 -6.621 9.653 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.554 -7.744 8.439 1.00 0.00 H new ATOM 1082 N GLY A 72 -6.310 -8.691 10.576 1.00 0.00 N ATOM 1083 CA GLY A 72 -7.669 -8.895 11.046 1.00 0.00 C ATOM 1084 C GLY A 72 -7.766 -9.942 12.145 1.00 0.00 C ATOM 1085 O GLY A 72 -8.798 -10.051 12.808 1.00 0.00 O ATOM 0 H GLY A 72 -6.149 -8.960 9.605 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.065 -7.950 11.416 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.296 -9.197 10.207 1.00 0.00 H new ATOM 1089 N GLY A 73 -6.695 -10.717 12.335 1.00 0.00 N ATOM 1090 CA GLY A 73 -6.692 -11.749 13.359 1.00 0.00 C ATOM 1091 C GLY A 73 -6.191 -11.253 14.706 1.00 0.00 C ATOM 1092 O GLY A 73 -6.594 -11.772 15.747 1.00 0.00 O ATOM 0 H GLY A 73 -5.831 -10.647 11.797 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -7.703 -12.139 13.476 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -6.066 -12.578 13.029 1.00 0.00 H new ATOM 1096 N VAL A 74 -5.305 -10.255 14.688 1.00 0.00 N ATOM 1097 CA VAL A 74 -4.748 -9.702 15.922 1.00 0.00 C ATOM 1098 C VAL A 74 -5.086 -8.216 16.064 1.00 0.00 C ATOM 1099 O VAL A 74 -4.212 -7.352 15.945 1.00 0.00 O ATOM 1100 CB VAL A 74 -3.216 -9.904 15.986 1.00 0.00 C ATOM 1101 CG1 VAL A 74 -2.673 -9.487 17.347 1.00 0.00 C ATOM 1102 CG2 VAL A 74 -2.856 -11.353 15.682 1.00 0.00 C ATOM 0 H VAL A 74 -4.959 -9.815 13.835 1.00 0.00 H new ATOM 0 HA VAL A 74 -5.203 -10.243 16.752 1.00 0.00 H new ATOM 0 HB VAL A 74 -2.754 -9.270 15.229 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.594 -9.637 17.370 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -2.896 -8.434 17.521 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.140 -10.090 18.125 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -1.774 -11.477 15.731 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -3.330 -12.007 16.414 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -3.206 -11.613 14.683 1.00 0.00 H new ATOM 1112 N GLN A 75 -6.364 -7.930 16.323 1.00 0.00 N ATOM 1113 CA GLN A 75 -6.839 -6.551 16.486 1.00 0.00 C ATOM 1114 C GLN A 75 -8.352 -6.519 16.725 1.00 0.00 C ATOM 1115 O GLN A 75 -8.835 -5.813 17.612 1.00 0.00 O ATOM 1116 CB GLN A 75 -6.492 -5.716 15.247 1.00 0.00 C ATOM 1117 CG GLN A 75 -5.762 -4.418 15.566 1.00 0.00 C ATOM 1118 CD GLN A 75 -4.564 -4.191 14.661 1.00 0.00 C ATOM 1119 OE1 GLN A 75 -3.424 -4.155 15.122 1.00 0.00 O ATOM 1120 NE2 GLN A 75 -4.816 -4.035 13.366 1.00 0.00 N ATOM 0 H GLN A 75 -7.092 -8.637 16.425 1.00 0.00 H new ATOM 0 HA GLN A 75 -6.340 -6.124 17.356 1.00 0.00 H new ATOM 0 HB2 GLN A 75 -5.874 -6.315 14.578 1.00 0.00 H new ATOM 0 HB3 GLN A 75 -7.411 -5.483 14.709 1.00 0.00 H new ATOM 0 HG2 GLN A 75 -6.453 -3.581 15.466 1.00 0.00 H new ATOM 0 HG3 GLN A 75 -5.431 -4.436 16.604 1.00 0.00 H new ATOM 0 HE21 GLN A 75 -5.777 -4.072 13.025 1.00 0.00 H new ATOM 0 HE22 GLN A 75 -4.049 -3.878 12.712 1.00 0.00 H new ATOM 1129 N GLY A 76 -9.090 -7.291 15.925 1.00 0.00 N ATOM 1130 CA GLY A 76 -10.538 -7.350 16.049 1.00 0.00 C ATOM 1131 C GLY A 76 -11.184 -8.030 14.856 1.00 0.00 C ATOM 1132 O GLY A 76 -10.765 -9.120 14.466 1.00 0.00 O ATOM 0 H GLY A 76 -8.705 -7.881 15.187 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.802 -7.888 16.960 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -10.935 -6.340 16.149 1.00 0.00 H new ATOM 1136 N ALA A 77 -12.196 -7.379 14.269 1.00 0.00 N ATOM 1137 CA ALA A 77 -12.895 -7.916 13.100 1.00 0.00 C ATOM 1138 C ALA A 77 -13.654 -9.203 13.433 1.00 0.00 C ATOM 1139 O ALA A 77 -13.046 -10.246 13.682 1.00 0.00 O ATOM 1140 CB ALA A 77 -11.908 -8.149 11.965 1.00 0.00 C ATOM 0 H ALA A 77 -12.548 -6.476 14.588 1.00 0.00 H new ATOM 0 HA ALA A 77 -13.634 -7.180 12.783 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -12.437 -8.549 11.099 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.433 -7.205 11.696 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -11.147 -8.860 12.285 1.00 0.00 H new ATOM 1146 N ARG A 78 -14.985 -9.118 13.435 1.00 0.00 N ATOM 1147 CA ARG A 78 -15.831 -10.270 13.743 1.00 0.00 C ATOM 1148 C ARG A 78 -16.446 -10.881 12.481 1.00 0.00 C ATOM 1149 O ARG A 78 -16.775 -12.069 12.458 1.00 0.00 O ATOM 1150 CB ARG A 78 -16.937 -9.861 14.727 1.00 0.00 C ATOM 1151 CG ARG A 78 -17.765 -11.026 15.256 1.00 0.00 C ATOM 1152 CD ARG A 78 -19.256 -10.711 15.226 1.00 0.00 C ATOM 1153 NE ARG A 78 -19.887 -10.895 16.533 1.00 0.00 N ATOM 1154 CZ ARG A 78 -20.243 -12.082 17.030 1.00 0.00 C ATOM 1155 NH1 ARG A 78 -20.027 -13.197 16.336 1.00 0.00 N ATOM 1156 NH2 ARG A 78 -20.817 -12.155 18.226 1.00 0.00 N ATOM 0 H ARG A 78 -15.500 -8.263 13.227 1.00 0.00 H new ATOM 0 HA ARG A 78 -15.200 -11.031 14.201 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -16.483 -9.340 15.570 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -17.602 -9.152 14.234 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -17.568 -11.915 14.657 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -17.461 -11.256 16.277 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -19.402 -9.682 14.896 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -19.746 -11.353 14.494 1.00 0.00 H new ATOM 0 HE ARG A 78 -20.066 -10.066 17.099 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -19.586 -13.149 15.417 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -20.302 -14.100 16.723 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -20.985 -11.305 18.764 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -21.089 -13.061 18.607 1.00 0.00 H new ATOM 1170 N ALA A 79 -16.598 -10.070 11.436 1.00 0.00 N ATOM 1171 CA ALA A 79 -17.173 -10.533 10.176 1.00 0.00 C ATOM 1172 C ALA A 79 -16.436 -9.926 8.989 1.00 0.00 C ATOM 1173 O ALA A 79 -16.580 -8.737 8.704 1.00 0.00 O ATOM 1174 CB ALA A 79 -18.654 -10.190 10.107 1.00 0.00 C ATOM 0 H ALA A 79 -16.330 -9.086 11.438 1.00 0.00 H new ATOM 0 HA ALA A 79 -17.063 -11.617 10.132 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -19.065 -10.543 9.161 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -19.178 -10.672 10.933 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -18.781 -9.110 10.178 1.00 0.00 H new ATOM 1180 N VAL A 80 -15.640 -10.745 8.306 1.00 0.00 N ATOM 1181 CA VAL A 80 -14.872 -10.281 7.154 1.00 0.00 C ATOM 1182 C VAL A 80 -15.265 -11.025 5.884 1.00 0.00 C ATOM 1183 O VAL A 80 -15.074 -12.237 5.780 1.00 0.00 O ATOM 1184 CB VAL A 80 -13.357 -10.450 7.377 1.00 0.00 C ATOM 1185 CG1 VAL A 80 -12.576 -9.731 6.290 1.00 0.00 C ATOM 1186 CG2 VAL A 80 -12.957 -9.945 8.755 1.00 0.00 C ATOM 0 H VAL A 80 -15.510 -11.732 8.530 1.00 0.00 H new ATOM 0 HA VAL A 80 -15.103 -9.222 7.038 1.00 0.00 H new ATOM 0 HB VAL A 80 -13.117 -11.512 7.324 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -11.508 -9.861 6.463 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -12.839 -10.147 5.317 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -12.820 -8.669 6.309 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -11.883 -10.074 8.892 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -13.210 -8.888 8.843 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -13.491 -10.511 9.519 1.00 0.00 H new ATOM 1196 N HIS A 81 -15.806 -10.287 4.918 1.00 0.00 N ATOM 1197 CA HIS A 81 -16.218 -10.872 3.649 1.00 0.00 C ATOM 1198 C HIS A 81 -15.309 -10.403 2.510 1.00 0.00 C ATOM 1199 O HIS A 81 -14.467 -9.523 2.699 1.00 0.00 O ATOM 1200 CB HIS A 81 -17.681 -10.516 3.355 1.00 0.00 C ATOM 1201 CG HIS A 81 -17.880 -9.125 2.837 1.00 0.00 C ATOM 1202 ND1 HIS A 81 -16.942 -8.124 2.971 1.00 0.00 N ATOM 1203 CD2 HIS A 81 -18.916 -8.579 2.167 1.00 0.00 C ATOM 1204 CE1 HIS A 81 -17.393 -7.023 2.408 1.00 0.00 C ATOM 1205 NE2 HIS A 81 -18.591 -7.269 1.910 1.00 0.00 N ATOM 0 H HIS A 81 -15.969 -9.283 4.992 1.00 0.00 H new ATOM 0 HA HIS A 81 -16.129 -11.956 3.723 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -18.076 -11.224 2.626 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -18.264 -10.639 4.268 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -19.831 -9.079 1.885 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -16.872 -6.078 2.361 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -19.178 -6.597 1.416 1.00 0.00 H new ATOM 1214 N VAL A 82 -15.492 -10.987 1.326 1.00 0.00 N ATOM 1215 CA VAL A 82 -14.694 -10.618 0.158 1.00 0.00 C ATOM 1216 C VAL A 82 -15.563 -9.952 -0.905 1.00 0.00 C ATOM 1217 O VAL A 82 -16.481 -10.570 -1.443 1.00 0.00 O ATOM 1218 CB VAL A 82 -13.974 -11.835 -0.466 1.00 0.00 C ATOM 1219 CG1 VAL A 82 -12.827 -12.294 0.421 1.00 0.00 C ATOM 1220 CG2 VAL A 82 -14.948 -12.978 -0.724 1.00 0.00 C ATOM 0 H VAL A 82 -16.184 -11.716 1.151 1.00 0.00 H new ATOM 0 HA VAL A 82 -13.938 -9.916 0.509 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.562 -11.524 -1.426 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -12.334 -13.152 -0.037 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.109 -11.482 0.537 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -13.215 -12.578 1.399 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -14.413 -13.820 -1.163 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -15.403 -13.288 0.217 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -15.726 -12.645 -1.411 1.00 0.00 H new ATOM 1230 N GLU A 83 -15.267 -8.688 -1.201 1.00 0.00 N ATOM 1231 CA GLU A 83 -16.022 -7.939 -2.202 1.00 0.00 C ATOM 1232 C GLU A 83 -15.586 -8.322 -3.614 1.00 0.00 C ATOM 1233 O GLU A 83 -16.409 -8.734 -4.434 1.00 0.00 O ATOM 1234 CB GLU A 83 -15.845 -6.433 -1.986 1.00 0.00 C ATOM 1235 CG GLU A 83 -16.850 -5.839 -1.014 1.00 0.00 C ATOM 1236 CD GLU A 83 -16.932 -4.329 -1.108 1.00 0.00 C ATOM 1237 OE1 GLU A 83 -17.662 -3.826 -1.988 1.00 0.00 O ATOM 1238 OE2 GLU A 83 -16.268 -3.647 -0.299 1.00 0.00 O ATOM 0 H GLU A 83 -14.511 -8.162 -0.763 1.00 0.00 H new ATOM 0 HA GLU A 83 -17.076 -8.191 -2.089 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -14.837 -6.243 -1.616 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.934 -5.923 -2.945 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -17.834 -6.265 -1.210 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -16.577 -6.121 0.003 1.00 0.00 H new ATOM 1245 N SER A 84 -14.287 -8.184 -3.889 1.00 0.00 N ATOM 1246 CA SER A 84 -13.735 -8.514 -5.202 1.00 0.00 C ATOM 1247 C SER A 84 -12.233 -8.241 -5.247 1.00 0.00 C ATOM 1248 O SER A 84 -11.699 -7.518 -4.403 1.00 0.00 O ATOM 1249 CB SER A 84 -14.442 -7.712 -6.305 1.00 0.00 C ATOM 1250 OG SER A 84 -14.779 -6.407 -5.861 1.00 0.00 O ATOM 0 H SER A 84 -13.598 -7.845 -3.218 1.00 0.00 H new ATOM 0 HA SER A 84 -13.902 -9.577 -5.375 1.00 0.00 H new ATOM 0 HB2 SER A 84 -13.795 -7.645 -7.180 1.00 0.00 H new ATOM 0 HB3 SER A 84 -15.345 -8.237 -6.616 1.00 0.00 H new ATOM 0 HG SER A 84 -15.226 -5.920 -6.585 1.00 0.00 H new ATOM 1256 N VAL A 85 -11.559 -8.823 -6.238 1.00 0.00 N ATOM 1257 CA VAL A 85 -10.117 -8.646 -6.401 1.00 0.00 C ATOM 1258 C VAL A 85 -9.748 -8.489 -7.876 1.00 0.00 C ATOM 1259 O VAL A 85 -10.403 -9.056 -8.751 1.00 0.00 O ATOM 1260 CB VAL A 85 -9.331 -9.833 -5.809 1.00 0.00 C ATOM 1261 CG1 VAL A 85 -9.374 -9.803 -4.286 1.00 0.00 C ATOM 1262 CG2 VAL A 85 -9.866 -11.157 -6.340 1.00 0.00 C ATOM 0 H VAL A 85 -11.990 -9.423 -6.942 1.00 0.00 H new ATOM 0 HA VAL A 85 -9.846 -7.739 -5.861 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.291 -9.740 -6.121 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -8.813 -10.649 -3.889 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -8.931 -8.874 -3.928 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -10.409 -9.864 -3.950 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -9.296 -11.979 -5.908 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -10.916 -11.261 -6.067 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -9.770 -11.179 -7.425 1.00 0.00 H new ATOM 1272 N GLN A 86 -8.694 -7.720 -8.143 1.00 0.00 N ATOM 1273 CA GLN A 86 -8.241 -7.492 -9.513 1.00 0.00 C ATOM 1274 C GLN A 86 -6.717 -7.387 -9.585 1.00 0.00 C ATOM 1275 O GLN A 86 -6.095 -6.690 -8.780 1.00 0.00 O ATOM 1276 CB GLN A 86 -8.882 -6.223 -10.086 1.00 0.00 C ATOM 1277 CG GLN A 86 -8.651 -4.975 -9.245 1.00 0.00 C ATOM 1278 CD GLN A 86 -8.254 -3.771 -10.080 1.00 0.00 C ATOM 1279 OE1 GLN A 86 -7.188 -3.912 -10.860 1.00 0.00 O flip ATOM 1280 NE2 GLN A 86 -8.900 -2.725 -10.025 1.00 0.00 N flip ATOM 0 H GLN A 86 -8.139 -7.246 -7.431 1.00 0.00 H new ATOM 0 HA GLN A 86 -8.551 -8.349 -10.111 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -8.489 -6.051 -11.088 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -9.955 -6.385 -10.189 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -9.560 -4.743 -8.689 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -7.871 -5.176 -8.511 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -9.713 -2.659 -9.412 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -8.623 -1.924 -10.592 1.00 0.00 H new ATOM 1289 N PRO A 87 -6.096 -8.080 -10.560 1.00 0.00 N ATOM 1290 CA PRO A 87 -4.645 -8.063 -10.741 1.00 0.00 C ATOM 1291 C PRO A 87 -4.166 -6.795 -11.443 1.00 0.00 C ATOM 1292 O PRO A 87 -4.798 -6.323 -12.390 1.00 0.00 O ATOM 1293 CB PRO A 87 -4.392 -9.292 -11.612 1.00 0.00 C ATOM 1294 CG PRO A 87 -5.635 -9.438 -12.423 1.00 0.00 C ATOM 1295 CD PRO A 87 -6.766 -8.933 -11.564 1.00 0.00 C ATOM 0 HA PRO A 87 -4.108 -8.078 -9.792 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -3.517 -9.155 -12.248 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -4.208 -10.178 -11.004 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.565 -8.866 -13.348 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -5.795 -10.479 -12.704 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -7.491 -8.367 -12.150 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -7.308 -9.754 -11.094 1.00 0.00 H new ATOM 1303 N LEU A 88 -3.048 -6.249 -10.973 1.00 0.00 N ATOM 1304 CA LEU A 88 -2.484 -5.035 -11.557 1.00 0.00 C ATOM 1305 C LEU A 88 -1.319 -5.366 -12.485 1.00 0.00 C ATOM 1306 O LEU A 88 -0.352 -6.011 -12.077 1.00 0.00 O ATOM 1307 CB LEU A 88 -2.026 -4.076 -10.455 1.00 0.00 C ATOM 1308 CG LEU A 88 -2.868 -2.807 -10.309 1.00 0.00 C ATOM 1309 CD1 LEU A 88 -4.284 -3.153 -9.877 1.00 0.00 C ATOM 1310 CD2 LEU A 88 -2.222 -1.848 -9.319 1.00 0.00 C ATOM 0 H LEU A 88 -2.515 -6.627 -10.190 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.263 -4.550 -12.146 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.033 -4.609 -9.504 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.993 -3.788 -10.651 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.918 -2.313 -11.279 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.868 -2.238 -9.778 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.745 -3.799 -10.624 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.256 -3.671 -8.918 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.835 -0.951 -9.228 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -2.139 -2.331 -8.345 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.228 -1.574 -9.673 1.00 0.00 H new ATOM 1322 N SER A 89 -1.419 -4.918 -13.735 1.00 0.00 N ATOM 1323 CA SER A 89 -0.373 -5.161 -14.727 1.00 0.00 C ATOM 1324 C SER A 89 0.747 -4.124 -14.607 1.00 0.00 C ATOM 1325 O SER A 89 0.755 -3.313 -13.679 1.00 0.00 O ATOM 1326 CB SER A 89 -0.969 -5.135 -16.138 1.00 0.00 C ATOM 1327 OG SER A 89 -0.343 -6.093 -16.974 1.00 0.00 O ATOM 0 H SER A 89 -2.214 -4.384 -14.085 1.00 0.00 H new ATOM 0 HA SER A 89 0.054 -6.146 -14.539 1.00 0.00 H new ATOM 0 HB2 SER A 89 -2.039 -5.336 -16.088 1.00 0.00 H new ATOM 0 HB3 SER A 89 -0.851 -4.140 -16.568 1.00 0.00 H new ATOM 0 HG SER A 89 -0.742 -6.058 -17.868 1.00 0.00 H new ATOM 1333 N LEU A 90 1.689 -4.151 -15.553 1.00 0.00 N ATOM 1334 CA LEU A 90 2.808 -3.208 -15.550 1.00 0.00 C ATOM 1335 C LEU A 90 2.411 -1.844 -16.135 1.00 0.00 C ATOM 1336 O LEU A 90 3.239 -0.933 -16.206 1.00 0.00 O ATOM 1337 CB LEU A 90 3.996 -3.790 -16.326 1.00 0.00 C ATOM 1338 CG LEU A 90 5.275 -3.982 -15.506 1.00 0.00 C ATOM 1339 CD1 LEU A 90 6.200 -4.986 -16.179 1.00 0.00 C ATOM 1340 CD2 LEU A 90 5.983 -2.649 -15.304 1.00 0.00 C ATOM 0 H LEU A 90 1.699 -4.814 -16.328 1.00 0.00 H new ATOM 0 HA LEU A 90 3.098 -3.049 -14.511 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.701 -4.753 -16.742 1.00 0.00 H new ATOM 0 HB3 LEU A 90 4.217 -3.133 -17.167 1.00 0.00 H new ATOM 0 HG LEU A 90 5.000 -4.377 -14.528 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.103 -5.108 -15.580 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.692 -5.946 -16.268 1.00 0.00 H new ATOM 0 HD13 LEU A 90 6.469 -4.624 -17.171 1.00 0.00 H new ATOM 0 HD21 LEU A 90 6.890 -2.804 -14.719 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.244 -2.225 -16.274 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.322 -1.963 -14.774 1.00 0.00 H new ATOM 1352 N GLU A 91 1.146 -1.703 -16.545 1.00 0.00 N ATOM 1353 CA GLU A 91 0.660 -0.447 -17.112 1.00 0.00 C ATOM 1354 C GLU A 91 0.261 0.541 -16.013 1.00 0.00 C ATOM 1355 O GLU A 91 0.394 1.754 -16.186 1.00 0.00 O ATOM 1356 CB GLU A 91 -0.532 -0.706 -18.035 1.00 0.00 C ATOM 1357 CG GLU A 91 -0.523 0.151 -19.293 1.00 0.00 C ATOM 1358 CD GLU A 91 -0.687 -0.666 -20.562 1.00 0.00 C ATOM 1359 OE1 GLU A 91 -1.658 -1.448 -20.647 1.00 0.00 O ATOM 1360 OE2 GLU A 91 0.157 -0.524 -21.471 1.00 0.00 O ATOM 0 H GLU A 91 0.445 -2.442 -16.494 1.00 0.00 H new ATOM 0 HA GLU A 91 1.473 -0.006 -17.689 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -0.538 -1.758 -18.321 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -1.454 -0.520 -17.485 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -1.326 0.885 -19.233 1.00 0.00 H new ATOM 0 HG3 GLU A 91 0.414 0.706 -19.342 1.00 0.00 H new ATOM 1367 N ASN A 92 -0.229 0.017 -14.885 1.00 0.00 N ATOM 1368 CA ASN A 92 -0.645 0.859 -13.762 1.00 0.00 C ATOM 1369 C ASN A 92 0.505 1.725 -13.261 1.00 0.00 C ATOM 1370 O ASN A 92 0.280 2.821 -12.744 1.00 0.00 O ATOM 1371 CB ASN A 92 -1.200 0.006 -12.616 1.00 0.00 C ATOM 1372 CG ASN A 92 -2.641 -0.411 -12.846 1.00 0.00 C ATOM 1373 OD1 ASN A 92 -3.572 0.276 -12.425 1.00 0.00 O ATOM 1374 ND2 ASN A 92 -2.835 -1.542 -13.517 1.00 0.00 N ATOM 0 H ASN A 92 -0.347 -0.984 -14.727 1.00 0.00 H new ATOM 0 HA ASN A 92 -1.435 1.517 -14.123 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -0.582 -0.884 -12.498 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.132 0.567 -11.684 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -3.783 -1.870 -13.700 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -2.036 -2.082 -13.849 1.00 0.00 H new ATOM 1381 N LEU A 93 1.739 1.253 -13.432 1.00 0.00 N ATOM 1382 CA LEU A 93 2.892 2.018 -13.010 1.00 0.00 C ATOM 1383 C LEU A 93 3.185 3.096 -14.045 1.00 0.00 C ATOM 1384 O LEU A 93 3.642 2.804 -15.149 1.00 0.00 O ATOM 1385 CB LEU A 93 4.103 1.107 -12.818 1.00 0.00 C ATOM 1386 CG LEU A 93 4.090 0.275 -11.532 1.00 0.00 C ATOM 1387 CD1 LEU A 93 3.393 -1.060 -11.764 1.00 0.00 C ATOM 1388 CD2 LEU A 93 5.509 0.064 -11.020 1.00 0.00 C ATOM 0 H LEU A 93 1.956 0.352 -13.857 1.00 0.00 H new ATOM 0 HA LEU A 93 2.679 2.491 -12.051 1.00 0.00 H new ATOM 0 HB2 LEU A 93 4.168 0.430 -13.670 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.005 1.719 -12.828 1.00 0.00 H new ATOM 0 HG LEU A 93 3.531 0.821 -10.772 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.394 -1.637 -10.839 1.00 0.00 H new ATOM 0 HD12 LEU A 93 2.365 -0.884 -12.081 1.00 0.00 H new ATOM 0 HD13 LEU A 93 3.921 -1.616 -12.539 1.00 0.00 H new ATOM 0 HD21 LEU A 93 5.482 -0.529 -10.106 1.00 0.00 H new ATOM 0 HD22 LEU A 93 6.094 -0.461 -11.775 1.00 0.00 H new ATOM 0 HD23 LEU A 93 5.968 1.030 -10.812 1.00 0.00 H new ATOM 1400 N ALA A 94 2.889 4.336 -13.675 1.00 0.00 N ATOM 1401 CA ALA A 94 3.090 5.494 -14.553 1.00 0.00 C ATOM 1402 C ALA A 94 4.401 5.380 -15.324 1.00 0.00 C ATOM 1403 O ALA A 94 4.397 5.210 -16.543 1.00 0.00 O ATOM 1404 CB ALA A 94 3.055 6.787 -13.748 1.00 0.00 C ATOM 0 H ALA A 94 2.503 4.572 -12.761 1.00 0.00 H new ATOM 0 HA ALA A 94 2.275 5.512 -15.277 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.206 7.635 -14.416 1.00 0.00 H new ATOM 0 HB2 ALA A 94 2.088 6.882 -13.254 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.846 6.770 -12.998 1.00 0.00 H new ATOM 1410 N LEU A 95 5.522 5.446 -14.607 1.00 0.00 N ATOM 1411 CA LEU A 95 6.832 5.315 -15.237 1.00 0.00 C ATOM 1412 C LEU A 95 7.069 3.864 -15.662 1.00 0.00 C ATOM 1413 O LEU A 95 7.938 3.587 -16.490 1.00 0.00 O ATOM 1414 CB LEU A 95 7.940 5.776 -14.289 1.00 0.00 C ATOM 1415 CG LEU A 95 8.986 6.704 -14.918 1.00 0.00 C ATOM 1416 CD1 LEU A 95 8.524 8.154 -14.856 1.00 0.00 C ATOM 1417 CD2 LEU A 95 10.333 6.539 -14.229 1.00 0.00 C ATOM 0 H LEU A 95 5.549 5.588 -13.597 1.00 0.00 H new ATOM 0 HA LEU A 95 6.853 5.952 -16.122 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.483 6.289 -13.443 1.00 0.00 H new ATOM 0 HB3 LEU A 95 8.448 4.897 -13.893 1.00 0.00 H new ATOM 0 HG LEU A 95 9.103 6.428 -15.966 1.00 0.00 H new ATOM 0 HD11 LEU A 95 9.280 8.796 -15.307 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.586 8.260 -15.400 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.375 8.444 -13.816 1.00 0.00 H new ATOM 0 HD21 LEU A 95 11.062 7.206 -14.690 1.00 0.00 H new ATOM 0 HD22 LEU A 95 10.234 6.785 -13.172 1.00 0.00 H new ATOM 0 HD23 LEU A 95 10.670 5.507 -14.331 1.00 0.00 H new ATOM 1429 N ARG A 96 6.277 2.947 -15.083 1.00 0.00 N ATOM 1430 CA ARG A 96 6.361 1.515 -15.377 1.00 0.00 C ATOM 1431 C ARG A 96 7.819 1.047 -15.464 1.00 0.00 C ATOM 1432 O ARG A 96 8.263 0.551 -16.503 1.00 0.00 O ATOM 1433 CB ARG A 96 5.616 1.177 -16.681 1.00 0.00 C ATOM 1434 CG ARG A 96 6.012 2.038 -17.873 1.00 0.00 C ATOM 1435 CD ARG A 96 5.393 1.521 -19.164 1.00 0.00 C ATOM 1436 NE ARG A 96 6.382 1.388 -20.236 1.00 0.00 N ATOM 1437 CZ ARG A 96 6.859 2.416 -20.943 1.00 0.00 C ATOM 1438 NH1 ARG A 96 6.428 3.655 -20.712 1.00 0.00 N ATOM 1439 NH2 ARG A 96 7.770 2.205 -21.888 1.00 0.00 N ATOM 0 H ARG A 96 5.560 3.183 -14.397 1.00 0.00 H new ATOM 0 HA ARG A 96 5.882 0.984 -14.554 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.797 0.131 -16.928 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.545 1.284 -16.511 1.00 0.00 H new ATOM 0 HG2 ARG A 96 5.694 3.066 -17.702 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.098 2.052 -17.969 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.927 0.553 -18.980 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.602 2.200 -19.483 1.00 0.00 H new ATOM 0 HE ARG A 96 6.727 0.454 -20.456 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.728 3.825 -19.990 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.798 4.434 -21.257 1.00 0.00 H new ATOM 0 HH21 ARG A 96 8.104 1.259 -22.072 1.00 0.00 H new ATOM 0 HH22 ARG A 96 8.135 2.989 -22.429 1.00 0.00 H new ATOM 1453 N GLY A 97 8.559 1.212 -14.367 1.00 0.00 N ATOM 1454 CA GLY A 97 9.953 0.805 -14.338 1.00 0.00 C ATOM 1455 C GLY A 97 10.103 -0.689 -14.531 1.00 0.00 C ATOM 1456 O GLY A 97 10.042 -1.182 -15.658 1.00 0.00 O ATOM 0 H GLY A 97 8.216 1.621 -13.498 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.502 1.330 -15.120 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.397 1.096 -13.386 1.00 0.00 H new ATOM 1460 N ARG A 98 10.275 -1.416 -13.430 1.00 0.00 N ATOM 1461 CA ARG A 98 10.401 -2.866 -13.494 1.00 0.00 C ATOM 1462 C ARG A 98 9.540 -3.509 -12.410 1.00 0.00 C ATOM 1463 O ARG A 98 9.884 -3.482 -11.228 1.00 0.00 O ATOM 1464 CB ARG A 98 11.865 -3.301 -13.326 1.00 0.00 C ATOM 1465 CG ARG A 98 12.882 -2.336 -13.923 1.00 0.00 C ATOM 1466 CD ARG A 98 13.301 -1.277 -12.915 1.00 0.00 C ATOM 1467 NE ARG A 98 14.616 -1.550 -12.339 1.00 0.00 N ATOM 1468 CZ ARG A 98 15.771 -1.221 -12.926 1.00 0.00 C ATOM 1469 NH1 ARG A 98 15.781 -0.636 -14.121 1.00 0.00 N ATOM 1470 NH2 ARG A 98 16.922 -1.485 -12.316 1.00 0.00 N ATOM 0 H ARG A 98 10.330 -1.026 -12.489 1.00 0.00 H new ATOM 0 HA ARG A 98 10.058 -3.196 -14.474 1.00 0.00 H new ATOM 0 HB2 ARG A 98 12.076 -3.420 -12.263 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.996 -4.279 -13.789 1.00 0.00 H new ATOM 0 HG2 ARG A 98 13.759 -2.890 -14.257 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.456 -1.854 -14.803 1.00 0.00 H new ATOM 0 HD2 ARG A 98 13.315 -0.301 -13.401 1.00 0.00 H new ATOM 0 HD3 ARG A 98 12.561 -1.225 -12.117 1.00 0.00 H new ATOM 0 HE ARG A 98 14.655 -2.020 -11.435 1.00 0.00 H new ATOM 0 HH11 ARG A 98 14.902 -0.435 -14.598 1.00 0.00 H new ATOM 0 HH12 ARG A 98 16.668 -0.389 -14.560 1.00 0.00 H new ATOM 0 HH21 ARG A 98 16.923 -1.938 -11.402 1.00 0.00 H new ATOM 0 HH22 ARG A 98 17.805 -1.235 -12.762 1.00 0.00 H new ATOM 1484 N CYS A 99 8.420 -4.091 -12.827 1.00 0.00 N ATOM 1485 CA CYS A 99 7.507 -4.749 -11.898 1.00 0.00 C ATOM 1486 C CYS A 99 7.185 -6.163 -12.375 1.00 0.00 C ATOM 1487 O CYS A 99 7.055 -6.405 -13.576 1.00 0.00 O ATOM 1488 CB CYS A 99 6.221 -3.932 -11.748 1.00 0.00 C ATOM 1489 SG CYS A 99 5.229 -4.370 -10.300 1.00 0.00 S ATOM 0 H CYS A 99 8.123 -4.121 -13.802 1.00 0.00 H new ATOM 0 HA CYS A 99 7.993 -4.816 -10.925 1.00 0.00 H new ATOM 0 HB2 CYS A 99 6.480 -2.875 -11.691 1.00 0.00 H new ATOM 0 HB3 CYS A 99 5.614 -4.063 -12.644 1.00 0.00 H new ATOM 0 HG CYS A 99 4.165 -3.623 -10.261 1.00 0.00 H new ATOM 1495 N GLN A 100 7.060 -7.094 -11.432 1.00 0.00 N ATOM 1496 CA GLN A 100 6.756 -8.483 -11.770 1.00 0.00 C ATOM 1497 C GLN A 100 5.249 -8.725 -11.794 1.00 0.00 C ATOM 1498 O GLN A 100 4.727 -9.319 -12.737 1.00 0.00 O ATOM 1499 CB GLN A 100 7.424 -9.442 -10.779 1.00 0.00 C ATOM 1500 CG GLN A 100 7.979 -10.704 -11.428 1.00 0.00 C ATOM 1501 CD GLN A 100 9.189 -10.435 -12.307 1.00 0.00 C ATOM 1502 OE1 GLN A 100 9.702 -9.317 -12.351 1.00 0.00 O ATOM 1503 NE2 GLN A 100 9.655 -11.463 -13.009 1.00 0.00 N ATOM 0 H GLN A 100 7.164 -6.914 -10.433 1.00 0.00 H new ATOM 0 HA GLN A 100 7.153 -8.675 -12.767 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.234 -8.919 -10.271 1.00 0.00 H new ATOM 0 HB3 GLN A 100 6.699 -9.725 -10.016 1.00 0.00 H new ATOM 0 HG2 GLN A 100 8.253 -11.416 -10.650 1.00 0.00 H new ATOM 0 HG3 GLN A 100 7.198 -11.172 -12.027 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.200 -12.373 -12.944 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.468 -11.341 -13.613 1.00 0.00 H new ATOM 1512 N GLU A 101 4.554 -8.265 -10.750 1.00 0.00 N ATOM 1513 CA GLU A 101 3.104 -8.438 -10.655 1.00 0.00 C ATOM 1514 C GLU A 101 2.512 -7.542 -9.566 1.00 0.00 C ATOM 1515 O GLU A 101 3.242 -6.900 -8.806 1.00 0.00 O ATOM 1516 CB GLU A 101 2.769 -9.902 -10.358 1.00 0.00 C ATOM 1517 CG GLU A 101 1.604 -10.447 -11.175 1.00 0.00 C ATOM 1518 CD GLU A 101 0.806 -11.505 -10.430 1.00 0.00 C ATOM 1519 OE1 GLU A 101 1.414 -12.283 -9.664 1.00 0.00 O ATOM 1520 OE2 GLU A 101 -0.427 -11.556 -10.617 1.00 0.00 O ATOM 0 H GLU A 101 4.972 -7.771 -9.961 1.00 0.00 H new ATOM 0 HA GLU A 101 2.666 -8.151 -11.611 1.00 0.00 H new ATOM 0 HB2 GLU A 101 3.651 -10.512 -10.550 1.00 0.00 H new ATOM 0 HB3 GLU A 101 2.535 -10.003 -9.298 1.00 0.00 H new ATOM 0 HG2 GLU A 101 0.942 -9.625 -11.449 1.00 0.00 H new ATOM 0 HG3 GLU A 101 1.985 -10.872 -12.103 1.00 0.00 H new ATOM 1527 N ALA A 102 1.182 -7.512 -9.491 1.00 0.00 N ATOM 1528 CA ALA A 102 0.484 -6.708 -8.493 1.00 0.00 C ATOM 1529 C ALA A 102 -0.910 -7.271 -8.216 1.00 0.00 C ATOM 1530 O ALA A 102 -1.586 -7.757 -9.125 1.00 0.00 O ATOM 1531 CB ALA A 102 0.400 -5.259 -8.945 1.00 0.00 C ATOM 0 H ALA A 102 0.566 -8.037 -10.112 1.00 0.00 H new ATOM 0 HA ALA A 102 1.052 -6.747 -7.564 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.123 -4.672 -8.190 1.00 0.00 H new ATOM 0 HB2 ALA A 102 1.406 -4.861 -9.081 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -0.143 -5.203 -9.889 1.00 0.00 H new ATOM 1537 N TRP A 103 -1.327 -7.213 -6.954 1.00 0.00 N ATOM 1538 CA TRP A 103 -2.631 -7.729 -6.544 1.00 0.00 C ATOM 1539 C TRP A 103 -3.389 -6.708 -5.694 1.00 0.00 C ATOM 1540 O TRP A 103 -2.783 -5.921 -4.968 1.00 0.00 O ATOM 1541 CB TRP A 103 -2.442 -9.035 -5.767 1.00 0.00 C ATOM 1542 CG TRP A 103 -3.701 -9.580 -5.161 1.00 0.00 C ATOM 1543 CD1 TRP A 103 -4.158 -9.364 -3.895 1.00 0.00 C ATOM 1544 CD2 TRP A 103 -4.655 -10.441 -5.792 1.00 0.00 C ATOM 1545 NE1 TRP A 103 -5.337 -10.038 -3.698 1.00 0.00 N ATOM 1546 CE2 TRP A 103 -5.663 -10.705 -4.849 1.00 0.00 C ATOM 1547 CE3 TRP A 103 -4.755 -11.012 -7.063 1.00 0.00 C ATOM 1548 CZ2 TRP A 103 -6.757 -11.518 -5.135 1.00 0.00 C ATOM 1549 CZ3 TRP A 103 -5.842 -11.817 -7.347 1.00 0.00 C ATOM 1550 CH2 TRP A 103 -6.828 -12.065 -6.386 1.00 0.00 C ATOM 0 H TRP A 103 -0.778 -6.812 -6.194 1.00 0.00 H new ATOM 0 HA TRP A 103 -3.225 -7.921 -7.438 1.00 0.00 H new ATOM 0 HB2 TRP A 103 -2.021 -9.785 -6.437 1.00 0.00 H new ATOM 0 HB3 TRP A 103 -1.713 -8.870 -4.974 1.00 0.00 H new ATOM 0 HD1 TRP A 103 -3.664 -8.752 -3.155 1.00 0.00 H new ATOM 0 HE1 TRP A 103 -5.881 -10.042 -2.835 1.00 0.00 H new ATOM 0 HE3 TRP A 103 -3.997 -10.828 -7.810 1.00 0.00 H new ATOM 0 HZ2 TRP A 103 -7.521 -11.709 -4.396 1.00 0.00 H new ATOM 0 HZ3 TRP A 103 -5.932 -12.262 -8.327 1.00 0.00 H new ATOM 0 HH2 TRP A 103 -7.663 -12.702 -6.638 1.00 0.00 H new ATOM 1561 N VAL A 104 -4.719 -6.736 -5.784 1.00 0.00 N ATOM 1562 CA VAL A 104 -5.563 -5.819 -5.019 1.00 0.00 C ATOM 1563 C VAL A 104 -6.738 -6.563 -4.386 1.00 0.00 C ATOM 1564 O VAL A 104 -7.423 -7.341 -5.052 1.00 0.00 O ATOM 1565 CB VAL A 104 -6.106 -4.671 -5.895 1.00 0.00 C ATOM 1566 CG1 VAL A 104 -6.811 -3.626 -5.040 1.00 0.00 C ATOM 1567 CG2 VAL A 104 -4.986 -4.033 -6.706 1.00 0.00 C ATOM 0 H VAL A 104 -5.235 -7.384 -6.379 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.935 -5.392 -4.237 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.833 -5.091 -6.590 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.186 -2.826 -5.679 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.644 -4.090 -4.512 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -6.108 -3.213 -4.316 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -5.392 -3.226 -7.316 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.231 -3.632 -6.030 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.532 -4.784 -7.353 1.00 0.00 H new ATOM 1577 N LEU A 105 -6.963 -6.314 -3.097 1.00 0.00 N ATOM 1578 CA LEU A 105 -8.052 -6.953 -2.363 1.00 0.00 C ATOM 1579 C LEU A 105 -8.902 -5.917 -1.630 1.00 0.00 C ATOM 1580 O LEU A 105 -8.399 -5.165 -0.792 1.00 0.00 O ATOM 1581 CB LEU A 105 -7.495 -7.968 -1.361 1.00 0.00 C ATOM 1582 CG LEU A 105 -8.489 -9.032 -0.888 1.00 0.00 C ATOM 1583 CD1 LEU A 105 -7.778 -10.352 -0.640 1.00 0.00 C ATOM 1584 CD2 LEU A 105 -9.215 -8.570 0.370 1.00 0.00 C ATOM 0 H LEU A 105 -6.402 -5.671 -2.538 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.684 -7.471 -3.085 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -6.639 -8.469 -1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.124 -7.428 -0.490 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.230 -9.182 -1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.500 -11.097 -0.304 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -7.309 -10.692 -1.563 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -7.015 -10.216 0.126 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -9.916 -9.341 0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.489 -8.389 1.163 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -9.759 -7.649 0.159 1.00 0.00 H new ATOM 1596 N SER A 106 -10.195 -5.893 -1.947 1.00 0.00 N ATOM 1597 CA SER A 106 -11.126 -4.963 -1.317 1.00 0.00 C ATOM 1598 C SER A 106 -12.212 -5.722 -0.561 1.00 0.00 C ATOM 1599 O SER A 106 -12.727 -6.732 -1.047 1.00 0.00 O ATOM 1600 CB SER A 106 -11.760 -4.041 -2.363 1.00 0.00 C ATOM 1601 OG SER A 106 -11.851 -4.678 -3.627 1.00 0.00 O ATOM 0 H SER A 106 -10.621 -6.510 -2.639 1.00 0.00 H new ATOM 0 HA SER A 106 -10.567 -4.352 -0.608 1.00 0.00 H new ATOM 0 HB2 SER A 106 -12.755 -3.742 -2.032 1.00 0.00 H new ATOM 0 HB3 SER A 106 -11.168 -3.131 -2.454 1.00 0.00 H new ATOM 0 HG SER A 106 -12.261 -4.066 -4.273 1.00 0.00 H new ATOM 1607 N GLY A 107 -12.552 -5.234 0.630 1.00 0.00 N ATOM 1608 CA GLY A 107 -13.571 -5.881 1.437 1.00 0.00 C ATOM 1609 C GLY A 107 -13.956 -5.070 2.661 1.00 0.00 C ATOM 1610 O GLY A 107 -13.671 -3.872 2.736 1.00 0.00 O ATOM 0 H GLY A 107 -12.139 -4.401 1.050 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -14.458 -6.051 0.826 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -13.210 -6.859 1.754 1.00 0.00 H new ATOM 1614 N LYS A 108 -14.604 -5.731 3.620 1.00 0.00 N ATOM 1615 CA LYS A 108 -15.041 -5.082 4.855 1.00 0.00 C ATOM 1616 C LYS A 108 -15.008 -6.064 6.026 1.00 0.00 C ATOM 1617 O LYS A 108 -15.248 -7.260 5.850 1.00 0.00 O ATOM 1618 CB LYS A 108 -16.463 -4.530 4.694 1.00 0.00 C ATOM 1619 CG LYS A 108 -16.576 -3.376 3.708 1.00 0.00 C ATOM 1620 CD LYS A 108 -17.760 -3.559 2.770 1.00 0.00 C ATOM 1621 CE LYS A 108 -18.932 -2.676 3.167 1.00 0.00 C ATOM 1622 NZ LYS A 108 -19.868 -2.446 2.030 1.00 0.00 N ATOM 0 H LYS A 108 -14.839 -6.722 3.564 1.00 0.00 H new ATOM 0 HA LYS A 108 -14.355 -4.261 5.063 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -17.119 -5.337 4.368 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -16.824 -4.198 5.667 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -16.684 -2.439 4.254 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -15.657 -3.302 3.126 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -17.456 -3.324 1.750 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -18.072 -4.603 2.777 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -19.472 -3.140 3.993 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -18.558 -1.718 3.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -20.652 -1.839 2.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -19.360 -1.980 1.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -20.245 -3.358 1.701 1.00 0.00 H new ATOM 1636 N GLN A 109 -14.723 -5.546 7.221 1.00 0.00 N ATOM 1637 CA GLN A 109 -14.670 -6.368 8.430 1.00 0.00 C ATOM 1638 C GLN A 109 -15.500 -5.730 9.544 1.00 0.00 C ATOM 1639 O GLN A 109 -15.717 -4.518 9.540 1.00 0.00 O ATOM 1640 CB GLN A 109 -13.221 -6.550 8.892 1.00 0.00 C ATOM 1641 CG GLN A 109 -12.507 -5.242 9.207 1.00 0.00 C ATOM 1642 CD GLN A 109 -11.076 -5.219 8.700 1.00 0.00 C ATOM 1643 OE1 GLN A 109 -10.320 -6.169 8.899 1.00 0.00 O ATOM 1644 NE2 GLN A 109 -10.696 -4.129 8.040 1.00 0.00 N ATOM 0 H GLN A 109 -14.525 -4.558 7.378 1.00 0.00 H new ATOM 0 HA GLN A 109 -15.088 -7.348 8.198 1.00 0.00 H new ATOM 0 HB2 GLN A 109 -13.209 -7.182 9.780 1.00 0.00 H new ATOM 0 HB3 GLN A 109 -12.666 -7.078 8.117 1.00 0.00 H new ATOM 0 HG2 GLN A 109 -13.059 -4.415 8.761 1.00 0.00 H new ATOM 0 HG3 GLN A 109 -12.509 -5.082 10.285 1.00 0.00 H new ATOM 0 HE21 GLN A 109 -11.355 -3.364 7.897 1.00 0.00 H new ATOM 0 HE22 GLN A 109 -9.746 -4.058 7.677 1.00 0.00 H new ATOM 1653 N GLN A 110 -15.956 -6.542 10.504 1.00 0.00 N ATOM 1654 CA GLN A 110 -16.749 -6.024 11.614 1.00 0.00 C ATOM 1655 C GLN A 110 -15.857 -5.785 12.825 1.00 0.00 C ATOM 1656 O GLN A 110 -15.711 -6.658 13.681 1.00 0.00 O ATOM 1657 CB GLN A 110 -17.881 -6.992 11.969 1.00 0.00 C ATOM 1658 CG GLN A 110 -18.659 -6.595 13.213 1.00 0.00 C ATOM 1659 CD GLN A 110 -19.803 -7.545 13.516 1.00 0.00 C ATOM 1660 OE1 GLN A 110 -19.939 -8.597 12.890 1.00 0.00 O ATOM 1661 NE2 GLN A 110 -20.631 -7.179 14.487 1.00 0.00 N ATOM 0 H GLN A 110 -15.790 -7.548 10.532 1.00 0.00 H new ATOM 0 HA GLN A 110 -17.194 -5.076 11.310 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -18.569 -7.056 11.126 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -17.463 -7.988 12.116 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -17.981 -6.565 14.066 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -19.054 -5.587 13.084 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -20.481 -6.299 14.980 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -21.417 -7.778 14.740 1.00 0.00 H new ATOM 1670 N ILE A 111 -15.254 -4.603 12.891 1.00 0.00 N ATOM 1671 CA ILE A 111 -14.372 -4.278 14.001 1.00 0.00 C ATOM 1672 C ILE A 111 -15.167 -3.872 15.231 1.00 0.00 C ATOM 1673 O ILE A 111 -15.481 -2.700 15.445 1.00 0.00 O ATOM 1674 CB ILE A 111 -13.348 -3.187 13.631 1.00 0.00 C ATOM 1675 CG1 ILE A 111 -12.472 -2.845 14.840 1.00 0.00 C ATOM 1676 CG2 ILE A 111 -14.037 -1.940 13.085 1.00 0.00 C ATOM 1677 CD1 ILE A 111 -11.192 -2.130 14.471 1.00 0.00 C ATOM 0 H ILE A 111 -15.359 -3.863 12.197 1.00 0.00 H new ATOM 0 HA ILE A 111 -13.812 -5.183 14.235 1.00 0.00 H new ATOM 0 HB ILE A 111 -12.708 -3.579 12.841 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -13.043 -2.221 15.528 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -12.226 -3.764 15.372 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -13.287 -1.190 12.834 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -14.604 -2.200 12.191 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -14.713 -1.538 13.840 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -10.620 -1.918 15.374 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -10.601 -2.761 13.807 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -11.431 -1.195 13.965 1.00 0.00 H new ATOM 1689 N ALA A 112 -15.482 -4.877 16.036 1.00 0.00 N ATOM 1690 CA ALA A 112 -16.241 -4.684 17.269 1.00 0.00 C ATOM 1691 C ALA A 112 -15.434 -3.874 18.285 1.00 0.00 C ATOM 1692 O ALA A 112 -14.203 -3.887 18.263 1.00 0.00 O ATOM 1693 CB ALA A 112 -16.633 -6.031 17.857 1.00 0.00 C ATOM 0 H ALA A 112 -15.221 -5.846 15.856 1.00 0.00 H new ATOM 0 HA ALA A 112 -17.146 -4.125 17.032 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -17.198 -5.876 18.776 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -17.247 -6.576 17.140 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -15.734 -6.607 18.077 1.00 0.00 H new ATOM 1800 N ALA A 119 -21.404 -2.751 15.425 1.00 0.00 N ATOM 1801 CA ALA A 119 -20.803 -3.240 14.189 1.00 0.00 C ATOM 1802 C ALA A 119 -20.467 -2.086 13.249 1.00 0.00 C ATOM 1803 O ALA A 119 -21.089 -1.023 13.304 1.00 0.00 O ATOM 1804 CB ALA A 119 -21.735 -4.228 13.505 1.00 0.00 C ATOM 0 HA ALA A 119 -19.874 -3.750 14.441 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -21.274 -4.585 12.584 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -21.921 -5.072 14.169 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.679 -3.736 13.271 1.00 0.00 H new ATOM 1810 N LYS A 120 -19.475 -2.302 12.384 1.00 0.00 N ATOM 1811 CA LYS A 120 -19.051 -1.282 11.429 1.00 0.00 C ATOM 1812 C LYS A 120 -18.440 -1.921 10.185 1.00 0.00 C ATOM 1813 O LYS A 120 -17.326 -2.444 10.235 1.00 0.00 O ATOM 1814 CB LYS A 120 -18.033 -0.339 12.075 1.00 0.00 C ATOM 1815 CG LYS A 120 -18.118 1.093 11.568 1.00 0.00 C ATOM 1816 CD LYS A 120 -17.097 1.987 12.253 1.00 0.00 C ATOM 1817 CE LYS A 120 -17.591 2.457 13.613 1.00 0.00 C ATOM 1818 NZ LYS A 120 -16.550 3.230 14.347 1.00 0.00 N ATOM 0 H LYS A 120 -18.951 -3.175 12.327 1.00 0.00 H new ATOM 0 HA LYS A 120 -19.932 -0.712 11.132 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -18.182 -0.342 13.155 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -17.029 -0.721 11.891 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -17.953 1.109 10.491 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -19.121 1.483 11.743 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.159 1.445 12.373 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -16.887 2.851 11.622 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.478 3.077 13.482 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -17.890 1.594 14.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -16.927 3.532 15.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -15.713 2.631 14.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -16.283 4.067 13.791 1.00 0.00 H new ATOM 1832 N ASP A 121 -19.170 -1.869 9.071 1.00 0.00 N ATOM 1833 CA ASP A 121 -18.693 -2.437 7.812 1.00 0.00 C ATOM 1834 C ASP A 121 -17.667 -1.507 7.161 1.00 0.00 C ATOM 1835 O ASP A 121 -17.905 -0.950 6.085 1.00 0.00 O ATOM 1836 CB ASP A 121 -19.868 -2.687 6.858 1.00 0.00 C ATOM 1837 CG ASP A 121 -20.341 -4.129 6.879 1.00 0.00 C ATOM 1838 OD1 ASP A 121 -20.856 -4.571 7.930 1.00 0.00 O ATOM 1839 OD2 ASP A 121 -20.200 -4.815 5.845 1.00 0.00 O ATOM 0 H ASP A 121 -20.093 -1.439 9.016 1.00 0.00 H new ATOM 0 HA ASP A 121 -18.210 -3.391 8.025 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -20.697 -2.033 7.129 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -19.570 -2.421 5.844 1.00 0.00 H new ATOM 1844 N VAL A 122 -16.528 -1.343 7.829 1.00 0.00 N ATOM 1845 CA VAL A 122 -15.460 -0.478 7.333 1.00 0.00 C ATOM 1846 C VAL A 122 -14.868 -1.026 6.036 1.00 0.00 C ATOM 1847 O VAL A 122 -14.439 -2.179 5.976 1.00 0.00 O ATOM 1848 CB VAL A 122 -14.334 -0.308 8.377 1.00 0.00 C ATOM 1849 CG1 VAL A 122 -14.783 0.617 9.501 1.00 0.00 C ATOM 1850 CG2 VAL A 122 -13.898 -1.660 8.931 1.00 0.00 C ATOM 0 H VAL A 122 -16.320 -1.799 8.717 1.00 0.00 H new ATOM 0 HA VAL A 122 -15.907 0.497 7.140 1.00 0.00 H new ATOM 0 HB VAL A 122 -13.475 0.145 7.882 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -13.977 0.725 10.227 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -15.034 1.595 9.089 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -15.659 0.194 9.992 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -13.104 -1.514 9.664 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -14.747 -2.149 9.408 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -13.530 -2.285 8.117 1.00 0.00 H new ATOM 1860 N THR A 123 -14.848 -0.188 5.000 1.00 0.00 N ATOM 1861 CA THR A 123 -14.309 -0.583 3.704 1.00 0.00 C ATOM 1862 C THR A 123 -12.835 -0.209 3.608 1.00 0.00 C ATOM 1863 O THR A 123 -12.454 0.927 3.900 1.00 0.00 O ATOM 1864 CB THR A 123 -15.094 0.078 2.563 1.00 0.00 C ATOM 1865 OG1 THR A 123 -16.414 0.405 2.970 1.00 0.00 O ATOM 1866 CG2 THR A 123 -15.194 -0.786 1.327 1.00 0.00 C ATOM 0 H THR A 123 -15.200 0.769 5.035 1.00 0.00 H new ATOM 0 HA THR A 123 -14.407 -1.664 3.610 1.00 0.00 H new ATOM 0 HB THR A 123 -14.530 0.977 2.316 1.00 0.00 H new ATOM 0 HG1 THR A 123 -16.891 0.826 2.225 1.00 0.00 H new ATOM 0 HG21 THR A 123 -15.761 -0.259 0.560 1.00 0.00 H new ATOM 0 HG22 THR A 123 -14.193 -1.004 0.953 1.00 0.00 H new ATOM 0 HG23 THR A 123 -15.700 -1.719 1.575 1.00 0.00 H new ATOM 1874 N LEU A 124 -12.007 -1.167 3.199 1.00 0.00 N ATOM 1875 CA LEU A 124 -10.574 -0.928 3.067 1.00 0.00 C ATOM 1876 C LEU A 124 -10.052 -1.409 1.716 1.00 0.00 C ATOM 1877 O LEU A 124 -10.604 -2.331 1.113 1.00 0.00 O ATOM 1878 CB LEU A 124 -9.802 -1.587 4.226 1.00 0.00 C ATOM 1879 CG LEU A 124 -9.582 -3.108 4.136 1.00 0.00 C ATOM 1880 CD1 LEU A 124 -10.884 -3.839 3.841 1.00 0.00 C ATOM 1881 CD2 LEU A 124 -8.526 -3.442 3.090 1.00 0.00 C ATOM 0 H LEU A 124 -12.303 -2.112 2.954 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.409 0.148 3.117 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -8.827 -1.106 4.301 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -10.334 -1.375 5.153 1.00 0.00 H new ATOM 0 HG LEU A 124 -9.222 -3.449 5.107 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -10.695 -4.911 3.784 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -11.602 -3.639 4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -11.289 -3.491 2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -8.388 -4.522 3.045 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.850 -3.076 2.116 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.583 -2.967 3.360 1.00 0.00 H new ATOM 1893 N HIS A 125 -8.981 -0.769 1.253 1.00 0.00 N ATOM 1894 CA HIS A 125 -8.363 -1.113 -0.022 1.00 0.00 C ATOM 1895 C HIS A 125 -6.876 -1.388 0.165 1.00 0.00 C ATOM 1896 O HIS A 125 -6.095 -0.469 0.423 1.00 0.00 O ATOM 1897 CB HIS A 125 -8.565 0.020 -1.033 1.00 0.00 C ATOM 1898 CG HIS A 125 -9.095 -0.446 -2.352 1.00 0.00 C ATOM 1899 ND1 HIS A 125 -10.440 -0.627 -2.600 1.00 0.00 N ATOM 1900 CD2 HIS A 125 -8.456 -0.775 -3.499 1.00 0.00 C ATOM 1901 CE1 HIS A 125 -10.603 -1.049 -3.841 1.00 0.00 C ATOM 1902 NE2 HIS A 125 -9.415 -1.146 -4.406 1.00 0.00 N ATOM 0 H HIS A 125 -8.521 -0.004 1.747 1.00 0.00 H new ATOM 0 HA HIS A 125 -8.840 -2.015 -0.405 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -9.253 0.753 -0.612 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -7.614 0.529 -1.191 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -7.390 -0.750 -3.668 1.00 0.00 H new ATOM 0 HE1 HIS A 125 -11.548 -1.276 -4.313 1.00 0.00 H new ATOM 0 HE2 HIS A 125 -9.238 -1.448 -5.364 1.00 0.00 H new ATOM 1911 N GLN A 126 -6.491 -2.656 0.043 1.00 0.00 N ATOM 1912 CA GLN A 126 -5.095 -3.049 0.208 1.00 0.00 C ATOM 1913 C GLN A 126 -4.517 -3.602 -1.092 1.00 0.00 C ATOM 1914 O GLN A 126 -5.163 -4.388 -1.789 1.00 0.00 O ATOM 1915 CB GLN A 126 -4.955 -4.078 1.334 1.00 0.00 C ATOM 1916 CG GLN A 126 -5.855 -5.295 1.177 1.00 0.00 C ATOM 1917 CD GLN A 126 -5.124 -6.599 1.439 1.00 0.00 C ATOM 1918 OE1 GLN A 126 -4.743 -7.306 0.507 1.00 0.00 O ATOM 1919 NE2 GLN A 126 -4.923 -6.924 2.712 1.00 0.00 N ATOM 0 H GLN A 126 -7.125 -3.427 -0.169 1.00 0.00 H new ATOM 0 HA GLN A 126 -4.528 -2.157 0.476 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -3.918 -4.410 1.382 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -5.179 -3.594 2.285 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -6.697 -5.211 1.864 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -6.267 -5.310 0.168 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.256 -6.308 3.454 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -4.436 -7.789 2.947 1.00 0.00 H new ATOM 1928 N ALA A 127 -3.293 -3.185 -1.406 1.00 0.00 N ATOM 1929 CA ALA A 127 -2.608 -3.631 -2.616 1.00 0.00 C ATOM 1930 C ALA A 127 -1.356 -4.432 -2.270 1.00 0.00 C ATOM 1931 O ALA A 127 -0.732 -4.203 -1.233 1.00 0.00 O ATOM 1932 CB ALA A 127 -2.249 -2.436 -3.487 1.00 0.00 C ATOM 0 H ALA A 127 -2.753 -2.535 -0.835 1.00 0.00 H new ATOM 0 HA ALA A 127 -3.283 -4.282 -3.171 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -1.739 -2.781 -4.386 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -3.158 -1.904 -3.767 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -1.593 -1.766 -2.932 1.00 0.00 H new ATOM 1938 N LEU A 128 -0.999 -5.378 -3.139 1.00 0.00 N ATOM 1939 CA LEU A 128 0.173 -6.221 -2.928 1.00 0.00 C ATOM 1940 C LEU A 128 1.127 -6.149 -4.120 1.00 0.00 C ATOM 1941 O LEU A 128 0.748 -6.474 -5.247 1.00 0.00 O ATOM 1942 CB LEU A 128 -0.258 -7.674 -2.692 1.00 0.00 C ATOM 1943 CG LEU A 128 -0.188 -8.153 -1.238 1.00 0.00 C ATOM 1944 CD1 LEU A 128 1.176 -7.853 -0.640 1.00 0.00 C ATOM 1945 CD2 LEU A 128 -1.291 -7.510 -0.410 1.00 0.00 C ATOM 0 H LEU A 128 -1.509 -5.579 -3.999 1.00 0.00 H new ATOM 0 HA LEU A 128 0.699 -5.853 -2.047 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -1.282 -7.794 -3.047 1.00 0.00 H new ATOM 0 HB3 LEU A 128 0.369 -8.325 -3.302 1.00 0.00 H new ATOM 0 HG LEU A 128 -0.335 -9.233 -1.225 1.00 0.00 H new ATOM 0 HD11 LEU A 128 1.205 -8.201 0.393 1.00 0.00 H new ATOM 0 HD12 LEU A 128 1.947 -8.364 -1.217 1.00 0.00 H new ATOM 0 HD13 LEU A 128 1.356 -6.778 -0.666 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -1.225 -7.862 0.619 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -1.177 -6.426 -0.431 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -2.262 -7.781 -0.825 1.00 0.00 H new ATOM 1957 N LEU A 129 2.364 -5.728 -3.861 1.00 0.00 N ATOM 1958 CA LEU A 129 3.382 -5.619 -4.905 1.00 0.00 C ATOM 1959 C LEU A 129 4.460 -6.685 -4.713 1.00 0.00 C ATOM 1960 O LEU A 129 4.794 -7.043 -3.582 1.00 0.00 O ATOM 1961 CB LEU A 129 4.019 -4.223 -4.887 1.00 0.00 C ATOM 1962 CG LEU A 129 3.498 -3.240 -5.942 1.00 0.00 C ATOM 1963 CD1 LEU A 129 3.695 -3.799 -7.344 1.00 0.00 C ATOM 1964 CD2 LEU A 129 2.032 -2.911 -5.697 1.00 0.00 C ATOM 0 H LEU A 129 2.687 -5.456 -2.932 1.00 0.00 H new ATOM 0 HA LEU A 129 2.901 -5.775 -5.870 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.863 -3.785 -3.901 1.00 0.00 H new ATOM 0 HB3 LEU A 129 5.095 -4.333 -5.020 1.00 0.00 H new ATOM 0 HG LEU A 129 4.073 -2.318 -5.858 1.00 0.00 H new ATOM 0 HD11 LEU A 129 3.318 -3.085 -8.077 1.00 0.00 H new ATOM 0 HD12 LEU A 129 4.756 -3.974 -7.520 1.00 0.00 H new ATOM 0 HD13 LEU A 129 3.152 -4.739 -7.441 1.00 0.00 H new ATOM 0 HD21 LEU A 129 1.684 -2.212 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.441 -3.825 -5.747 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.920 -2.460 -4.711 1.00 0.00 H new ATOM 1976 N ARG A 130 5.001 -7.189 -5.823 1.00 0.00 N ATOM 1977 CA ARG A 130 6.042 -8.214 -5.769 1.00 0.00 C ATOM 1978 C ARG A 130 7.153 -7.926 -6.779 1.00 0.00 C ATOM 1979 O ARG A 130 6.944 -8.019 -7.990 1.00 0.00 O ATOM 1980 CB ARG A 130 5.443 -9.599 -6.032 1.00 0.00 C ATOM 1981 CG ARG A 130 6.394 -10.744 -5.715 1.00 0.00 C ATOM 1982 CD ARG A 130 7.082 -11.265 -6.969 1.00 0.00 C ATOM 1983 NE ARG A 130 6.813 -12.684 -7.199 1.00 0.00 N ATOM 1984 CZ ARG A 130 7.442 -13.424 -8.114 1.00 0.00 C ATOM 1985 NH1 ARG A 130 8.396 -12.892 -8.874 1.00 0.00 N ATOM 1986 NH2 ARG A 130 7.122 -14.705 -8.268 1.00 0.00 N ATOM 0 H ARG A 130 4.736 -6.905 -6.766 1.00 0.00 H new ATOM 0 HA ARG A 130 6.475 -8.197 -4.769 1.00 0.00 H new ATOM 0 HB2 ARG A 130 4.538 -9.714 -5.435 1.00 0.00 H new ATOM 0 HB3 ARG A 130 5.145 -9.664 -7.079 1.00 0.00 H new ATOM 0 HG2 ARG A 130 7.145 -10.407 -5.001 1.00 0.00 H new ATOM 0 HG3 ARG A 130 5.842 -11.554 -5.239 1.00 0.00 H new ATOM 0 HD2 ARG A 130 6.746 -10.689 -7.831 1.00 0.00 H new ATOM 0 HD3 ARG A 130 8.157 -11.111 -6.882 1.00 0.00 H new ATOM 0 HE ARG A 130 6.101 -13.136 -6.625 1.00 0.00 H new ATOM 0 HH11 ARG A 130 8.652 -11.911 -8.760 1.00 0.00 H new ATOM 0 HH12 ARG A 130 8.872 -13.465 -9.571 1.00 0.00 H new ATOM 0 HH21 ARG A 130 6.395 -15.123 -7.687 1.00 0.00 H new ATOM 0 HH22 ARG A 130 7.603 -15.270 -8.968 1.00 0.00 H new ATOM 2000 N LEU A 131 8.334 -7.584 -6.266 1.00 0.00 N ATOM 2001 CA LEU A 131 9.490 -7.290 -7.111 1.00 0.00 C ATOM 2002 C LEU A 131 10.628 -8.264 -6.804 1.00 0.00 C ATOM 2003 O LEU A 131 10.971 -8.474 -5.638 1.00 0.00 O ATOM 2004 CB LEU A 131 9.962 -5.848 -6.897 1.00 0.00 C ATOM 2005 CG LEU A 131 8.896 -4.769 -7.117 1.00 0.00 C ATOM 2006 CD1 LEU A 131 7.995 -4.643 -5.896 1.00 0.00 C ATOM 2007 CD2 LEU A 131 9.552 -3.435 -7.441 1.00 0.00 C ATOM 0 H LEU A 131 8.515 -7.504 -5.266 1.00 0.00 H new ATOM 0 HA LEU A 131 9.193 -7.407 -8.153 1.00 0.00 H new ATOM 0 HB2 LEU A 131 10.344 -5.756 -5.880 1.00 0.00 H new ATOM 0 HB3 LEU A 131 10.797 -5.653 -7.570 1.00 0.00 H new ATOM 0 HG LEU A 131 8.277 -5.065 -7.964 1.00 0.00 H new ATOM 0 HD11 LEU A 131 7.246 -3.871 -6.075 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.498 -5.595 -5.711 1.00 0.00 H new ATOM 0 HD13 LEU A 131 8.595 -4.372 -5.027 1.00 0.00 H new ATOM 0 HD21 LEU A 131 8.782 -2.679 -7.595 1.00 0.00 H new ATOM 0 HD22 LEU A 131 10.195 -3.135 -6.614 1.00 0.00 H new ATOM 0 HD23 LEU A 131 10.149 -3.534 -8.347 1.00 0.00 H new ATOM 2019 N PRO A 132 11.223 -8.887 -7.843 1.00 0.00 N ATOM 2020 CA PRO A 132 12.315 -9.856 -7.667 1.00 0.00 C ATOM 2021 C PRO A 132 13.684 -9.212 -7.400 1.00 0.00 C ATOM 2022 O PRO A 132 14.698 -9.908 -7.364 1.00 0.00 O ATOM 2023 CB PRO A 132 12.327 -10.595 -9.003 1.00 0.00 C ATOM 2024 CG PRO A 132 11.866 -9.581 -9.992 1.00 0.00 C ATOM 2025 CD PRO A 132 10.868 -8.714 -9.268 1.00 0.00 C ATOM 0 HA PRO A 132 12.149 -10.488 -6.794 1.00 0.00 H new ATOM 0 HB2 PRO A 132 13.325 -10.961 -9.245 1.00 0.00 H new ATOM 0 HB3 PRO A 132 11.665 -11.461 -8.984 1.00 0.00 H new ATOM 0 HG2 PRO A 132 12.703 -8.988 -10.360 1.00 0.00 H new ATOM 0 HG3 PRO A 132 11.410 -10.061 -10.858 1.00 0.00 H new ATOM 0 HD2 PRO A 132 10.945 -7.671 -9.576 1.00 0.00 H new ATOM 0 HD3 PRO A 132 9.844 -9.030 -9.467 1.00 0.00 H new ATOM 2033 N GLN A 133 13.711 -7.888 -7.203 1.00 0.00 N ATOM 2034 CA GLN A 133 14.961 -7.171 -6.928 1.00 0.00 C ATOM 2035 C GLN A 133 15.729 -7.832 -5.779 1.00 0.00 C ATOM 2036 O GLN A 133 16.959 -7.898 -5.795 1.00 0.00 O ATOM 2037 CB GLN A 133 14.659 -5.704 -6.590 1.00 0.00 C ATOM 2038 CG GLN A 133 15.816 -4.750 -6.844 1.00 0.00 C ATOM 2039 CD GLN A 133 16.298 -4.766 -8.284 1.00 0.00 C ATOM 2040 OE1 GLN A 133 15.569 -5.166 -9.193 1.00 0.00 O ATOM 2041 NE2 GLN A 133 17.534 -4.326 -8.501 1.00 0.00 N ATOM 0 H GLN A 133 12.883 -7.293 -7.229 1.00 0.00 H new ATOM 0 HA GLN A 133 15.585 -7.211 -7.821 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.800 -5.378 -7.176 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.373 -5.637 -5.540 1.00 0.00 H new ATOM 0 HG2 GLN A 133 15.508 -3.738 -6.582 1.00 0.00 H new ATOM 0 HG3 GLN A 133 16.645 -5.012 -6.187 1.00 0.00 H new ATOM 0 HE21 GLN A 133 18.105 -4.003 -7.720 1.00 0.00 H new ATOM 0 HE22 GLN A 133 17.911 -4.311 -9.449 1.00 0.00 H new ATOM 2050 N TYR A 134 14.984 -8.319 -4.787 1.00 0.00 N ATOM 2051 CA TYR A 134 15.566 -8.983 -3.617 1.00 0.00 C ATOM 2052 C TYR A 134 14.459 -9.551 -2.724 1.00 0.00 C ATOM 2053 O TYR A 134 14.541 -9.476 -1.495 1.00 0.00 O ATOM 2054 CB TYR A 134 16.442 -8.007 -2.812 1.00 0.00 C ATOM 2055 CG TYR A 134 15.964 -6.572 -2.857 1.00 0.00 C ATOM 2056 CD1 TYR A 134 14.614 -6.265 -2.749 1.00 0.00 C ATOM 2057 CD2 TYR A 134 16.863 -5.529 -3.014 1.00 0.00 C ATOM 2058 CE1 TYR A 134 14.175 -4.960 -2.794 1.00 0.00 C ATOM 2059 CE2 TYR A 134 16.433 -4.218 -3.061 1.00 0.00 C ATOM 2060 CZ TYR A 134 15.087 -3.940 -2.952 1.00 0.00 C ATOM 2061 OH TYR A 134 14.653 -2.633 -3.002 1.00 0.00 O ATOM 0 H TYR A 134 13.966 -8.266 -4.770 1.00 0.00 H new ATOM 0 HA TYR A 134 16.195 -9.801 -3.969 1.00 0.00 H new ATOM 0 HB2 TYR A 134 16.475 -8.336 -1.773 1.00 0.00 H new ATOM 0 HB3 TYR A 134 17.462 -8.052 -3.193 1.00 0.00 H new ATOM 0 HD1 TYR A 134 13.896 -7.063 -2.628 1.00 0.00 H new ATOM 0 HD2 TYR A 134 17.918 -5.745 -3.101 1.00 0.00 H new ATOM 0 HE1 TYR A 134 13.122 -4.738 -2.706 1.00 0.00 H new ATOM 0 HE2 TYR A 134 17.146 -3.416 -3.182 1.00 0.00 H new ATOM 0 HH TYR A 134 15.423 -2.037 -3.116 1.00 0.00 H new ATOM 2071 N GLN A 135 13.414 -10.104 -3.350 1.00 0.00 N ATOM 2072 CA GLN A 135 12.279 -10.665 -2.618 1.00 0.00 C ATOM 2073 C GLN A 135 11.649 -9.595 -1.726 1.00 0.00 C ATOM 2074 O GLN A 135 11.870 -9.567 -0.514 1.00 0.00 O ATOM 2075 CB GLN A 135 12.719 -11.870 -1.779 1.00 0.00 C ATOM 2076 CG GLN A 135 12.540 -13.206 -2.487 1.00 0.00 C ATOM 2077 CD GLN A 135 13.622 -13.474 -3.516 1.00 0.00 C ATOM 2078 OE1 GLN A 135 14.590 -14.184 -3.245 1.00 0.00 O ATOM 2079 NE2 GLN A 135 13.464 -12.907 -4.709 1.00 0.00 N ATOM 0 H GLN A 135 13.333 -10.174 -4.364 1.00 0.00 H new ATOM 0 HA GLN A 135 11.535 -11.005 -3.338 1.00 0.00 H new ATOM 0 HB2 GLN A 135 13.768 -11.750 -1.509 1.00 0.00 H new ATOM 0 HB3 GLN A 135 12.150 -11.882 -0.850 1.00 0.00 H new ATOM 0 HG2 GLN A 135 12.541 -14.007 -1.748 1.00 0.00 H new ATOM 0 HG3 GLN A 135 11.566 -13.225 -2.976 1.00 0.00 H new ATOM 0 HE21 GLN A 135 12.647 -12.325 -4.893 1.00 0.00 H new ATOM 0 HE22 GLN A 135 14.160 -13.054 -5.440 1.00 0.00 H new ATOM 2088 N THR A 136 10.872 -8.703 -2.339 1.00 0.00 N ATOM 2089 CA THR A 136 10.223 -7.620 -1.606 1.00 0.00 C ATOM 2090 C THR A 136 8.705 -7.643 -1.809 1.00 0.00 C ATOM 2091 O THR A 136 8.210 -8.156 -2.816 1.00 0.00 O ATOM 2092 CB THR A 136 10.798 -6.273 -2.055 1.00 0.00 C ATOM 2093 OG1 THR A 136 10.282 -5.208 -1.271 1.00 0.00 O ATOM 2094 CG2 THR A 136 10.521 -5.956 -3.509 1.00 0.00 C ATOM 0 H THR A 136 10.678 -8.710 -3.340 1.00 0.00 H new ATOM 0 HA THR A 136 10.419 -7.760 -0.543 1.00 0.00 H new ATOM 0 HB THR A 136 11.876 -6.367 -1.920 1.00 0.00 H new ATOM 0 HG1 THR A 136 10.666 -4.360 -1.577 1.00 0.00 H new ATOM 0 HG21 THR A 136 10.956 -4.988 -3.760 1.00 0.00 H new ATOM 0 HG22 THR A 136 10.963 -6.727 -4.140 1.00 0.00 H new ATOM 0 HG23 THR A 136 9.444 -5.924 -3.676 1.00 0.00 H new ATOM 2102 N ASP A 137 7.974 -7.081 -0.843 1.00 0.00 N ATOM 2103 CA ASP A 137 6.518 -7.035 -0.911 1.00 0.00 C ATOM 2104 C ASP A 137 5.977 -5.696 -0.398 1.00 0.00 C ATOM 2105 O ASP A 137 5.926 -5.459 0.812 1.00 0.00 O ATOM 2106 CB ASP A 137 5.919 -8.188 -0.100 1.00 0.00 C ATOM 2107 CG ASP A 137 5.027 -9.088 -0.936 1.00 0.00 C ATOM 2108 OD1 ASP A 137 5.508 -9.618 -1.961 1.00 0.00 O ATOM 2109 OD2 ASP A 137 3.851 -9.267 -0.561 1.00 0.00 O ATOM 0 H ASP A 137 8.370 -6.653 -0.006 1.00 0.00 H new ATOM 0 HA ASP A 137 6.226 -7.138 -1.956 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.725 -8.781 0.331 1.00 0.00 H new ATOM 0 HB3 ASP A 137 5.342 -7.782 0.731 1.00 0.00 H new ATOM 2114 N LEU A 138 5.563 -4.828 -1.325 1.00 0.00 N ATOM 2115 CA LEU A 138 5.013 -3.516 -0.971 1.00 0.00 C ATOM 2116 C LEU A 138 3.496 -3.598 -0.815 1.00 0.00 C ATOM 2117 O LEU A 138 2.789 -3.983 -1.748 1.00 0.00 O ATOM 2118 CB LEU A 138 5.370 -2.474 -2.037 1.00 0.00 C ATOM 2119 CG LEU A 138 6.684 -1.725 -1.803 1.00 0.00 C ATOM 2120 CD1 LEU A 138 7.418 -1.509 -3.118 1.00 0.00 C ATOM 2121 CD2 LEU A 138 6.425 -0.397 -1.106 1.00 0.00 C ATOM 0 H LEU A 138 5.598 -5.010 -2.328 1.00 0.00 H new ATOM 0 HA LEU A 138 5.451 -3.210 -0.021 1.00 0.00 H new ATOM 0 HB2 LEU A 138 5.422 -2.972 -3.005 1.00 0.00 H new ATOM 0 HB3 LEU A 138 4.561 -1.746 -2.096 1.00 0.00 H new ATOM 0 HG LEU A 138 7.316 -2.333 -1.156 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.350 -0.975 -2.931 1.00 0.00 H new ATOM 0 HD12 LEU A 138 7.638 -2.474 -3.575 1.00 0.00 H new ATOM 0 HD13 LEU A 138 6.793 -0.923 -3.792 1.00 0.00 H new ATOM 0 HD21 LEU A 138 7.371 0.121 -0.948 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.773 0.218 -1.726 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.945 -0.578 -0.144 1.00 0.00 H new ATOM 2133 N LEU A 139 3.002 -3.238 0.369 1.00 0.00 N ATOM 2134 CA LEU A 139 1.569 -3.276 0.653 1.00 0.00 C ATOM 2135 C LEU A 139 1.007 -1.873 0.882 1.00 0.00 C ATOM 2136 O LEU A 139 1.745 -0.940 1.201 1.00 0.00 O ATOM 2137 CB LEU A 139 1.297 -4.151 1.882 1.00 0.00 C ATOM 2138 CG LEU A 139 0.159 -5.163 1.724 1.00 0.00 C ATOM 2139 CD1 LEU A 139 0.496 -6.461 2.444 1.00 0.00 C ATOM 2140 CD2 LEU A 139 -1.152 -4.587 2.246 1.00 0.00 C ATOM 0 H LEU A 139 3.575 -2.916 1.149 1.00 0.00 H new ATOM 0 HA LEU A 139 1.069 -3.704 -0.216 1.00 0.00 H new ATOM 0 HB2 LEU A 139 2.210 -4.691 2.132 1.00 0.00 H new ATOM 0 HB3 LEU A 139 1.069 -3.501 2.727 1.00 0.00 H new ATOM 0 HG LEU A 139 0.038 -5.378 0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -0.324 -7.169 2.321 1.00 0.00 H new ATOM 0 HD12 LEU A 139 1.407 -6.885 2.022 1.00 0.00 H new ATOM 0 HD13 LEU A 139 0.646 -6.260 3.505 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -1.947 -5.323 2.124 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -1.046 -4.339 3.302 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -1.402 -3.686 1.686 1.00 0.00 H new ATOM 2152 N LEU A 140 -0.310 -1.736 0.722 1.00 0.00 N ATOM 2153 CA LEU A 140 -0.987 -0.454 0.920 1.00 0.00 C ATOM 2154 C LEU A 140 -2.269 -0.641 1.732 1.00 0.00 C ATOM 2155 O LEU A 140 -2.844 -1.731 1.752 1.00 0.00 O ATOM 2156 CB LEU A 140 -1.308 0.198 -0.426 1.00 0.00 C ATOM 2157 CG LEU A 140 -0.095 0.748 -1.177 1.00 0.00 C ATOM 2158 CD1 LEU A 140 -0.269 0.576 -2.677 1.00 0.00 C ATOM 2159 CD2 LEU A 140 0.133 2.212 -0.827 1.00 0.00 C ATOM 0 H LEU A 140 -0.931 -2.500 0.455 1.00 0.00 H new ATOM 0 HA LEU A 140 -0.316 0.202 1.475 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -1.808 -0.535 -1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -2.015 1.011 -0.261 1.00 0.00 H new ATOM 0 HG LEU A 140 0.784 0.181 -0.869 1.00 0.00 H new ATOM 0 HD11 LEU A 140 0.605 0.974 -3.193 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -0.378 -0.483 -2.912 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -1.159 1.114 -3.004 1.00 0.00 H new ATOM 0 HD21 LEU A 140 1.000 2.585 -1.371 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -0.747 2.793 -1.103 1.00 0.00 H new ATOM 0 HD23 LEU A 140 0.309 2.307 0.245 1.00 0.00 H new ATOM 2171 N THR A 141 -2.707 0.421 2.406 1.00 0.00 N ATOM 2172 CA THR A 141 -3.916 0.364 3.228 1.00 0.00 C ATOM 2173 C THR A 141 -4.726 1.655 3.115 1.00 0.00 C ATOM 2174 O THR A 141 -4.299 2.709 3.589 1.00 0.00 O ATOM 2175 CB THR A 141 -3.553 0.106 4.695 1.00 0.00 C ATOM 2176 OG1 THR A 141 -2.448 -0.777 4.795 1.00 0.00 O ATOM 2177 CG2 THR A 141 -4.690 -0.490 5.496 1.00 0.00 C ATOM 0 H THR A 141 -2.244 1.330 2.400 1.00 0.00 H new ATOM 0 HA THR A 141 -4.529 -0.458 2.859 1.00 0.00 H new ATOM 0 HB THR A 141 -3.312 1.086 5.107 1.00 0.00 H new ATOM 0 HG1 THR A 141 -2.233 -0.926 5.739 1.00 0.00 H new ATOM 0 HG21 THR A 141 -4.367 -0.648 6.525 1.00 0.00 H new ATOM 0 HG22 THR A 141 -5.541 0.192 5.483 1.00 0.00 H new ATOM 0 HG23 THR A 141 -4.983 -1.444 5.058 1.00 0.00 H new ATOM 2185 N PHE A 142 -5.899 1.561 2.490 1.00 0.00 N ATOM 2186 CA PHE A 142 -6.777 2.716 2.319 1.00 0.00 C ATOM 2187 C PHE A 142 -8.108 2.495 3.037 1.00 0.00 C ATOM 2188 O PHE A 142 -8.962 1.743 2.564 1.00 0.00 O ATOM 2189 CB PHE A 142 -7.022 2.987 0.832 1.00 0.00 C ATOM 2190 CG PHE A 142 -6.811 4.424 0.443 1.00 0.00 C ATOM 2191 CD1 PHE A 142 -7.638 5.418 0.941 1.00 0.00 C ATOM 2192 CD2 PHE A 142 -5.785 4.778 -0.416 1.00 0.00 C ATOM 2193 CE1 PHE A 142 -7.445 6.739 0.586 1.00 0.00 C ATOM 2194 CE2 PHE A 142 -5.589 6.096 -0.776 1.00 0.00 C ATOM 2195 CZ PHE A 142 -6.419 7.078 -0.274 1.00 0.00 C ATOM 0 H PHE A 142 -6.263 0.695 2.093 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.285 3.584 2.759 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.357 2.357 0.241 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -8.042 2.697 0.581 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -8.442 5.157 1.614 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -5.130 4.014 -0.809 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -8.096 7.506 0.980 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -4.787 6.359 -1.450 1.00 0.00 H new ATOM 0 HZ PHE A 142 -6.266 8.110 -0.553 1.00 0.00 H new ATOM 2205 N ASN A 143 -8.274 3.157 4.180 1.00 0.00 N ATOM 2206 CA ASN A 143 -9.500 3.036 4.968 1.00 0.00 C ATOM 2207 C ASN A 143 -10.526 4.083 4.541 1.00 0.00 C ATOM 2208 O ASN A 143 -10.272 5.283 4.634 1.00 0.00 O ATOM 2209 CB ASN A 143 -9.190 3.191 6.459 1.00 0.00 C ATOM 2210 CG ASN A 143 -8.127 2.220 6.943 1.00 0.00 C ATOM 2211 OD1 ASN A 143 -8.423 1.069 7.265 1.00 0.00 O ATOM 2212 ND2 ASN A 143 -6.881 2.680 6.997 1.00 0.00 N ATOM 0 H ASN A 143 -7.576 3.783 4.582 1.00 0.00 H new ATOM 0 HA ASN A 143 -9.920 2.046 4.791 1.00 0.00 H new ATOM 0 HB2 ASN A 143 -8.859 4.211 6.652 1.00 0.00 H new ATOM 0 HB3 ASN A 143 -10.104 3.038 7.033 1.00 0.00 H new ATOM 0 HD21 ASN A 143 -6.126 2.072 7.315 1.00 0.00 H new ATOM 0 HD22 ASN A 143 -6.680 3.641 6.721 1.00 0.00 H new ATOM 2219 N GLN A 144 -11.687 3.619 4.076 1.00 0.00 N ATOM 2220 CA GLN A 144 -12.750 4.521 3.639 1.00 0.00 C ATOM 2221 C GLN A 144 -14.129 3.929 3.928 1.00 0.00 C ATOM 2222 O GLN A 144 -14.545 2.967 3.283 1.00 0.00 O ATOM 2223 CB GLN A 144 -12.615 4.827 2.141 1.00 0.00 C ATOM 2224 CG GLN A 144 -12.502 3.589 1.262 1.00 0.00 C ATOM 2225 CD GLN A 144 -13.583 3.525 0.198 1.00 0.00 C ATOM 2226 OE1 GLN A 144 -13.205 3.767 -1.055 1.00 0.00 O flip ATOM 2227 NE2 GLN A 144 -14.748 3.260 0.496 1.00 0.00 N flip ATOM 0 H GLN A 144 -11.913 2.628 3.993 1.00 0.00 H new ATOM 0 HA GLN A 144 -12.650 5.449 4.201 1.00 0.00 H new ATOM 0 HB2 GLN A 144 -13.479 5.409 1.821 1.00 0.00 H new ATOM 0 HB3 GLN A 144 -11.735 5.451 1.986 1.00 0.00 H new ATOM 0 HG2 GLN A 144 -11.524 3.578 0.781 1.00 0.00 H new ATOM 0 HG3 GLN A 144 -12.560 2.698 1.887 1.00 0.00 H new ATOM 0 HE21 GLN A 144 -14.997 3.081 1.469 1.00 0.00 H new ATOM 0 HE22 GLN A 144 -15.464 3.220 -0.230 1.00 0.00 H new ATOM 2236 N PRO A 145 -14.860 4.501 4.906 1.00 0.00 N ATOM 2237 CA PRO A 145 -16.203 4.026 5.274 1.00 0.00 C ATOM 2238 C PRO A 145 -17.144 3.948 4.068 1.00 0.00 C ATOM 2239 O PRO A 145 -16.899 4.580 3.039 1.00 0.00 O ATOM 2240 CB PRO A 145 -16.690 5.081 6.270 1.00 0.00 C ATOM 2241 CG PRO A 145 -15.447 5.670 6.840 1.00 0.00 C ATOM 2242 CD PRO A 145 -14.440 5.653 5.725 1.00 0.00 C ATOM 0 HA PRO A 145 -16.182 3.015 5.681 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -17.297 5.840 5.777 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -17.309 4.634 7.048 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -15.622 6.686 7.194 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -15.095 5.091 7.694 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -14.457 6.581 5.153 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -13.425 5.530 6.102 1.00 0.00 H new ATOM 2473 N PRO A 162 -16.257 13.841 -2.992 1.00 0.00 N ATOM 2474 CA PRO A 162 -15.688 12.648 -2.341 1.00 0.00 C ATOM 2475 C PRO A 162 -14.514 12.050 -3.122 1.00 0.00 C ATOM 2476 O PRO A 162 -14.250 12.440 -4.261 1.00 0.00 O ATOM 2477 CB PRO A 162 -16.862 11.658 -2.308 1.00 0.00 C ATOM 2478 CG PRO A 162 -18.081 12.504 -2.421 1.00 0.00 C ATOM 2479 CD PRO A 162 -17.693 13.673 -3.280 1.00 0.00 C ATOM 0 HA PRO A 162 -15.282 12.886 -1.358 1.00 0.00 H new ATOM 0 HB2 PRO A 162 -16.799 10.944 -3.129 1.00 0.00 H new ATOM 0 HB3 PRO A 162 -16.866 11.081 -1.383 1.00 0.00 H new ATOM 0 HG2 PRO A 162 -18.903 11.946 -2.869 1.00 0.00 H new ATOM 0 HG3 PRO A 162 -18.418 12.836 -1.439 1.00 0.00 H new ATOM 0 HD2 PRO A 162 -17.871 13.473 -4.337 1.00 0.00 H new ATOM 0 HD3 PRO A 162 -18.262 14.567 -3.025 1.00 0.00 H new ATOM 2487 N TRP A 163 -13.815 11.098 -2.499 1.00 0.00 N ATOM 2488 CA TRP A 163 -12.671 10.444 -3.132 1.00 0.00 C ATOM 2489 C TRP A 163 -12.960 8.968 -3.408 1.00 0.00 C ATOM 2490 O TRP A 163 -13.595 8.288 -2.602 1.00 0.00 O ATOM 2491 CB TRP A 163 -11.422 10.578 -2.254 1.00 0.00 C ATOM 2492 CG TRP A 163 -10.421 11.548 -2.805 1.00 0.00 C ATOM 2493 CD1 TRP A 163 -10.047 11.680 -4.110 1.00 0.00 C ATOM 2494 CD2 TRP A 163 -9.669 12.521 -2.070 1.00 0.00 C ATOM 2495 NE1 TRP A 163 -9.110 12.676 -4.234 1.00 0.00 N ATOM 2496 CE2 TRP A 163 -8.861 13.207 -2.996 1.00 0.00 C ATOM 2497 CE3 TRP A 163 -9.600 12.882 -0.721 1.00 0.00 C ATOM 2498 CZ2 TRP A 163 -7.997 14.231 -2.618 1.00 0.00 C ATOM 2499 CZ3 TRP A 163 -8.743 13.897 -0.345 1.00 0.00 C ATOM 2500 CH2 TRP A 163 -7.950 14.563 -1.291 1.00 0.00 C ATOM 0 H TRP A 163 -14.022 10.764 -1.558 1.00 0.00 H new ATOM 0 HA TRP A 163 -12.490 10.941 -4.085 1.00 0.00 H new ATOM 0 HB2 TRP A 163 -11.719 10.899 -1.255 1.00 0.00 H new ATOM 0 HB3 TRP A 163 -10.952 9.600 -2.148 1.00 0.00 H new ATOM 0 HD1 TRP A 163 -10.432 11.087 -4.927 1.00 0.00 H new ATOM 0 HE1 TRP A 163 -8.671 12.972 -5.106 1.00 0.00 H new ATOM 0 HE3 TRP A 163 -10.207 12.375 0.015 1.00 0.00 H new ATOM 0 HZ2 TRP A 163 -7.386 14.745 -3.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 163 -8.682 14.183 0.695 1.00 0.00 H new ATOM 0 HH2 TRP A 163 -7.289 15.353 -0.966 1.00 0.00 H new ATOM 2511 N SER A 164 -12.489 8.484 -4.561 1.00 0.00 N ATOM 2512 CA SER A 164 -12.696 7.091 -4.953 1.00 0.00 C ATOM 2513 C SER A 164 -11.373 6.440 -5.380 1.00 0.00 C ATOM 2514 O SER A 164 -10.301 6.840 -4.917 1.00 0.00 O ATOM 2515 CB SER A 164 -13.728 7.020 -6.085 1.00 0.00 C ATOM 2516 OG SER A 164 -13.193 7.525 -7.299 1.00 0.00 O ATOM 0 H SER A 164 -11.963 9.037 -5.237 1.00 0.00 H new ATOM 0 HA SER A 164 -13.075 6.537 -4.094 1.00 0.00 H new ATOM 0 HB2 SER A 164 -14.046 5.987 -6.226 1.00 0.00 H new ATOM 0 HB3 SER A 164 -14.614 7.592 -5.809 1.00 0.00 H new ATOM 0 HG SER A 164 -13.871 7.467 -8.004 1.00 0.00 H new ATOM 2522 N LEU A 165 -11.449 5.435 -6.264 1.00 0.00 N ATOM 2523 CA LEU A 165 -10.254 4.738 -6.746 1.00 0.00 C ATOM 2524 C LEU A 165 -9.207 5.723 -7.266 1.00 0.00 C ATOM 2525 O LEU A 165 -8.010 5.456 -7.186 1.00 0.00 O ATOM 2526 CB LEU A 165 -10.617 3.745 -7.855 1.00 0.00 C ATOM 2527 CG LEU A 165 -9.927 2.380 -7.754 1.00 0.00 C ATOM 2528 CD1 LEU A 165 -10.864 1.267 -8.204 1.00 0.00 C ATOM 2529 CD2 LEU A 165 -8.648 2.368 -8.578 1.00 0.00 C ATOM 0 H LEU A 165 -12.324 5.089 -6.657 1.00 0.00 H new ATOM 0 HA LEU A 165 -9.831 4.195 -5.901 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -11.696 3.591 -7.845 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -10.367 4.191 -8.818 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.667 2.205 -6.710 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.354 0.307 -8.124 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -11.751 1.260 -7.571 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -11.159 1.436 -9.240 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -8.171 1.391 -8.495 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.886 2.568 -9.623 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -7.969 3.136 -8.207 1.00 0.00 H new ATOM 2541 N GLY A 166 -9.670 6.861 -7.792 1.00 0.00 N ATOM 2542 CA GLY A 166 -8.765 7.875 -8.315 1.00 0.00 C ATOM 2543 C GLY A 166 -7.629 8.202 -7.360 1.00 0.00 C ATOM 2544 O GLY A 166 -6.482 8.348 -7.782 1.00 0.00 O ATOM 0 H GLY A 166 -10.660 7.097 -7.864 1.00 0.00 H new ATOM 0 HA2 GLY A 166 -8.349 7.530 -9.262 1.00 0.00 H new ATOM 0 HA3 GLY A 166 -9.329 8.784 -8.526 1.00 0.00 H new ATOM 2548 N ASP A 167 -7.950 8.304 -6.068 1.00 0.00 N ATOM 2549 CA ASP A 167 -6.945 8.600 -5.053 1.00 0.00 C ATOM 2550 C ASP A 167 -6.060 7.381 -4.805 1.00 0.00 C ATOM 2551 O ASP A 167 -4.833 7.484 -4.823 1.00 0.00 O ATOM 2552 CB ASP A 167 -7.612 9.050 -3.746 1.00 0.00 C ATOM 2553 CG ASP A 167 -6.643 9.742 -2.803 1.00 0.00 C ATOM 2554 OD1 ASP A 167 -5.598 9.147 -2.473 1.00 0.00 O ATOM 2555 OD2 ASP A 167 -6.931 10.884 -2.392 1.00 0.00 O ATOM 0 H ASP A 167 -8.896 8.186 -5.704 1.00 0.00 H new ATOM 0 HA ASP A 167 -6.320 9.414 -5.419 1.00 0.00 H new ATOM 0 HB2 ASP A 167 -8.434 9.727 -3.977 1.00 0.00 H new ATOM 0 HB3 ASP A 167 -8.043 8.183 -3.246 1.00 0.00 H new ATOM 2560 N PHE A 168 -6.689 6.225 -4.582 1.00 0.00 N ATOM 2561 CA PHE A 168 -5.952 4.984 -4.342 1.00 0.00 C ATOM 2562 C PHE A 168 -4.990 4.691 -5.494 1.00 0.00 C ATOM 2563 O PHE A 168 -3.826 4.356 -5.269 1.00 0.00 O ATOM 2564 CB PHE A 168 -6.917 3.807 -4.153 1.00 0.00 C ATOM 2565 CG PHE A 168 -6.222 2.503 -3.879 1.00 0.00 C ATOM 2566 CD1 PHE A 168 -5.834 1.677 -4.923 1.00 0.00 C ATOM 2567 CD2 PHE A 168 -5.953 2.106 -2.581 1.00 0.00 C ATOM 2568 CE1 PHE A 168 -5.187 0.483 -4.674 1.00 0.00 C ATOM 2569 CE2 PHE A 168 -5.309 0.912 -2.325 1.00 0.00 C ATOM 2570 CZ PHE A 168 -4.925 0.099 -3.373 1.00 0.00 C ATOM 0 H PHE A 168 -7.704 6.123 -4.563 1.00 0.00 H new ATOM 0 HA PHE A 168 -5.372 5.112 -3.428 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -7.593 4.030 -3.328 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -7.530 3.702 -5.048 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -6.040 1.971 -5.942 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -6.251 2.738 -1.758 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -4.886 -0.150 -5.495 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -5.106 0.614 -1.307 1.00 0.00 H new ATOM 0 HZ PHE A 168 -4.421 -0.835 -3.176 1.00 0.00 H new ATOM 2580 N GLU A 169 -5.485 4.829 -6.726 1.00 0.00 N ATOM 2581 CA GLU A 169 -4.673 4.589 -7.920 1.00 0.00 C ATOM 2582 C GLU A 169 -3.407 5.442 -7.890 1.00 0.00 C ATOM 2583 O GLU A 169 -2.327 4.977 -8.253 1.00 0.00 O ATOM 2584 CB GLU A 169 -5.478 4.891 -9.189 1.00 0.00 C ATOM 2585 CG GLU A 169 -5.518 3.729 -10.173 1.00 0.00 C ATOM 2586 CD GLU A 169 -6.634 3.851 -11.198 1.00 0.00 C ATOM 2587 OE1 GLU A 169 -7.728 4.342 -10.842 1.00 0.00 O ATOM 2588 OE2 GLU A 169 -6.414 3.451 -12.361 1.00 0.00 O ATOM 0 H GLU A 169 -6.447 5.106 -6.923 1.00 0.00 H new ATOM 0 HA GLU A 169 -4.386 3.537 -7.929 1.00 0.00 H new ATOM 0 HB2 GLU A 169 -6.498 5.155 -8.909 1.00 0.00 H new ATOM 0 HB3 GLU A 169 -5.048 5.762 -9.684 1.00 0.00 H new ATOM 0 HG2 GLU A 169 -4.562 3.668 -10.692 1.00 0.00 H new ATOM 0 HG3 GLU A 169 -5.641 2.797 -9.621 1.00 0.00 H new ATOM 2595 N GLN A 170 -3.550 6.694 -7.448 1.00 0.00 N ATOM 2596 CA GLN A 170 -2.418 7.611 -7.358 1.00 0.00 C ATOM 2597 C GLN A 170 -1.371 7.077 -6.378 1.00 0.00 C ATOM 2598 O GLN A 170 -0.165 7.190 -6.620 1.00 0.00 O ATOM 2599 CB GLN A 170 -2.893 9.006 -6.928 1.00 0.00 C ATOM 2600 CG GLN A 170 -1.776 10.034 -6.809 1.00 0.00 C ATOM 2601 CD GLN A 170 -1.138 10.369 -8.143 1.00 0.00 C ATOM 2602 OE1 GLN A 170 -0.016 9.725 -8.444 1.00 0.00 O flip ATOM 2603 NE2 GLN A 170 -1.647 11.200 -8.896 1.00 0.00 N flip ATOM 0 H GLN A 170 -4.439 7.093 -7.148 1.00 0.00 H new ATOM 0 HA GLN A 170 -1.958 7.690 -8.343 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -3.628 9.366 -7.648 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -3.401 8.925 -5.967 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -2.174 10.946 -6.363 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -1.011 9.655 -6.131 1.00 0.00 H new ATOM 0 HE21 GLN A 170 -2.510 11.672 -8.626 1.00 0.00 H new ATOM 0 HE22 GLN A 170 -1.206 11.416 -9.790 1.00 0.00 H new ATOM 2612 N LEU A 171 -1.833 6.482 -5.275 1.00 0.00 N ATOM 2613 CA LEU A 171 -0.925 5.920 -4.279 1.00 0.00 C ATOM 2614 C LEU A 171 -0.139 4.751 -4.865 1.00 0.00 C ATOM 2615 O LEU A 171 0.992 4.492 -4.457 1.00 0.00 O ATOM 2616 CB LEU A 171 -1.684 5.479 -3.023 1.00 0.00 C ATOM 2617 CG LEU A 171 -1.131 6.038 -1.707 1.00 0.00 C ATOM 2618 CD1 LEU A 171 0.210 5.396 -1.375 1.00 0.00 C ATOM 2619 CD2 LEU A 171 -0.994 7.554 -1.781 1.00 0.00 C ATOM 0 H LEU A 171 -2.823 6.379 -5.053 1.00 0.00 H new ATOM 0 HA LEU A 171 -0.222 6.702 -3.991 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -2.726 5.782 -3.120 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -1.672 4.390 -2.972 1.00 0.00 H new ATOM 0 HG LEU A 171 -1.835 5.797 -0.911 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.587 5.805 -0.438 1.00 0.00 H new ATOM 0 HD12 LEU A 171 0.083 4.318 -1.275 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.921 5.605 -2.174 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -0.600 7.930 -0.837 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -0.313 7.819 -2.590 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -1.971 7.999 -1.969 1.00 0.00 H new ATOM 2631 N VAL A 172 -0.730 4.057 -5.840 1.00 0.00 N ATOM 2632 CA VAL A 172 -0.053 2.937 -6.489 1.00 0.00 C ATOM 2633 C VAL A 172 1.138 3.449 -7.301 1.00 0.00 C ATOM 2634 O VAL A 172 2.156 2.768 -7.424 1.00 0.00 O ATOM 2635 CB VAL A 172 -0.995 2.138 -7.413 1.00 0.00 C ATOM 2636 CG1 VAL A 172 -0.328 0.846 -7.865 1.00 0.00 C ATOM 2637 CG2 VAL A 172 -2.320 1.845 -6.719 1.00 0.00 C ATOM 0 H VAL A 172 -1.667 4.250 -6.194 1.00 0.00 H new ATOM 0 HA VAL A 172 0.287 2.266 -5.700 1.00 0.00 H new ATOM 0 HB VAL A 172 -1.204 2.746 -8.294 1.00 0.00 H new ATOM 0 HG11 VAL A 172 -1.006 0.295 -8.516 1.00 0.00 H new ATOM 0 HG12 VAL A 172 0.587 1.080 -8.409 1.00 0.00 H new ATOM 0 HG13 VAL A 172 -0.086 0.237 -6.994 1.00 0.00 H new ATOM 0 HG21 VAL A 172 -2.966 1.281 -7.392 1.00 0.00 H new ATOM 0 HG22 VAL A 172 -2.137 1.261 -5.817 1.00 0.00 H new ATOM 0 HG23 VAL A 172 -2.806 2.783 -6.451 1.00 0.00 H new ATOM 2647 N THR A 173 1.007 4.669 -7.832 1.00 0.00 N ATOM 2648 CA THR A 173 2.080 5.289 -8.605 1.00 0.00 C ATOM 2649 C THR A 173 3.043 6.053 -7.693 1.00 0.00 C ATOM 2650 O THR A 173 4.019 6.639 -8.162 1.00 0.00 O ATOM 2651 CB THR A 173 1.515 6.232 -9.662 1.00 0.00 C ATOM 2652 OG1 THR A 173 0.330 6.863 -9.207 1.00 0.00 O ATOM 2653 CG2 THR A 173 1.196 5.540 -10.965 1.00 0.00 C ATOM 0 H THR A 173 0.169 5.243 -7.739 1.00 0.00 H new ATOM 0 HA THR A 173 2.629 4.490 -9.103 1.00 0.00 H new ATOM 0 HB THR A 173 2.301 6.966 -9.837 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.442 7.133 -8.271 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.798 6.266 -11.674 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.104 5.095 -11.372 1.00 0.00 H new ATOM 0 HG23 THR A 173 0.456 4.759 -10.791 1.00 0.00 H new ATOM 2661 N SER A 174 2.769 6.037 -6.386 1.00 0.00 N ATOM 2662 CA SER A 174 3.619 6.719 -5.411 1.00 0.00 C ATOM 2663 C SER A 174 4.987 6.031 -5.255 1.00 0.00 C ATOM 2664 O SER A 174 5.788 6.424 -4.409 1.00 0.00 O ATOM 2665 CB SER A 174 2.922 6.785 -4.053 1.00 0.00 C ATOM 2666 OG SER A 174 1.815 7.663 -4.097 1.00 0.00 O ATOM 0 H SER A 174 1.965 5.559 -5.980 1.00 0.00 H new ATOM 0 HA SER A 174 3.791 7.728 -5.786 1.00 0.00 H new ATOM 0 HB2 SER A 174 2.590 5.789 -3.761 1.00 0.00 H new ATOM 0 HB3 SER A 174 3.628 7.121 -3.293 1.00 0.00 H new ATOM 0 HG SER A 174 1.776 8.182 -3.266 1.00 0.00 H new ATOM 2672 N LEU A 175 5.260 5.011 -6.067 1.00 0.00 N ATOM 2673 CA LEU A 175 6.544 4.315 -5.999 1.00 0.00 C ATOM 2674 C LEU A 175 7.270 4.392 -7.345 1.00 0.00 C ATOM 2675 O LEU A 175 7.891 3.421 -7.788 1.00 0.00 O ATOM 2676 CB LEU A 175 6.352 2.850 -5.583 1.00 0.00 C ATOM 2677 CG LEU A 175 5.201 2.112 -6.278 1.00 0.00 C ATOM 2678 CD1 LEU A 175 5.692 0.810 -6.896 1.00 0.00 C ATOM 2679 CD2 LEU A 175 4.069 1.850 -5.291 1.00 0.00 C ATOM 0 H LEU A 175 4.617 4.651 -6.772 1.00 0.00 H new ATOM 0 HA LEU A 175 7.155 4.809 -5.243 1.00 0.00 H new ATOM 0 HB2 LEU A 175 7.278 2.310 -5.780 1.00 0.00 H new ATOM 0 HB3 LEU A 175 6.185 2.815 -4.506 1.00 0.00 H new ATOM 0 HG LEU A 175 4.819 2.743 -7.081 1.00 0.00 H new ATOM 0 HD11 LEU A 175 4.860 0.302 -7.384 1.00 0.00 H new ATOM 0 HD12 LEU A 175 6.467 1.026 -7.632 1.00 0.00 H new ATOM 0 HD13 LEU A 175 6.101 0.168 -6.116 1.00 0.00 H new ATOM 0 HD21 LEU A 175 3.259 1.326 -5.798 1.00 0.00 H new ATOM 0 HD22 LEU A 175 4.438 1.238 -4.468 1.00 0.00 H new ATOM 0 HD23 LEU A 175 3.700 2.798 -4.901 1.00 0.00 H new ATOM 2691 N THR A 176 7.185 5.556 -7.993 1.00 0.00 N ATOM 2692 CA THR A 176 7.827 5.772 -9.288 1.00 0.00 C ATOM 2693 C THR A 176 9.347 5.687 -9.165 1.00 0.00 C ATOM 2694 O THR A 176 9.969 6.492 -8.467 1.00 0.00 O ATOM 2695 CB THR A 176 7.421 7.133 -9.866 1.00 0.00 C ATOM 2696 OG1 THR A 176 6.013 7.286 -9.851 1.00 0.00 O ATOM 2697 CG2 THR A 176 7.883 7.346 -11.290 1.00 0.00 C ATOM 0 H THR A 176 6.675 6.365 -7.639 1.00 0.00 H new ATOM 0 HA THR A 176 7.493 4.986 -9.965 1.00 0.00 H new ATOM 0 HB THR A 176 7.909 7.869 -9.227 1.00 0.00 H new ATOM 0 HG1 THR A 176 5.690 7.251 -8.926 1.00 0.00 H new ATOM 0 HG21 THR A 176 7.561 8.329 -11.634 1.00 0.00 H new ATOM 0 HG22 THR A 176 8.970 7.285 -11.333 1.00 0.00 H new ATOM 0 HG23 THR A 176 7.451 6.578 -11.931 1.00 0.00 H new ATOM 2705 N LEU A 177 9.934 4.701 -9.841 1.00 0.00 N ATOM 2706 CA LEU A 177 11.378 4.498 -9.808 1.00 0.00 C ATOM 2707 C LEU A 177 12.108 5.597 -10.574 1.00 0.00 C ATOM 2708 O LEU A 177 11.841 5.826 -11.756 1.00 0.00 O ATOM 2709 CB LEU A 177 11.734 3.128 -10.393 1.00 0.00 C ATOM 2710 CG LEU A 177 13.132 2.613 -10.043 1.00 0.00 C ATOM 2711 CD1 LEU A 177 13.373 2.684 -8.540 1.00 0.00 C ATOM 2712 CD2 LEU A 177 13.315 1.190 -10.553 1.00 0.00 C ATOM 0 H LEU A 177 9.429 4.030 -10.419 1.00 0.00 H new ATOM 0 HA LEU A 177 11.698 4.538 -8.767 1.00 0.00 H new ATOM 0 HB2 LEU A 177 10.999 2.401 -10.047 1.00 0.00 H new ATOM 0 HB3 LEU A 177 11.644 3.180 -11.478 1.00 0.00 H new ATOM 0 HG LEU A 177 13.867 3.252 -10.532 1.00 0.00 H new ATOM 0 HD11 LEU A 177 14.373 2.313 -8.314 1.00 0.00 H new ATOM 0 HD12 LEU A 177 13.285 3.718 -8.206 1.00 0.00 H new ATOM 0 HD13 LEU A 177 12.634 2.072 -8.024 1.00 0.00 H new ATOM 0 HD21 LEU A 177 14.314 0.837 -10.297 1.00 0.00 H new ATOM 0 HD22 LEU A 177 12.571 0.540 -10.092 1.00 0.00 H new ATOM 0 HD23 LEU A 177 13.191 1.173 -11.636 1.00 0.00 H new ATOM 2724 N HIS A 178 13.035 6.267 -9.893 1.00 0.00 N ATOM 2725 CA HIS A 178 13.818 7.342 -10.503 1.00 0.00 C ATOM 2726 C HIS A 178 15.307 7.126 -10.256 1.00 0.00 C ATOM 2727 O HIS A 178 16.087 6.985 -11.199 1.00 0.00 O ATOM 2728 CB HIS A 178 13.394 8.701 -9.941 1.00 0.00 C ATOM 2729 CG HIS A 178 12.048 9.158 -10.411 1.00 0.00 C ATOM 2730 ND1 HIS A 178 10.986 9.630 -9.720 1.00 0.00 N flip ATOM 2731 CD2 HIS A 178 11.674 9.165 -11.739 1.00 0.00 C flip ATOM 2732 CE1 HIS A 178 10.000 9.912 -10.631 1.00 0.00 C flip ATOM 2733 NE2 HIS A 178 10.439 9.622 -11.842 1.00 0.00 N flip ATOM 0 H HIS A 178 13.264 6.085 -8.916 1.00 0.00 H new ATOM 0 HA HIS A 178 13.631 7.329 -11.577 1.00 0.00 H new ATOM 0 HB2 HIS A 178 13.389 8.648 -8.852 1.00 0.00 H new ATOM 0 HB3 HIS A 178 14.138 9.447 -10.220 1.00 0.00 H new ATOM 0 HD2 HIS A 178 12.294 8.847 -12.564 1.00 0.00 H new ATOM 0 HE1 HIS A 178 9.023 10.307 -10.396 1.00 0.00 H new ATOM 0 HE2 HIS A 178 9.914 9.732 -12.709 1.00 0.00 H new ATOM 2742 N ASP A 179 15.691 7.098 -8.981 1.00 0.00 N ATOM 2743 CA ASP A 179 17.083 6.898 -8.599 1.00 0.00 C ATOM 2744 C ASP A 179 17.221 5.674 -7.696 1.00 0.00 C ATOM 2745 O ASP A 179 16.970 5.753 -6.491 1.00 0.00 O ATOM 2746 CB ASP A 179 17.624 8.142 -7.888 1.00 0.00 C ATOM 2747 CG ASP A 179 18.192 9.164 -8.855 1.00 0.00 C ATOM 2748 OD1 ASP A 179 17.425 9.673 -9.700 1.00 0.00 O ATOM 2749 OD2 ASP A 179 19.403 9.457 -8.764 1.00 0.00 O ATOM 0 H ASP A 179 15.053 7.212 -8.194 1.00 0.00 H new ATOM 0 HA ASP A 179 17.667 6.729 -9.504 1.00 0.00 H new ATOM 0 HB2 ASP A 179 16.824 8.601 -7.308 1.00 0.00 H new ATOM 0 HB3 ASP A 179 18.399 7.845 -7.182 1.00 0.00 H new ATOM 2754 N PRO A 180 17.620 4.519 -8.269 1.00 0.00 N ATOM 2755 CA PRO A 180 17.791 3.269 -7.512 1.00 0.00 C ATOM 2756 C PRO A 180 18.994 3.322 -6.566 1.00 0.00 C ATOM 2757 O PRO A 180 19.975 2.594 -6.744 1.00 0.00 O ATOM 2758 CB PRO A 180 18.001 2.219 -8.607 1.00 0.00 C ATOM 2759 CG PRO A 180 18.568 2.981 -9.755 1.00 0.00 C ATOM 2760 CD PRO A 180 17.935 4.343 -9.703 1.00 0.00 C ATOM 0 HA PRO A 180 16.939 3.059 -6.866 1.00 0.00 H new ATOM 0 HB2 PRO A 180 18.681 1.434 -8.278 1.00 0.00 H new ATOM 0 HB3 PRO A 180 17.062 1.735 -8.877 1.00 0.00 H new ATOM 0 HG2 PRO A 180 19.653 3.052 -9.678 1.00 0.00 H new ATOM 0 HG3 PRO A 180 18.347 2.484 -10.700 1.00 0.00 H new ATOM 0 HD2 PRO A 180 18.614 5.116 -10.063 1.00 0.00 H new ATOM 0 HD3 PRO A 180 17.038 4.393 -10.321 1.00 0.00 H new