USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 832 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 62 THR OG1 : rot 180:sc= -0.389 USER MOD Set 1.2: B 64 GLN : amide:sc= 0.393 K(o=-2.6,f=-3.4) USER MOD Set 1.3: B 78 ASN : amide:sc= -2.62 K(o=-2.6,f=-4.1!) USER MOD Set 2.1: B 41 GLN : amide:sc= -1.6 X(o=-1.5,f=-1.5) USER MOD Set 2.2: B 44 LYS NZ :NH3+ -177:sc= 0.0718 (180deg=0) USER MOD Set 3.1: A 62 THR OG1 : rot 180:sc= -0.324 USER MOD Set 3.2: A 64 GLN : amide:sc= 0.43 K(o=-2.6,f=-3.4) USER MOD Set 3.3: A 78 ASN : amide:sc= -2.67 K(o=-2.6,f=-3.7!) USER MOD Set 4.1: A 41 GLN : amide:sc= -1.58 X(o=-1.5,f=-1.7) USER MOD Set 4.2: A 44 LYS NZ :NH3+ -177:sc= 0.0758 (180deg=0) USER MOD Single : A 32 SER OG : rot 22:sc= 0.508 USER MOD Single : A 37 HIS : no HE2:sc= -0.239 X(o=-0.24,f=-0.6) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 MET CE :methyl 146:sc= -3.1 (180deg=-5.01!) USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 68 LYS NZ :NH3+ 157:sc= -0.0861 (180deg=-0.638) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 96:sc= 0.00392 USER MOD Single : B 32 SER OG : rot 32:sc= 0.467 USER MOD Single : B 37 HIS : no HD1:sc= -0.262 X(o=-0.26,f=-0.59) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 MET CE :methyl 147:sc= -3.02 (180deg=-5.09!) USER MOD Single : B 67 GLN : amide:sc=-0.00361 K(o=-0.0036,f=-0.74) USER MOD Single : B 68 LYS NZ :NH3+ 132:sc= -0.0749 (180deg=-0.666) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 94:sc= 0.00296 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 32 6.154 -0.405 1.208 1.00 0.00 N ATOM 28 CA SER A 32 7.490 -0.982 0.877 1.00 0.00 C ATOM 29 C SER A 32 8.038 -0.343 -0.404 1.00 0.00 C ATOM 30 O SER A 32 9.229 -0.370 -0.652 1.00 0.00 O ATOM 31 CB SER A 32 7.358 -2.490 0.672 1.00 0.00 C ATOM 32 OG SER A 32 6.457 -3.018 1.636 1.00 0.00 O ATOM 0 HA SER A 32 8.176 -0.780 1.700 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.997 -2.702 -0.334 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.333 -2.968 0.768 1.00 0.00 H new ATOM 0 HG SER A 32 5.880 -2.301 1.971 1.00 0.00 H new ATOM 38 N ASP A 33 7.184 0.231 -1.219 1.00 0.00 N ATOM 39 CA ASP A 33 7.662 0.867 -2.478 1.00 0.00 C ATOM 40 C ASP A 33 8.081 2.322 -2.223 1.00 0.00 C ATOM 41 O ASP A 33 8.279 3.079 -3.153 1.00 0.00 O ATOM 42 CB ASP A 33 6.548 0.838 -3.525 1.00 0.00 C ATOM 43 CG ASP A 33 5.287 1.485 -2.951 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.342 2.662 -2.633 1.00 0.00 O ATOM 45 OD2 ASP A 33 4.288 0.795 -2.840 1.00 0.00 O ATOM 0 H ASP A 33 6.177 0.284 -1.062 1.00 0.00 H new ATOM 0 HA ASP A 33 8.525 0.309 -2.841 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.865 1.369 -4.423 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.339 -0.190 -3.820 1.00 0.00 H new ATOM 50 N ALA A 34 8.229 2.719 -0.981 1.00 0.00 N ATOM 51 CA ALA A 34 8.649 4.112 -0.679 1.00 0.00 C ATOM 52 C ALA A 34 10.181 4.179 -0.561 1.00 0.00 C ATOM 53 O ALA A 34 10.764 5.244 -0.602 1.00 0.00 O ATOM 54 CB ALA A 34 8.016 4.558 0.640 1.00 0.00 C ATOM 0 H ALA A 34 8.074 2.129 -0.163 1.00 0.00 H new ATOM 0 HA ALA A 34 8.321 4.770 -1.484 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.323 5.580 0.864 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.930 4.515 0.555 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.343 3.897 1.443 1.00 0.00 H new ATOM 60 N GLU A 35 10.833 3.047 -0.411 1.00 0.00 N ATOM 61 CA GLU A 35 12.321 3.038 -0.285 1.00 0.00 C ATOM 62 C GLU A 35 12.989 3.718 -1.501 1.00 0.00 C ATOM 63 O GLU A 35 13.910 4.489 -1.315 1.00 0.00 O ATOM 64 CB GLU A 35 12.826 1.593 -0.157 1.00 0.00 C ATOM 65 CG GLU A 35 12.083 0.879 0.982 1.00 0.00 C ATOM 66 CD GLU A 35 12.986 0.793 2.215 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.682 1.759 2.484 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.966 -0.237 2.869 1.00 0.00 O ATOM 0 H GLU A 35 10.393 2.128 -0.371 1.00 0.00 H new ATOM 0 HA GLU A 35 12.588 3.600 0.610 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.671 1.060 -1.095 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.898 1.589 0.038 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.168 1.419 1.227 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.788 -0.121 0.665 1.00 0.00 H new ATOM 75 N PRO A 36 12.536 3.430 -2.711 1.00 0.00 N ATOM 76 CA PRO A 36 13.118 4.028 -3.955 1.00 0.00 C ATOM 77 C PRO A 36 12.477 5.387 -4.263 1.00 0.00 C ATOM 78 O PRO A 36 13.160 6.347 -4.560 1.00 0.00 O ATOM 79 CB PRO A 36 12.771 3.009 -5.032 1.00 0.00 C ATOM 80 CG PRO A 36 11.557 2.235 -4.551 1.00 0.00 C ATOM 81 CD PRO A 36 11.402 2.494 -3.050 1.00 0.00 C ATOM 0 HA PRO A 36 14.189 4.217 -3.875 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.558 3.508 -5.978 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.610 2.336 -5.208 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.663 2.553 -5.088 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.682 1.170 -4.744 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.435 2.943 -2.822 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.467 1.568 -2.478 1.00 0.00 H new ATOM 89 N HIS A 37 11.163 5.464 -4.204 1.00 0.00 N ATOM 90 CA HIS A 37 10.422 6.744 -4.495 1.00 0.00 C ATOM 91 C HIS A 37 10.285 6.969 -6.013 1.00 0.00 C ATOM 92 O HIS A 37 9.569 7.854 -6.442 1.00 0.00 O ATOM 93 CB HIS A 37 11.122 7.954 -3.855 1.00 0.00 C ATOM 94 CG HIS A 37 10.094 8.979 -3.458 1.00 0.00 C ATOM 95 ND1 HIS A 37 8.974 8.650 -2.711 1.00 0.00 N ATOM 96 CD2 HIS A 37 10.002 10.327 -3.697 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.263 9.777 -2.529 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.845 10.830 -3.110 1.00 0.00 N ATOM 0 H HIS A 37 10.560 4.678 -3.961 1.00 0.00 H new ATOM 0 HA HIS A 37 9.428 6.647 -4.059 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.691 7.637 -2.981 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.832 8.390 -4.558 1.00 0.00 H new ATOM 0 HD1 HIS A 37 8.733 7.722 -2.363 1.00 0.00 H new ATOM 0 HD2 HIS A 37 10.719 10.910 -4.256 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.334 9.825 -1.980 1.00 0.00 H new ATOM 106 N TYR A 38 10.947 6.180 -6.828 1.00 0.00 N ATOM 107 CA TYR A 38 10.833 6.355 -8.308 1.00 0.00 C ATOM 108 C TYR A 38 10.185 5.104 -8.916 1.00 0.00 C ATOM 109 O TYR A 38 9.504 5.174 -9.919 1.00 0.00 O ATOM 110 CB TYR A 38 12.222 6.571 -8.924 1.00 0.00 C ATOM 111 CG TYR A 38 13.194 5.539 -8.398 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.907 5.789 -7.220 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.383 4.337 -9.090 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.810 4.836 -6.732 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.287 3.385 -8.602 1.00 0.00 C ATOM 116 CZ TYR A 38 14.999 3.634 -7.424 1.00 0.00 C ATOM 117 OH TYR A 38 15.888 2.693 -6.943 1.00 0.00 O ATOM 0 H TYR A 38 11.561 5.422 -6.529 1.00 0.00 H new ATOM 0 HA TYR A 38 10.216 7.228 -8.520 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.161 6.503 -10.010 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.581 7.573 -8.687 1.00 0.00 H new ATOM 0 HD1 TYR A 38 13.761 6.717 -6.687 1.00 0.00 H new ATOM 0 HD2 TYR A 38 12.833 4.144 -9.999 1.00 0.00 H new ATOM 0 HE1 TYR A 38 15.360 5.028 -5.823 1.00 0.00 H new ATOM 0 HE2 TYR A 38 14.434 2.458 -9.136 1.00 0.00 H new ATOM 0 HH TYR A 38 15.899 1.917 -7.541 1.00 0.00 H new ATOM 127 N LEU A 39 10.388 3.961 -8.306 1.00 0.00 N ATOM 128 CA LEU A 39 9.786 2.696 -8.827 1.00 0.00 C ATOM 129 C LEU A 39 8.256 2.847 -8.992 1.00 0.00 C ATOM 130 O LEU A 39 7.732 2.551 -10.051 1.00 0.00 O ATOM 131 CB LEU A 39 10.092 1.552 -7.844 1.00 0.00 C ATOM 132 CG LEU A 39 10.803 0.395 -8.568 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.955 -0.103 -9.746 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.156 0.881 -9.093 1.00 0.00 C ATOM 0 H LEU A 39 10.950 3.851 -7.462 1.00 0.00 H new ATOM 0 HA LEU A 39 10.216 2.473 -9.803 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.719 1.920 -7.032 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.166 1.193 -7.395 1.00 0.00 H new ATOM 0 HG LEU A 39 10.947 -0.424 -7.864 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.473 -0.921 -10.247 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.991 -0.455 -9.378 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.798 0.713 -10.452 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.662 0.063 -9.606 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.001 1.706 -9.789 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.770 1.220 -8.258 1.00 0.00 H new ATOM 146 N PRO A 40 7.570 3.302 -7.956 1.00 0.00 N ATOM 147 CA PRO A 40 6.081 3.491 -7.994 1.00 0.00 C ATOM 148 C PRO A 40 5.714 4.712 -8.846 1.00 0.00 C ATOM 149 O PRO A 40 4.593 4.845 -9.304 1.00 0.00 O ATOM 150 CB PRO A 40 5.695 3.674 -6.533 1.00 0.00 C ATOM 151 CG PRO A 40 6.929 4.152 -5.802 1.00 0.00 C ATOM 152 CD PRO A 40 8.143 3.704 -6.616 1.00 0.00 C ATOM 0 HA PRO A 40 5.552 2.653 -8.449 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.886 4.398 -6.436 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.336 2.736 -6.109 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.917 5.237 -5.696 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.966 3.734 -4.796 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.870 4.509 -6.720 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.657 2.870 -6.137 1.00 0.00 H new ATOM 160 N GLN A 41 6.657 5.590 -9.087 1.00 0.00 N ATOM 161 CA GLN A 41 6.375 6.781 -9.934 1.00 0.00 C ATOM 162 C GLN A 41 6.290 6.312 -11.389 1.00 0.00 C ATOM 163 O GLN A 41 5.502 6.807 -12.179 1.00 0.00 O ATOM 164 CB GLN A 41 7.521 7.793 -9.772 1.00 0.00 C ATOM 165 CG GLN A 41 7.311 8.994 -10.700 1.00 0.00 C ATOM 166 CD GLN A 41 6.037 9.739 -10.297 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.763 9.908 -9.125 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.240 10.194 -11.225 1.00 0.00 N ATOM 0 H GLN A 41 7.611 5.529 -8.731 1.00 0.00 H new ATOM 0 HA GLN A 41 5.440 7.258 -9.641 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.573 8.130 -8.737 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.473 7.313 -9.999 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.169 9.664 -10.644 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.236 8.658 -11.734 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.469 10.052 -12.209 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.388 10.691 -10.967 1.00 0.00 H new ATOM 177 N LEU A 42 7.103 5.353 -11.745 1.00 0.00 N ATOM 178 CA LEU A 42 7.089 4.843 -13.132 1.00 0.00 C ATOM 179 C LEU A 42 5.820 4.025 -13.356 1.00 0.00 C ATOM 180 O LEU A 42 5.067 4.289 -14.264 1.00 0.00 O ATOM 181 CB LEU A 42 8.323 3.956 -13.377 1.00 0.00 C ATOM 182 CG LEU A 42 9.679 4.731 -13.307 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.530 6.207 -12.889 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.603 4.031 -12.305 1.00 0.00 C ATOM 0 H LEU A 42 7.777 4.903 -11.125 1.00 0.00 H new ATOM 0 HA LEU A 42 7.111 5.684 -13.825 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.335 3.154 -12.639 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.233 3.487 -14.357 1.00 0.00 H new ATOM 0 HG LEU A 42 10.093 4.725 -14.316 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.512 6.679 -12.863 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.897 6.727 -13.608 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.075 6.261 -11.900 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.551 4.565 -12.250 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.134 4.023 -11.321 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.782 3.006 -12.630 1.00 0.00 H new ATOM 196 N ARG A 43 5.573 3.031 -12.531 1.00 0.00 N ATOM 197 CA ARG A 43 4.344 2.186 -12.705 1.00 0.00 C ATOM 198 C ARG A 43 3.099 3.069 -12.875 1.00 0.00 C ATOM 199 O ARG A 43 2.274 2.828 -13.740 1.00 0.00 O ATOM 200 CB ARG A 43 4.180 1.253 -11.495 1.00 0.00 C ATOM 201 CG ARG A 43 3.832 2.044 -10.231 1.00 0.00 C ATOM 202 CD ARG A 43 3.754 1.088 -9.040 1.00 0.00 C ATOM 203 NE ARG A 43 3.232 1.823 -7.845 1.00 0.00 N ATOM 204 CZ ARG A 43 3.327 1.316 -6.631 1.00 0.00 C ATOM 205 NH1 ARG A 43 3.880 0.144 -6.416 1.00 0.00 N ATOM 206 NH2 ARG A 43 2.858 1.995 -5.621 1.00 0.00 N ATOM 0 H ARG A 43 6.169 2.769 -11.746 1.00 0.00 H new ATOM 0 HA ARG A 43 4.456 1.583 -13.606 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.396 0.523 -11.698 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.102 0.694 -11.335 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.586 2.809 -10.048 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.880 2.559 -10.361 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.102 0.247 -9.277 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.740 0.676 -8.825 1.00 0.00 H new ATOM 0 HE ARG A 43 2.794 2.735 -7.972 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.249 -0.397 -7.198 1.00 0.00 H new ATOM 0 HH12 ARG A 43 3.941 -0.225 -5.467 1.00 0.00 H new ATOM 0 HH21 ARG A 43 2.425 2.905 -5.776 1.00 0.00 H new ATOM 0 HH22 ARG A 43 2.924 1.616 -4.677 1.00 0.00 H new ATOM 220 N LYS A 44 2.968 4.099 -12.074 1.00 0.00 N ATOM 221 CA LYS A 44 1.792 4.982 -12.218 1.00 0.00 C ATOM 222 C LYS A 44 1.877 5.693 -13.573 1.00 0.00 C ATOM 223 O LYS A 44 0.869 6.030 -14.166 1.00 0.00 O ATOM 224 CB LYS A 44 1.748 6.000 -11.073 1.00 0.00 C ATOM 225 CG LYS A 44 2.992 6.889 -11.105 1.00 0.00 C ATOM 226 CD LYS A 44 2.809 8.060 -10.138 1.00 0.00 C ATOM 227 CE LYS A 44 2.892 7.551 -8.698 1.00 0.00 C ATOM 228 NZ LYS A 44 3.056 8.706 -7.772 1.00 0.00 N ATOM 0 H LYS A 44 3.624 4.357 -11.336 1.00 0.00 H new ATOM 0 HA LYS A 44 0.877 4.392 -12.174 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.852 6.614 -11.158 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.689 5.480 -10.117 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.873 6.310 -10.828 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.160 7.261 -12.116 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.577 8.813 -10.313 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.846 8.540 -10.310 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.990 6.994 -8.445 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.731 6.864 -8.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.164 8.358 -6.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 3.901 9.249 -8.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.218 9.319 -7.830 1.00 0.00 H new ATOM 242 N ASP A 45 3.077 5.910 -14.075 1.00 0.00 N ATOM 243 CA ASP A 45 3.216 6.579 -15.392 1.00 0.00 C ATOM 244 C ASP A 45 2.622 5.678 -16.478 1.00 0.00 C ATOM 245 O ASP A 45 1.849 6.132 -17.293 1.00 0.00 O ATOM 246 CB ASP A 45 4.690 6.857 -15.693 1.00 0.00 C ATOM 247 CG ASP A 45 5.238 7.868 -14.684 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.490 8.747 -14.291 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.396 7.744 -14.321 1.00 0.00 O ATOM 0 H ASP A 45 3.954 5.650 -13.624 1.00 0.00 H new ATOM 0 HA ASP A 45 2.682 7.529 -15.372 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.263 5.931 -15.643 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.798 7.244 -16.706 1.00 0.00 H new ATOM 254 N ILE A 46 2.963 4.402 -16.497 1.00 0.00 N ATOM 255 CA ILE A 46 2.389 3.489 -17.540 1.00 0.00 C ATOM 256 C ILE A 46 0.857 3.527 -17.458 1.00 0.00 C ATOM 257 O ILE A 46 0.174 3.439 -18.460 1.00 0.00 O ATOM 258 CB ILE A 46 2.938 2.053 -17.366 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.880 1.351 -18.722 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.146 1.235 -16.332 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.866 2.010 -19.687 1.00 0.00 C ATOM 0 H ILE A 46 3.608 3.961 -15.841 1.00 0.00 H new ATOM 0 HA ILE A 46 2.689 3.828 -18.531 1.00 0.00 H new ATOM 0 HB ILE A 46 3.961 2.124 -16.997 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.121 0.294 -18.606 1.00 0.00 H new ATOM 0 HG13 ILE A 46 1.869 1.404 -19.127 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.576 0.236 -16.252 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.194 1.730 -15.362 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.106 1.158 -16.648 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.822 1.506 -20.653 1.00 0.00 H new ATOM 0 HD12 ILE A 46 3.605 3.061 -19.813 1.00 0.00 H new ATOM 0 HD13 ILE A 46 4.876 1.933 -19.284 1.00 0.00 H new ATOM 273 N LEU A 47 0.316 3.685 -16.271 1.00 0.00 N ATOM 274 CA LEU A 47 -1.163 3.762 -16.129 1.00 0.00 C ATOM 275 C LEU A 47 -1.652 4.994 -16.893 1.00 0.00 C ATOM 276 O LEU A 47 -2.629 4.948 -17.620 1.00 0.00 O ATOM 277 CB LEU A 47 -1.525 3.895 -14.648 1.00 0.00 C ATOM 278 CG LEU A 47 -1.474 2.520 -13.982 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.558 2.684 -12.464 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.654 1.676 -14.469 1.00 0.00 C ATOM 0 H LEU A 47 0.840 3.763 -15.399 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.632 2.862 -16.528 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.832 4.576 -14.154 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.522 4.324 -14.544 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.539 2.024 -14.242 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.522 1.703 -11.990 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.719 3.287 -12.116 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.493 3.179 -12.203 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.620 0.695 -13.995 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.589 2.172 -14.208 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.595 1.559 -15.551 1.00 0.00 H new ATOM 292 N GLU A 48 -0.947 6.088 -16.751 1.00 0.00 N ATOM 293 CA GLU A 48 -1.328 7.332 -17.479 1.00 0.00 C ATOM 294 C GLU A 48 -0.985 7.130 -18.951 1.00 0.00 C ATOM 295 O GLU A 48 -1.696 7.565 -19.834 1.00 0.00 O ATOM 296 CB GLU A 48 -0.554 8.559 -16.956 1.00 0.00 C ATOM 297 CG GLU A 48 -0.244 8.425 -15.458 1.00 0.00 C ATOM 298 CD GLU A 48 -0.486 9.763 -14.753 1.00 0.00 C ATOM 299 OE1 GLU A 48 -1.640 10.127 -14.596 1.00 0.00 O ATOM 300 OE2 GLU A 48 0.486 10.400 -14.384 1.00 0.00 O ATOM 0 H GLU A 48 -0.121 6.171 -16.159 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.392 7.517 -17.330 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.376 8.670 -17.514 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.139 9.462 -17.129 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.873 7.652 -15.016 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.791 8.113 -15.319 1.00 0.00 H new ATOM 307 N VAL A 49 0.108 6.454 -19.213 1.00 0.00 N ATOM 308 CA VAL A 49 0.520 6.194 -20.621 1.00 0.00 C ATOM 309 C VAL A 49 -0.579 5.380 -21.300 1.00 0.00 C ATOM 310 O VAL A 49 -1.176 5.818 -22.258 1.00 0.00 O ATOM 311 CB VAL A 49 1.840 5.417 -20.637 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.294 5.207 -22.085 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.913 6.208 -19.876 1.00 0.00 C ATOM 0 H VAL A 49 0.734 6.070 -18.505 1.00 0.00 H new ATOM 0 HA VAL A 49 0.666 7.134 -21.153 1.00 0.00 H new ATOM 0 HB VAL A 49 1.694 4.449 -20.157 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.233 4.654 -22.095 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.535 4.642 -22.626 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.438 6.175 -22.565 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.851 5.653 -19.889 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.058 7.177 -20.354 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.593 6.356 -18.845 1.00 0.00 H new ATOM 323 N ILE A 50 -0.885 4.212 -20.781 1.00 0.00 N ATOM 324 CA ILE A 50 -1.986 3.390 -21.377 1.00 0.00 C ATOM 325 C ILE A 50 -3.263 4.242 -21.435 1.00 0.00 C ATOM 326 O ILE A 50 -4.135 4.011 -22.247 1.00 0.00 O ATOM 327 CB ILE A 50 -2.224 2.141 -20.522 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.920 1.345 -20.409 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.296 1.266 -21.176 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.850 0.674 -19.036 1.00 0.00 C ATOM 0 H ILE A 50 -0.421 3.795 -19.974 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.710 3.074 -22.383 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.558 2.442 -19.529 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.871 0.593 -21.196 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.065 2.006 -20.547 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.463 0.378 -20.566 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.225 1.830 -21.259 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.964 0.966 -22.170 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.078 0.107 -18.955 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.879 1.436 -18.257 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.698 0.000 -18.917 1.00 0.00 H new ATOM 342 N CYS A 51 -3.363 5.237 -20.582 1.00 0.00 N ATOM 343 CA CYS A 51 -4.552 6.123 -20.590 1.00 0.00 C ATOM 344 C CYS A 51 -4.481 7.055 -21.809 1.00 0.00 C ATOM 345 O CYS A 51 -5.446 7.233 -22.520 1.00 0.00 O ATOM 346 CB CYS A 51 -4.571 6.954 -19.302 1.00 0.00 C ATOM 347 SG CYS A 51 -6.241 7.592 -19.019 1.00 0.00 S ATOM 0 H CYS A 51 -2.661 5.467 -19.879 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.461 5.524 -20.647 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.256 6.342 -18.457 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -3.863 7.779 -19.379 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.257 8.295 -17.926 1.00 0.00 H new ATOM 353 N LYS A 52 -3.339 7.648 -22.055 1.00 0.00 N ATOM 354 CA LYS A 52 -3.200 8.573 -23.228 1.00 0.00 C ATOM 355 C LYS A 52 -3.537 7.834 -24.525 1.00 0.00 C ATOM 356 O LYS A 52 -4.046 8.413 -25.466 1.00 0.00 O ATOM 357 CB LYS A 52 -1.760 9.085 -23.333 1.00 0.00 C ATOM 358 CG LYS A 52 -1.324 9.741 -22.021 1.00 0.00 C ATOM 359 CD LYS A 52 0.177 9.498 -21.810 1.00 0.00 C ATOM 360 CE LYS A 52 0.969 10.741 -22.229 1.00 0.00 C ATOM 361 NZ LYS A 52 1.391 11.493 -21.012 1.00 0.00 N ATOM 0 H LYS A 52 -2.494 7.533 -21.495 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.885 9.408 -23.081 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.091 8.258 -23.572 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.683 9.804 -24.149 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.531 10.811 -22.049 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.892 9.328 -21.188 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.373 9.266 -20.763 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.501 8.636 -22.393 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.843 10.450 -22.811 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.357 11.377 -22.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.929 12.337 -21.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 0.550 11.783 -20.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.989 10.884 -20.418 1.00 0.00 H new ATOM 375 N TYR A 53 -3.236 6.566 -24.583 1.00 0.00 N ATOM 376 CA TYR A 53 -3.507 5.775 -25.810 1.00 0.00 C ATOM 377 C TYR A 53 -4.782 4.932 -25.629 1.00 0.00 C ATOM 378 O TYR A 53 -5.313 4.397 -26.583 1.00 0.00 O ATOM 379 CB TYR A 53 -2.321 4.833 -26.062 1.00 0.00 C ATOM 380 CG TYR A 53 -1.038 5.611 -26.291 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.472 6.370 -25.256 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.393 5.547 -27.532 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.727 7.059 -25.458 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.808 6.242 -27.735 1.00 0.00 C ATOM 385 CZ TYR A 53 1.367 6.997 -26.695 1.00 0.00 C ATOM 386 OH TYR A 53 2.550 7.676 -26.895 1.00 0.00 O ATOM 0 H TYR A 53 -2.808 6.040 -23.821 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.644 6.454 -26.652 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.197 4.165 -25.210 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.529 4.207 -26.930 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.966 6.422 -24.297 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.820 4.962 -28.333 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.158 7.640 -24.656 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.303 6.195 -28.694 1.00 0.00 H new ATOM 0 HH TYR A 53 2.863 7.525 -27.812 1.00 0.00 H new ATOM 396 N VAL A 54 -5.266 4.791 -24.413 1.00 0.00 N ATOM 397 CA VAL A 54 -6.495 3.961 -24.171 1.00 0.00 C ATOM 398 C VAL A 54 -7.222 4.526 -22.927 1.00 0.00 C ATOM 399 O VAL A 54 -7.332 5.726 -22.781 1.00 0.00 O ATOM 400 CB VAL A 54 -6.107 2.475 -23.961 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.307 1.590 -24.303 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.933 2.075 -24.864 1.00 0.00 C ATOM 0 H VAL A 54 -4.863 5.215 -23.578 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.159 4.007 -25.034 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.811 2.344 -22.920 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.040 0.543 -24.157 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.144 1.845 -23.653 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.593 1.750 -25.343 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.684 1.028 -24.694 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.212 2.217 -25.908 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.068 2.696 -24.632 1.00 0.00 H new ATOM 412 N GLN A 55 -7.728 3.695 -22.031 1.00 0.00 N ATOM 413 CA GLN A 55 -8.427 4.231 -20.827 1.00 0.00 C ATOM 414 C GLN A 55 -8.757 3.080 -19.874 1.00 0.00 C ATOM 415 O GLN A 55 -9.630 2.274 -20.134 1.00 0.00 O ATOM 416 CB GLN A 55 -9.716 4.937 -21.256 1.00 0.00 C ATOM 417 CG GLN A 55 -9.718 6.379 -20.740 1.00 0.00 C ATOM 418 CD GLN A 55 -11.134 6.952 -20.823 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.674 7.111 -21.900 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.762 7.270 -19.725 1.00 0.00 N ATOM 0 H GLN A 55 -7.683 2.678 -22.090 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.780 4.945 -20.317 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.800 4.930 -22.343 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.581 4.401 -20.866 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.363 6.408 -19.710 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.033 6.988 -21.330 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.309 7.136 -18.821 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.707 7.652 -19.770 1.00 0.00 H new ATOM 429 N ILE A 56 -8.057 3.003 -18.777 1.00 0.00 N ATOM 430 CA ILE A 56 -8.305 1.909 -17.789 1.00 0.00 C ATOM 431 C ILE A 56 -8.194 2.469 -16.373 1.00 0.00 C ATOM 432 O ILE A 56 -7.744 3.581 -16.169 1.00 0.00 O ATOM 433 CB ILE A 56 -7.276 0.785 -17.975 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.889 1.377 -18.272 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.710 -0.107 -19.137 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.822 0.595 -17.505 1.00 0.00 C ATOM 0 H ILE A 56 -7.317 3.655 -18.518 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.305 1.506 -17.949 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.219 0.198 -17.058 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.686 1.335 -19.342 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.862 2.428 -17.984 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.982 -0.907 -19.273 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.687 -0.538 -18.919 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.771 0.487 -20.049 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.839 1.016 -17.717 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -5.022 0.660 -16.435 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.843 -0.450 -17.815 1.00 0.00 H new ATOM 448 N ASP A 57 -8.597 1.703 -15.393 1.00 0.00 N ATOM 449 CA ASP A 57 -8.516 2.175 -13.983 1.00 0.00 C ATOM 450 C ASP A 57 -7.292 1.538 -13.310 1.00 0.00 C ATOM 451 O ASP A 57 -6.752 0.577 -13.822 1.00 0.00 O ATOM 452 CB ASP A 57 -9.784 1.760 -13.235 1.00 0.00 C ATOM 453 CG ASP A 57 -10.861 2.829 -13.424 1.00 0.00 C ATOM 454 OD1 ASP A 57 -11.277 3.031 -14.553 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.253 3.427 -12.435 1.00 0.00 O ATOM 0 H ASP A 57 -8.981 0.765 -15.512 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.423 3.261 -13.962 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.141 0.800 -13.607 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.567 1.630 -12.175 1.00 0.00 H new ATOM 460 N PRO A 58 -6.880 2.074 -12.178 1.00 0.00 N ATOM 461 CA PRO A 58 -5.703 1.548 -11.416 1.00 0.00 C ATOM 462 C PRO A 58 -6.072 0.235 -10.735 1.00 0.00 C ATOM 463 O PRO A 58 -5.245 -0.643 -10.570 1.00 0.00 O ATOM 464 CB PRO A 58 -5.398 2.646 -10.406 1.00 0.00 C ATOM 465 CG PRO A 58 -6.676 3.433 -10.213 1.00 0.00 C ATOM 466 CD PRO A 58 -7.511 3.257 -11.482 1.00 0.00 C ATOM 0 HA PRO A 58 -4.839 1.328 -12.043 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.061 2.219 -9.461 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.598 3.292 -10.767 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.221 3.073 -9.341 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.457 4.487 -10.040 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.559 3.069 -11.247 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.480 4.150 -12.106 1.00 0.00 H new ATOM 474 N GLU A 59 -7.319 0.082 -10.375 1.00 0.00 N ATOM 475 CA GLU A 59 -7.763 -1.190 -9.740 1.00 0.00 C ATOM 476 C GLU A 59 -7.716 -2.320 -10.783 1.00 0.00 C ATOM 477 O GLU A 59 -7.813 -3.484 -10.443 1.00 0.00 O ATOM 478 CB GLU A 59 -9.195 -1.030 -9.224 1.00 0.00 C ATOM 479 CG GLU A 59 -9.190 -0.155 -7.969 1.00 0.00 C ATOM 480 CD GLU A 59 -10.555 -0.238 -7.283 1.00 0.00 C ATOM 481 OE1 GLU A 59 -10.953 -1.337 -6.930 1.00 0.00 O ATOM 482 OE2 GLU A 59 -11.179 0.798 -7.123 1.00 0.00 O ATOM 0 H GLU A 59 -8.049 0.785 -10.494 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.104 -1.433 -8.907 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.822 -0.578 -9.993 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.623 -2.007 -8.998 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.407 -0.485 -7.286 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -8.967 0.878 -8.234 1.00 0.00 H new ATOM 489 N MET A 60 -7.565 -1.989 -12.050 1.00 0.00 N ATOM 490 CA MET A 60 -7.509 -3.038 -13.104 1.00 0.00 C ATOM 491 C MET A 60 -6.055 -3.472 -13.323 1.00 0.00 C ATOM 492 O MET A 60 -5.791 -4.557 -13.803 1.00 0.00 O ATOM 493 CB MET A 60 -8.070 -2.462 -14.407 1.00 0.00 C ATOM 494 CG MET A 60 -9.604 -2.489 -14.367 1.00 0.00 C ATOM 495 SD MET A 60 -10.221 -3.914 -15.298 1.00 0.00 S ATOM 496 CE MET A 60 -10.140 -3.162 -16.942 1.00 0.00 C ATOM 0 H MET A 60 -7.479 -1.032 -12.391 1.00 0.00 H new ATOM 0 HA MET A 60 -8.098 -3.902 -12.795 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.718 -1.440 -14.545 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.709 -3.041 -15.257 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.948 -2.542 -13.334 1.00 0.00 H new ATOM 0 HG3 MET A 60 -10.004 -1.567 -14.790 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.883 -3.924 -17.678 1.00 0.00 H new ATOM 0 HE2 MET A 60 -11.108 -2.728 -17.192 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.380 -2.381 -16.948 1.00 0.00 H new ATOM 506 N VAL A 61 -5.110 -2.627 -12.980 1.00 0.00 N ATOM 507 CA VAL A 61 -3.673 -2.984 -13.173 1.00 0.00 C ATOM 508 C VAL A 61 -3.081 -3.472 -11.847 1.00 0.00 C ATOM 509 O VAL A 61 -3.116 -2.776 -10.849 1.00 0.00 O ATOM 510 CB VAL A 61 -2.907 -1.748 -13.652 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.473 -2.140 -14.010 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.599 -1.169 -14.889 1.00 0.00 C ATOM 0 H VAL A 61 -5.275 -1.706 -12.575 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.591 -3.777 -13.916 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.891 -1.001 -12.858 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.929 -1.259 -14.351 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.979 -2.554 -13.131 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.487 -2.887 -14.804 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.055 -0.289 -15.232 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.614 -1.917 -15.681 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.621 -0.888 -14.636 1.00 0.00 H new ATOM 522 N THR A 62 -2.538 -4.664 -11.833 1.00 0.00 N ATOM 523 CA THR A 62 -1.944 -5.209 -10.581 1.00 0.00 C ATOM 524 C THR A 62 -0.468 -4.820 -10.496 1.00 0.00 C ATOM 525 O THR A 62 0.171 -4.540 -11.493 1.00 0.00 O ATOM 526 CB THR A 62 -2.056 -6.736 -10.577 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.335 -7.119 -11.064 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.870 -7.259 -9.153 1.00 0.00 C ATOM 0 H THR A 62 -2.482 -5.284 -12.641 1.00 0.00 H new ATOM 0 HA THR A 62 -2.482 -4.798 -9.727 1.00 0.00 H new ATOM 0 HB THR A 62 -1.283 -7.158 -11.219 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.406 -8.096 -11.063 1.00 0.00 H new ATOM 0 HG21 THR A 62 -1.950 -8.346 -9.151 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.887 -6.967 -8.784 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.640 -6.838 -8.507 1.00 0.00 H new ATOM 536 N VAL A 63 0.076 -4.813 -9.308 1.00 0.00 N ATOM 537 CA VAL A 63 1.512 -4.458 -9.131 1.00 0.00 C ATOM 538 C VAL A 63 2.107 -5.358 -8.050 1.00 0.00 C ATOM 539 O VAL A 63 1.630 -5.390 -6.930 1.00 0.00 O ATOM 540 CB VAL A 63 1.626 -2.999 -8.699 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.101 -2.594 -8.639 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.897 -2.114 -9.709 1.00 0.00 C ATOM 0 H VAL A 63 -0.419 -5.040 -8.446 1.00 0.00 H new ATOM 0 HA VAL A 63 2.049 -4.596 -10.069 1.00 0.00 H new ATOM 0 HB VAL A 63 1.177 -2.877 -7.713 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.180 -1.552 -8.330 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.623 -3.226 -7.920 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.552 -2.716 -9.624 1.00 0.00 H new ATOM 0 HG21 VAL A 63 0.977 -1.071 -9.403 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.347 -2.239 -10.694 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.154 -2.400 -9.752 1.00 0.00 H new ATOM 552 N GLN A 64 3.135 -6.094 -8.377 1.00 0.00 N ATOM 553 CA GLN A 64 3.752 -7.002 -7.371 1.00 0.00 C ATOM 554 C GLN A 64 5.271 -6.999 -7.530 1.00 0.00 C ATOM 555 O GLN A 64 5.793 -7.260 -8.597 1.00 0.00 O ATOM 556 CB GLN A 64 3.203 -8.418 -7.574 1.00 0.00 C ATOM 557 CG GLN A 64 3.473 -8.877 -9.014 1.00 0.00 C ATOM 558 CD GLN A 64 2.255 -9.633 -9.550 1.00 0.00 C ATOM 559 OE1 GLN A 64 2.091 -10.808 -9.286 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.390 -9.005 -10.299 1.00 0.00 N ATOM 0 H GLN A 64 3.573 -6.105 -9.298 1.00 0.00 H new ATOM 0 HA GLN A 64 3.508 -6.658 -6.366 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.672 -9.105 -6.869 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.132 -8.436 -7.371 1.00 0.00 H new ATOM 0 HG2 GLN A 64 3.686 -8.016 -9.647 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.353 -9.519 -9.043 1.00 0.00 H new ATOM 0 HE21 GLN A 64 1.528 -8.019 -10.520 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.576 -9.500 -10.663 1.00 0.00 H new ATOM 569 N LEU A 65 5.982 -6.695 -6.473 1.00 0.00 N ATOM 570 CA LEU A 65 7.466 -6.658 -6.549 1.00 0.00 C ATOM 571 C LEU A 65 8.059 -7.976 -6.056 1.00 0.00 C ATOM 572 O LEU A 65 7.538 -8.613 -5.160 1.00 0.00 O ATOM 573 CB LEU A 65 7.989 -5.512 -5.683 1.00 0.00 C ATOM 574 CG LEU A 65 7.422 -5.628 -4.258 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.555 -5.486 -3.238 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.390 -4.522 -4.023 1.00 0.00 C ATOM 0 H LEU A 65 5.592 -6.470 -5.558 1.00 0.00 H new ATOM 0 HA LEU A 65 7.762 -6.505 -7.587 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.078 -5.536 -5.653 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.703 -4.555 -6.120 1.00 0.00 H new ATOM 0 HG LEU A 65 6.947 -6.602 -4.141 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.149 -5.569 -2.230 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.290 -6.274 -3.399 1.00 0.00 H new ATOM 0 HD13 LEU A 65 9.033 -4.514 -3.358 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.990 -4.606 -3.013 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.866 -3.549 -4.145 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.579 -4.622 -4.744 1.00 0.00 H new ATOM 588 N GLU A 66 9.156 -8.376 -6.640 1.00 0.00 N ATOM 589 CA GLU A 66 9.823 -9.641 -6.230 1.00 0.00 C ATOM 590 C GLU A 66 11.321 -9.372 -6.080 1.00 0.00 C ATOM 591 O GLU A 66 11.777 -8.264 -6.288 1.00 0.00 O ATOM 592 CB GLU A 66 9.589 -10.712 -7.303 1.00 0.00 C ATOM 593 CG GLU A 66 8.188 -11.310 -7.160 1.00 0.00 C ATOM 594 CD GLU A 66 8.039 -11.981 -5.790 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.832 -12.860 -5.494 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.134 -11.604 -5.063 1.00 0.00 O ATOM 0 H GLU A 66 9.623 -7.872 -7.394 1.00 0.00 H new ATOM 0 HA GLU A 66 9.414 -9.995 -5.284 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.706 -10.275 -8.295 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.338 -11.498 -7.211 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.437 -10.528 -7.274 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.013 -12.039 -7.951 1.00 0.00 H new ATOM 603 N GLN A 67 12.090 -10.368 -5.715 1.00 0.00 N ATOM 604 CA GLN A 67 13.559 -10.153 -5.549 1.00 0.00 C ATOM 605 C GLN A 67 14.317 -11.446 -5.855 1.00 0.00 C ATOM 606 O GLN A 67 13.760 -12.527 -5.823 1.00 0.00 O ATOM 607 CB GLN A 67 13.850 -9.720 -4.111 1.00 0.00 C ATOM 608 CG GLN A 67 13.011 -8.486 -3.767 1.00 0.00 C ATOM 609 CD GLN A 67 13.420 -7.955 -2.393 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.589 -7.909 -2.068 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.497 -7.546 -1.565 1.00 0.00 N ATOM 0 H GLN A 67 11.765 -11.316 -5.526 1.00 0.00 H new ATOM 0 HA GLN A 67 13.886 -9.377 -6.241 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.620 -10.533 -3.422 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.910 -9.495 -3.996 1.00 0.00 H new ATOM 0 HG2 GLN A 67 13.154 -7.714 -4.524 1.00 0.00 H new ATOM 0 HG3 GLN A 67 11.952 -8.742 -3.769 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.515 -7.584 -1.837 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.758 -7.188 -0.646 1.00 0.00 H new ATOM 620 N LYS A 68 15.587 -11.335 -6.150 1.00 0.00 N ATOM 621 CA LYS A 68 16.404 -12.546 -6.459 1.00 0.00 C ATOM 622 C LYS A 68 17.511 -12.692 -5.413 1.00 0.00 C ATOM 623 O LYS A 68 17.790 -11.774 -4.663 1.00 0.00 O ATOM 624 CB LYS A 68 17.033 -12.395 -7.847 1.00 0.00 C ATOM 625 CG LYS A 68 15.930 -12.275 -8.908 1.00 0.00 C ATOM 626 CD LYS A 68 16.249 -11.119 -9.862 1.00 0.00 C ATOM 627 CE LYS A 68 17.528 -11.432 -10.639 1.00 0.00 C ATOM 628 NZ LYS A 68 17.315 -12.646 -11.476 1.00 0.00 N ATOM 0 H LYS A 68 16.096 -10.452 -6.190 1.00 0.00 H new ATOM 0 HA LYS A 68 15.767 -13.430 -6.442 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.672 -11.512 -7.872 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.667 -13.254 -8.064 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.848 -13.207 -9.467 1.00 0.00 H new ATOM 0 HG3 LYS A 68 14.967 -12.106 -8.427 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.420 -10.966 -10.553 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.371 -10.193 -9.300 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.800 -10.585 -11.270 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.356 -11.594 -9.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 17.990 -12.645 -12.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.462 -13.497 -10.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.344 -12.644 -11.849 1.00 0.00 H new ATOM 642 N ASP A 69 18.139 -13.838 -5.356 1.00 0.00 N ATOM 643 CA ASP A 69 19.226 -14.056 -4.363 1.00 0.00 C ATOM 644 C ASP A 69 20.526 -13.421 -4.874 1.00 0.00 C ATOM 645 O ASP A 69 21.524 -14.092 -5.069 1.00 0.00 O ATOM 646 CB ASP A 69 19.427 -15.559 -4.152 1.00 0.00 C ATOM 647 CG ASP A 69 18.227 -16.134 -3.398 1.00 0.00 C ATOM 648 OD1 ASP A 69 18.154 -15.933 -2.197 1.00 0.00 O ATOM 649 OD2 ASP A 69 17.401 -16.768 -4.035 1.00 0.00 O ATOM 0 H ASP A 69 17.942 -14.636 -5.960 1.00 0.00 H new ATOM 0 HA ASP A 69 18.953 -13.593 -3.415 1.00 0.00 H new ATOM 0 HB2 ASP A 69 19.540 -16.060 -5.113 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.343 -15.739 -3.590 1.00 0.00 H new ATOM 654 N GLY A 70 20.520 -12.129 -5.093 1.00 0.00 N ATOM 655 CA GLY A 70 21.749 -11.443 -5.591 1.00 0.00 C ATOM 656 C GLY A 70 21.580 -9.926 -5.469 1.00 0.00 C ATOM 657 O GLY A 70 22.097 -9.172 -6.270 1.00 0.00 O ATOM 0 H GLY A 70 19.715 -11.520 -4.948 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.617 -11.769 -5.017 1.00 0.00 H new ATOM 0 HA3 GLY A 70 21.933 -11.715 -6.630 1.00 0.00 H new ATOM 661 N ASP A 71 20.850 -9.479 -4.477 1.00 0.00 N ATOM 662 CA ASP A 71 20.626 -8.012 -4.289 1.00 0.00 C ATOM 663 C ASP A 71 19.938 -7.444 -5.529 1.00 0.00 C ATOM 664 O ASP A 71 20.311 -6.405 -6.043 1.00 0.00 O ATOM 665 CB ASP A 71 21.968 -7.303 -4.064 1.00 0.00 C ATOM 666 CG ASP A 71 22.403 -7.484 -2.609 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.708 -6.989 -1.737 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.425 -8.114 -2.390 1.00 0.00 O ATOM 0 H ASP A 71 20.396 -10.073 -3.783 1.00 0.00 H new ATOM 0 HA ASP A 71 19.993 -7.850 -3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.724 -7.712 -4.734 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.875 -6.242 -4.298 1.00 0.00 H new ATOM 673 N ILE A 72 18.944 -8.135 -6.017 1.00 0.00 N ATOM 674 CA ILE A 72 18.223 -7.667 -7.234 1.00 0.00 C ATOM 675 C ILE A 72 16.720 -7.623 -6.944 1.00 0.00 C ATOM 676 O ILE A 72 16.240 -8.264 -6.028 1.00 0.00 O ATOM 677 CB ILE A 72 18.506 -8.630 -8.394 1.00 0.00 C ATOM 678 CG1 ILE A 72 20.016 -8.952 -8.435 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.065 -7.971 -9.707 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.375 -9.762 -9.692 1.00 0.00 C ATOM 0 H ILE A 72 18.599 -9.010 -5.622 1.00 0.00 H new ATOM 0 HA ILE A 72 18.565 -6.669 -7.507 1.00 0.00 H new ATOM 0 HB ILE A 72 17.953 -9.559 -8.256 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.589 -8.025 -8.420 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.296 -9.514 -7.544 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.262 -8.648 -10.538 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.998 -7.751 -9.663 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.621 -7.045 -9.854 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.444 -9.975 -9.695 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.819 -10.699 -9.692 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.117 -9.187 -10.581 1.00 0.00 H new ATOM 692 N SER A 73 15.975 -6.869 -7.715 1.00 0.00 N ATOM 693 CA SER A 73 14.503 -6.775 -7.483 1.00 0.00 C ATOM 694 C SER A 73 13.757 -7.121 -8.771 1.00 0.00 C ATOM 695 O SER A 73 14.344 -7.222 -9.831 1.00 0.00 O ATOM 696 CB SER A 73 14.146 -5.352 -7.055 1.00 0.00 C ATOM 697 OG SER A 73 14.997 -4.954 -5.988 1.00 0.00 O ATOM 0 H SER A 73 16.325 -6.314 -8.496 1.00 0.00 H new ATOM 0 HA SER A 73 14.215 -7.475 -6.699 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.256 -4.669 -7.897 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.103 -5.305 -6.740 1.00 0.00 H new ATOM 0 HG SER A 73 14.771 -4.041 -5.713 1.00 0.00 H new ATOM 703 N ILE A 74 12.467 -7.310 -8.678 1.00 0.00 N ATOM 704 CA ILE A 74 11.661 -7.662 -9.883 1.00 0.00 C ATOM 705 C ILE A 74 10.252 -7.068 -9.730 1.00 0.00 C ATOM 706 O ILE A 74 9.352 -7.712 -9.227 1.00 0.00 O ATOM 707 CB ILE A 74 11.594 -9.195 -9.997 1.00 0.00 C ATOM 708 CG1 ILE A 74 12.996 -9.735 -10.327 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.598 -9.612 -11.094 1.00 0.00 C ATOM 710 CD1 ILE A 74 12.954 -11.259 -10.515 1.00 0.00 C ATOM 0 H ILE A 74 11.934 -7.235 -7.812 1.00 0.00 H new ATOM 0 HA ILE A 74 12.117 -7.257 -10.786 1.00 0.00 H new ATOM 0 HB ILE A 74 11.252 -9.611 -9.049 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.371 -9.261 -11.234 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.689 -9.480 -9.525 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.564 -10.699 -11.160 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.606 -9.232 -10.848 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.918 -9.200 -12.051 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.954 -11.625 -10.748 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.600 -11.729 -9.597 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.278 -11.506 -11.333 1.00 0.00 H new ATOM 722 N LEU A 75 10.062 -5.848 -10.164 1.00 0.00 N ATOM 723 CA LEU A 75 8.723 -5.207 -10.048 1.00 0.00 C ATOM 724 C LEU A 75 7.827 -5.658 -11.200 1.00 0.00 C ATOM 725 O LEU A 75 7.965 -5.210 -12.321 1.00 0.00 O ATOM 726 CB LEU A 75 8.881 -3.685 -10.086 1.00 0.00 C ATOM 727 CG LEU A 75 7.564 -3.011 -9.654 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.808 -2.138 -8.420 1.00 0.00 C ATOM 729 CD2 LEU A 75 7.034 -2.136 -10.797 1.00 0.00 C ATOM 0 H LEU A 75 10.782 -5.268 -10.595 1.00 0.00 H new ATOM 0 HA LEU A 75 8.265 -5.503 -9.104 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.691 -3.378 -9.424 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.152 -3.364 -11.092 1.00 0.00 H new ATOM 0 HG LEU A 75 6.832 -3.782 -9.413 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.874 -1.664 -8.119 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.180 -2.757 -7.604 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.544 -1.370 -8.657 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.103 -1.660 -10.489 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.770 -1.370 -11.040 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.852 -2.755 -11.675 1.00 0.00 H new ATOM 741 N GLU A 76 6.903 -6.537 -10.919 1.00 0.00 N ATOM 742 CA GLU A 76 5.974 -7.026 -11.976 1.00 0.00 C ATOM 743 C GLU A 76 4.646 -6.280 -11.839 1.00 0.00 C ATOM 744 O GLU A 76 4.290 -5.837 -10.765 1.00 0.00 O ATOM 745 CB GLU A 76 5.728 -8.529 -11.795 1.00 0.00 C ATOM 746 CG GLU A 76 7.063 -9.267 -11.652 1.00 0.00 C ATOM 747 CD GLU A 76 6.810 -10.679 -11.123 1.00 0.00 C ATOM 748 OE1 GLU A 76 5.958 -10.824 -10.262 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.473 -11.593 -11.586 1.00 0.00 O ATOM 0 H GLU A 76 6.752 -6.940 -9.994 1.00 0.00 H new ATOM 0 HA GLU A 76 6.409 -6.850 -12.960 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.112 -8.701 -10.912 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.177 -8.921 -12.650 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.570 -9.314 -12.616 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.720 -8.724 -10.972 1.00 0.00 H new ATOM 756 N LEU A 77 3.911 -6.140 -12.912 1.00 0.00 N ATOM 757 CA LEU A 77 2.603 -5.427 -12.829 1.00 0.00 C ATOM 758 C LEU A 77 1.644 -5.990 -13.879 1.00 0.00 C ATOM 759 O LEU A 77 1.964 -6.077 -15.048 1.00 0.00 O ATOM 760 CB LEU A 77 2.808 -3.923 -13.061 1.00 0.00 C ATOM 761 CG LEU A 77 3.618 -3.686 -14.339 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.257 -2.319 -14.922 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.113 -3.715 -14.007 1.00 0.00 C ATOM 0 H LEU A 77 4.159 -6.487 -13.838 1.00 0.00 H new ATOM 0 HA LEU A 77 2.177 -5.575 -11.837 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.841 -3.425 -13.138 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.326 -3.484 -12.208 1.00 0.00 H new ATOM 0 HG LEU A 77 3.389 -4.466 -15.065 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.832 -2.148 -15.832 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.193 -2.293 -15.155 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.488 -1.541 -14.195 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.691 -3.546 -14.916 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.340 -2.933 -13.282 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.374 -4.686 -13.586 1.00 0.00 H new ATOM 775 N ASN A 78 0.468 -6.376 -13.465 1.00 0.00 N ATOM 776 CA ASN A 78 -0.520 -6.931 -14.424 1.00 0.00 C ATOM 777 C ASN A 78 -1.362 -5.787 -14.973 1.00 0.00 C ATOM 778 O ASN A 78 -1.684 -4.856 -14.262 1.00 0.00 O ATOM 779 CB ASN A 78 -1.438 -7.910 -13.700 1.00 0.00 C ATOM 780 CG ASN A 78 -0.620 -8.900 -12.855 1.00 0.00 C ATOM 781 OD1 ASN A 78 -1.072 -9.341 -11.816 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.567 -9.271 -13.255 1.00 0.00 N ATOM 0 H ASN A 78 0.150 -6.329 -12.497 1.00 0.00 H new ATOM 0 HA ASN A 78 0.000 -7.445 -15.232 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.129 -7.362 -13.059 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.041 -8.456 -14.426 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.111 -9.928 -12.696 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.950 -8.903 -14.126 1.00 0.00 H new ATOM 789 N VAL A 79 -1.722 -5.846 -16.225 1.00 0.00 N ATOM 790 CA VAL A 79 -2.547 -4.755 -16.813 1.00 0.00 C ATOM 791 C VAL A 79 -3.835 -5.342 -17.391 1.00 0.00 C ATOM 792 O VAL A 79 -3.899 -5.695 -18.554 1.00 0.00 O ATOM 793 CB VAL A 79 -1.759 -4.055 -17.916 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.526 -2.815 -18.369 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.386 -3.639 -17.376 1.00 0.00 C ATOM 0 H VAL A 79 -1.481 -6.602 -16.866 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.798 -4.032 -16.037 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.626 -4.732 -18.760 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.968 -2.310 -19.157 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.504 -3.111 -18.749 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.654 -2.138 -17.525 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.178 -3.139 -18.163 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.517 -2.958 -16.535 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.158 -4.524 -17.046 1.00 0.00 H new ATOM 805 N THR A 80 -4.860 -5.447 -16.583 1.00 0.00 N ATOM 806 CA THR A 80 -6.151 -6.012 -17.072 1.00 0.00 C ATOM 807 C THR A 80 -6.916 -4.941 -17.852 1.00 0.00 C ATOM 808 O THR A 80 -7.593 -4.110 -17.278 1.00 0.00 O ATOM 809 CB THR A 80 -6.993 -6.470 -15.879 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.229 -7.359 -15.076 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.249 -7.184 -16.383 1.00 0.00 C ATOM 0 H THR A 80 -4.856 -5.164 -15.603 1.00 0.00 H new ATOM 0 HA THR A 80 -5.950 -6.862 -17.724 1.00 0.00 H new ATOM 0 HB THR A 80 -7.285 -5.604 -15.285 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.811 -6.861 -14.343 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.848 -7.510 -15.533 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.834 -6.500 -16.998 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.961 -8.051 -16.977 1.00 0.00 H new ATOM 819 N LEU A 81 -6.811 -4.957 -19.156 1.00 0.00 N ATOM 820 CA LEU A 81 -7.525 -3.951 -19.984 1.00 0.00 C ATOM 821 C LEU A 81 -8.918 -4.497 -20.354 1.00 0.00 C ATOM 822 O LEU A 81 -9.044 -5.669 -20.645 1.00 0.00 O ATOM 823 CB LEU A 81 -6.717 -3.706 -21.256 1.00 0.00 C ATOM 824 CG LEU A 81 -5.315 -3.217 -20.883 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.300 -3.742 -21.902 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.294 -1.686 -20.883 1.00 0.00 C ATOM 0 H LEU A 81 -6.256 -5.631 -19.683 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.639 -3.018 -19.431 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.650 -4.624 -21.840 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.218 -2.966 -21.881 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.054 -3.585 -19.891 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.303 -3.393 -21.635 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.315 -4.832 -21.902 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.559 -3.375 -22.895 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.296 -1.336 -20.618 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.556 -1.319 -21.875 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.015 -1.312 -20.156 1.00 0.00 H new ATOM 838 N PRO A 82 -9.930 -3.647 -20.335 1.00 0.00 N ATOM 839 CA PRO A 82 -11.336 -4.041 -20.671 1.00 0.00 C ATOM 840 C PRO A 82 -11.568 -3.979 -22.184 1.00 0.00 C ATOM 841 O PRO A 82 -10.667 -3.682 -22.946 1.00 0.00 O ATOM 842 CB PRO A 82 -12.177 -2.996 -19.953 1.00 0.00 C ATOM 843 CG PRO A 82 -11.307 -1.764 -19.772 1.00 0.00 C ATOM 844 CD PRO A 82 -9.851 -2.182 -19.987 1.00 0.00 C ATOM 0 HA PRO A 82 -11.577 -5.061 -20.371 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -13.068 -2.755 -20.532 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.516 -3.372 -18.988 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.591 -0.989 -20.484 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.441 -1.345 -18.774 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.387 -1.607 -20.789 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.254 -2.018 -19.090 1.00 0.00 H new ATOM 976 N SER B 32 1.968 -10.810 -31.863 1.00 0.00 N ATOM 977 CA SER B 32 0.566 -10.783 -31.351 1.00 0.00 C ATOM 978 C SER B 32 0.256 -9.416 -30.732 1.00 0.00 C ATOM 979 O SER B 32 -0.893 -9.039 -30.599 1.00 0.00 O ATOM 980 CB SER B 32 0.389 -11.868 -30.292 1.00 0.00 C ATOM 981 OG SER B 32 1.087 -13.039 -30.695 1.00 0.00 O ATOM 0 HA SER B 32 -0.117 -10.963 -32.181 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.767 -11.519 -29.331 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.669 -12.091 -30.157 1.00 0.00 H new ATOM 0 HG SER B 32 1.876 -12.786 -31.218 1.00 0.00 H new ATOM 987 N ASP B 33 1.267 -8.670 -30.352 1.00 0.00 N ATOM 988 CA ASP B 33 1.025 -7.332 -29.744 1.00 0.00 C ATOM 989 C ASP B 33 0.905 -6.257 -30.833 1.00 0.00 C ATOM 990 O ASP B 33 0.939 -5.077 -30.543 1.00 0.00 O ATOM 991 CB ASP B 33 2.176 -6.976 -28.805 1.00 0.00 C ATOM 992 CG ASP B 33 3.504 -7.075 -29.560 1.00 0.00 C ATOM 993 OD1 ASP B 33 3.677 -6.331 -30.511 1.00 0.00 O ATOM 994 OD2 ASP B 33 4.323 -7.892 -29.173 1.00 0.00 O ATOM 0 H ASP B 33 2.248 -8.934 -30.439 1.00 0.00 H new ATOM 0 HA ASP B 33 0.091 -7.371 -29.183 1.00 0.00 H new ATOM 0 HB2 ASP B 33 2.042 -5.967 -28.415 1.00 0.00 H new ATOM 0 HB3 ASP B 33 2.182 -7.650 -27.949 1.00 0.00 H new ATOM 999 N ALA B 34 0.759 -6.645 -32.078 1.00 0.00 N ATOM 1000 CA ALA B 34 0.625 -5.645 -33.169 1.00 0.00 C ATOM 1001 C ALA B 34 -0.862 -5.337 -33.410 1.00 0.00 C ATOM 1002 O ALA B 34 -1.203 -4.357 -34.044 1.00 0.00 O ATOM 1003 CB ALA B 34 1.244 -6.205 -34.451 1.00 0.00 C ATOM 0 H ALA B 34 0.728 -7.619 -32.380 1.00 0.00 H new ATOM 0 HA ALA B 34 1.141 -4.728 -32.884 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.146 -5.472 -35.252 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.299 -6.420 -34.282 1.00 0.00 H new ATOM 0 HB3 ALA B 34 0.728 -7.123 -34.733 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.748 -6.171 -32.913 1.00 0.00 N ATOM 1010 CA GLU B 35 -3.210 -5.937 -33.113 1.00 0.00 C ATOM 1011 C GLU B 35 -3.633 -4.550 -32.579 1.00 0.00 C ATOM 1012 O GLU B 35 -4.379 -3.862 -33.246 1.00 0.00 O ATOM 1013 CB GLU B 35 -4.018 -7.034 -32.403 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.525 -8.418 -32.850 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.509 -9.018 -33.857 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -5.001 -8.275 -34.689 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -4.753 -10.211 -33.779 1.00 0.00 O ATOM 0 H GLU B 35 -1.517 -7.006 -32.376 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.413 -5.968 -34.183 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.914 -6.933 -31.323 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -5.078 -6.924 -32.633 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.536 -8.334 -33.300 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.428 -9.076 -31.986 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.168 -4.160 -31.402 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.521 -2.839 -30.789 1.00 0.00 C ATOM 1026 C PRO B 36 -2.587 -1.733 -31.296 1.00 0.00 C ATOM 1027 O PRO B 36 -3.028 -0.664 -31.667 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.323 -3.076 -29.299 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.338 -4.221 -29.149 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.237 -4.933 -30.499 1.00 0.00 C ATOM 0 HA PRO B 36 -4.531 -2.511 -31.037 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.943 -2.177 -28.814 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.271 -3.320 -28.820 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.362 -3.847 -28.841 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.672 -4.913 -28.376 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.215 -4.922 -30.879 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.537 -5.978 -30.420 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.293 -1.986 -31.297 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.278 -0.972 -31.762 1.00 0.00 C ATOM 1040 C HIS B 37 0.008 0.066 -30.661 1.00 0.00 C ATOM 1041 O HIS B 37 0.923 0.858 -30.783 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.751 -0.255 -33.038 1.00 0.00 C ATOM 1043 CG HIS B 37 0.441 0.095 -33.887 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.411 -0.838 -34.218 1.00 0.00 N ATOM 1045 CD2 HIS B 37 0.833 1.270 -34.480 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.331 -0.214 -34.977 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.026 1.072 -35.168 1.00 0.00 N ATOM 0 H HIS B 37 -0.889 -2.870 -30.989 1.00 0.00 H new ATOM 0 HA HIS B 37 0.641 -1.513 -31.986 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.433 -0.896 -33.597 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.303 0.648 -32.777 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.297 2.206 -34.421 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.209 -0.695 -35.382 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.554 1.761 -35.703 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.750 0.069 -29.586 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.496 1.050 -28.487 1.00 0.00 C ATOM 1057 C TYR B 38 -0.088 0.293 -27.217 1.00 0.00 C ATOM 1058 O TYR B 38 0.661 0.792 -26.401 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.762 1.876 -28.214 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.964 0.967 -28.100 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.689 0.621 -29.247 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.356 0.474 -26.849 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.804 -0.219 -29.144 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.471 -0.365 -26.746 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.196 -0.712 -27.893 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.296 -1.540 -27.791 1.00 0.00 O ATOM 0 H TYR B 38 -1.532 -0.566 -29.426 1.00 0.00 H new ATOM 0 HA TYR B 38 0.307 1.725 -28.785 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.641 2.448 -27.294 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.916 2.595 -29.018 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -3.388 1.002 -30.211 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -2.798 0.741 -25.964 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -5.362 -0.487 -30.029 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -4.773 -0.745 -25.781 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.429 -1.793 -26.854 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.570 -0.916 -27.051 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.215 -1.725 -25.846 1.00 0.00 C ATOM 1078 C LEU B 39 1.320 -1.835 -25.695 1.00 0.00 C ATOM 1079 O LEU B 39 1.842 -1.555 -24.631 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.825 -3.131 -25.989 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.713 -3.458 -24.775 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.909 -3.337 -23.474 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.892 -2.485 -24.732 1.00 0.00 C ATOM 0 H LEU B 39 -1.200 -1.379 -27.706 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.613 -1.234 -24.958 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.415 -3.187 -26.904 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -0.030 -3.872 -26.076 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.077 -4.481 -24.871 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.552 -3.572 -22.626 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.071 -4.034 -23.498 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.532 -2.319 -23.373 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.522 -2.715 -23.873 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.519 -1.465 -24.646 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.477 -2.581 -25.647 1.00 0.00 H new ATOM 1095 N PRO B 40 2.013 -2.234 -26.750 1.00 0.00 N ATOM 1096 CA PRO B 40 3.506 -2.379 -26.726 1.00 0.00 C ATOM 1097 C PRO B 40 4.183 -1.001 -26.731 1.00 0.00 C ATOM 1098 O PRO B 40 5.336 -0.868 -26.361 1.00 0.00 O ATOM 1099 CB PRO B 40 3.821 -3.175 -27.984 1.00 0.00 C ATOM 1100 CG PRO B 40 2.666 -2.969 -28.942 1.00 0.00 C ATOM 1101 CD PRO B 40 1.445 -2.585 -28.106 1.00 0.00 C ATOM 0 HA PRO B 40 3.874 -2.878 -25.830 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.756 -2.837 -28.430 1.00 0.00 H new ATOM 0 HB3 PRO B 40 3.944 -4.233 -27.750 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.900 -2.186 -29.663 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.472 -3.878 -29.511 1.00 0.00 H new ATOM 0 HD2 PRO B 40 0.913 -1.741 -28.544 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.735 -3.409 -28.038 1.00 0.00 H new ATOM 1109 N GLN B 41 3.467 0.025 -27.119 1.00 0.00 N ATOM 1110 CA GLN B 41 4.052 1.394 -27.114 1.00 0.00 C ATOM 1111 C GLN B 41 4.138 1.863 -25.659 1.00 0.00 C ATOM 1112 O GLN B 41 5.066 2.547 -25.259 1.00 0.00 O ATOM 1113 CB GLN B 41 3.139 2.331 -27.920 1.00 0.00 C ATOM 1114 CG GLN B 41 3.663 3.770 -27.861 1.00 0.00 C ATOM 1115 CD GLN B 41 5.035 3.846 -28.535 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.255 3.231 -29.560 1.00 0.00 O ATOM 1117 NE2 GLN B 41 5.973 4.576 -27.999 1.00 0.00 N ATOM 0 H GLN B 41 2.500 -0.030 -27.439 1.00 0.00 H new ATOM 0 HA GLN B 41 5.045 1.398 -27.564 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.090 1.998 -28.957 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.125 2.290 -27.523 1.00 0.00 H new ATOM 0 HG2 GLN B 41 2.965 4.443 -28.359 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.737 4.098 -26.824 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.789 5.092 -27.139 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.891 4.631 -28.440 1.00 0.00 H new ATOM 1126 N LEU B 42 3.167 1.496 -24.866 1.00 0.00 N ATOM 1127 CA LEU B 42 3.169 1.908 -23.447 1.00 0.00 C ATOM 1128 C LEU B 42 4.249 1.132 -22.698 1.00 0.00 C ATOM 1129 O LEU B 42 5.103 1.712 -22.068 1.00 0.00 O ATOM 1130 CB LEU B 42 1.796 1.621 -22.815 1.00 0.00 C ATOM 1131 CG LEU B 42 0.634 2.473 -23.421 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.062 3.349 -24.615 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.486 1.534 -23.884 1.00 0.00 C ATOM 0 H LEU B 42 2.371 0.925 -25.149 1.00 0.00 H new ATOM 0 HA LEU B 42 3.373 2.977 -23.382 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.563 0.564 -22.940 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.853 1.811 -21.743 1.00 0.00 H new ATOM 0 HG LEU B 42 0.301 3.148 -22.632 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.202 3.910 -24.981 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.840 4.043 -24.297 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.447 2.714 -25.413 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.301 2.121 -24.308 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.099 0.851 -24.640 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.856 0.962 -23.033 1.00 0.00 H new ATOM 1145 N ARG B 43 4.222 -0.181 -22.761 1.00 0.00 N ATOM 1146 CA ARG B 43 5.252 -0.999 -22.039 1.00 0.00 C ATOM 1147 C ARG B 43 6.664 -0.474 -22.334 1.00 0.00 C ATOM 1148 O ARG B 43 7.479 -0.329 -21.437 1.00 0.00 O ATOM 1149 CB ARG B 43 5.130 -2.473 -22.456 1.00 0.00 C ATOM 1150 CG ARG B 43 5.549 -2.671 -23.915 1.00 0.00 C ATOM 1151 CD ARG B 43 5.339 -4.135 -24.310 1.00 0.00 C ATOM 1152 NE ARG B 43 5.919 -4.372 -25.667 1.00 0.00 N ATOM 1153 CZ ARG B 43 5.635 -5.462 -26.355 1.00 0.00 C ATOM 1154 NH1 ARG B 43 4.832 -6.386 -25.880 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.165 -5.624 -27.536 1.00 0.00 N ATOM 0 H ARG B 43 3.531 -0.721 -23.281 1.00 0.00 H new ATOM 0 HA ARG B 43 5.077 -0.917 -20.966 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.754 -3.090 -21.809 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.102 -2.808 -22.321 1.00 0.00 H new ATOM 0 HG2 ARG B 43 4.964 -2.020 -24.565 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.595 -2.394 -24.045 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.813 -4.791 -23.580 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.276 -4.374 -24.310 1.00 0.00 H new ATOM 0 HE ARG B 43 6.547 -3.677 -26.070 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.411 -6.271 -24.958 1.00 0.00 H new ATOM 0 HH12 ARG B 43 4.629 -7.219 -26.433 1.00 0.00 H new ATOM 0 HH21 ARG B 43 6.790 -4.913 -27.916 1.00 0.00 H new ATOM 0 HH22 ARG B 43 5.954 -6.461 -28.079 1.00 0.00 H new ATOM 1169 N LYS B 44 6.956 -0.168 -23.576 1.00 0.00 N ATOM 1170 CA LYS B 44 8.298 0.358 -23.896 1.00 0.00 C ATOM 1171 C LYS B 44 8.461 1.727 -23.227 1.00 0.00 C ATOM 1172 O LYS B 44 9.556 2.126 -22.876 1.00 0.00 O ATOM 1173 CB LYS B 44 8.477 0.472 -25.414 1.00 0.00 C ATOM 1174 CG LYS B 44 7.456 1.448 -25.997 1.00 0.00 C ATOM 1175 CD LYS B 44 7.814 1.756 -27.452 1.00 0.00 C ATOM 1176 CE LYS B 44 7.525 0.531 -28.320 1.00 0.00 C ATOM 1177 NZ LYS B 44 7.545 0.924 -29.757 1.00 0.00 N ATOM 0 H LYS B 44 6.321 -0.263 -24.369 1.00 0.00 H new ATOM 0 HA LYS B 44 9.062 -0.323 -23.521 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.487 0.812 -25.643 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.358 -0.508 -25.876 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.455 1.020 -25.941 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.442 2.368 -25.413 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.237 2.610 -27.806 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.867 2.029 -27.529 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.269 -0.244 -28.134 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.554 0.109 -28.061 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.298 0.102 -30.345 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 6.855 1.685 -29.918 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.496 1.259 -30.012 1.00 0.00 H new ATOM 1191 N ASP B 45 7.372 2.446 -23.033 1.00 0.00 N ATOM 1192 CA ASP B 45 7.471 3.771 -22.374 1.00 0.00 C ATOM 1193 C ASP B 45 7.934 3.579 -20.927 1.00 0.00 C ATOM 1194 O ASP B 45 8.842 4.248 -20.482 1.00 0.00 O ATOM 1195 CB ASP B 45 6.114 4.479 -22.397 1.00 0.00 C ATOM 1196 CG ASP B 45 5.723 4.790 -23.842 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.611 5.088 -24.624 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.544 4.726 -24.143 1.00 0.00 O ATOM 0 H ASP B 45 6.430 2.164 -23.305 1.00 0.00 H new ATOM 0 HA ASP B 45 8.192 4.387 -22.912 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.356 3.849 -21.932 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.163 5.400 -21.816 1.00 0.00 H new ATOM 1203 N ILE B 46 7.334 2.665 -20.187 1.00 0.00 N ATOM 1204 CA ILE B 46 7.772 2.443 -18.768 1.00 0.00 C ATOM 1205 C ILE B 46 9.268 2.100 -18.750 1.00 0.00 C ATOM 1206 O ILE B 46 9.984 2.476 -17.843 1.00 0.00 O ATOM 1207 CB ILE B 46 6.920 1.335 -18.105 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.923 1.572 -16.594 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.446 -0.078 -18.403 1.00 0.00 C ATOM 1210 CD1 ILE B 46 6.169 2.861 -16.272 1.00 0.00 C ATOM 0 H ILE B 46 6.568 2.070 -20.503 1.00 0.00 H new ATOM 0 HA ILE B 46 7.620 3.353 -18.188 1.00 0.00 H new ATOM 0 HB ILE B 46 5.912 1.389 -18.517 1.00 0.00 H new ATOM 0 HG12 ILE B 46 6.456 0.730 -16.083 1.00 0.00 H new ATOM 0 HG13 ILE B 46 7.948 1.638 -16.229 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.809 -0.814 -17.912 1.00 0.00 H new ATOM 0 HG22 ILE B 46 7.437 -0.250 -19.479 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.465 -0.173 -18.029 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.174 3.026 -15.195 1.00 0.00 H new ATOM 0 HD12 ILE B 46 6.655 3.701 -16.770 1.00 0.00 H new ATOM 0 HD13 ILE B 46 5.140 2.778 -16.622 1.00 0.00 H new ATOM 1222 N LEU B 47 9.745 1.412 -19.762 1.00 0.00 N ATOM 1223 CA LEU B 47 11.193 1.075 -19.820 1.00 0.00 C ATOM 1224 C LEU B 47 11.984 2.383 -19.892 1.00 0.00 C ATOM 1225 O LEU B 47 12.978 2.567 -19.211 1.00 0.00 O ATOM 1226 CB LEU B 47 11.471 0.233 -21.066 1.00 0.00 C ATOM 1227 CG LEU B 47 11.084 -1.221 -20.798 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.095 -2.002 -22.114 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.089 -1.845 -19.828 1.00 0.00 C ATOM 0 H LEU B 47 9.189 1.072 -20.547 1.00 0.00 H new ATOM 0 HA LEU B 47 11.487 0.506 -18.938 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.905 0.621 -21.913 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.526 0.296 -21.332 1.00 0.00 H new ATOM 0 HG LEU B 47 10.086 -1.257 -20.361 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.819 -3.039 -21.924 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.380 -1.558 -22.807 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.093 -1.966 -22.550 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.814 -2.882 -19.636 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.087 -1.809 -20.265 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.083 -1.289 -18.891 1.00 0.00 H new ATOM 1241 N GLU B 48 11.520 3.304 -20.698 1.00 0.00 N ATOM 1242 CA GLU B 48 12.206 4.622 -20.814 1.00 0.00 C ATOM 1243 C GLU B 48 11.931 5.401 -19.534 1.00 0.00 C ATOM 1244 O GLU B 48 12.779 6.109 -19.028 1.00 0.00 O ATOM 1245 CB GLU B 48 11.675 5.437 -22.011 1.00 0.00 C ATOM 1246 CG GLU B 48 11.240 4.519 -23.162 1.00 0.00 C ATOM 1247 CD GLU B 48 11.709 5.099 -24.500 1.00 0.00 C ATOM 1248 OE1 GLU B 48 12.901 5.045 -24.760 1.00 0.00 O ATOM 1249 OE2 GLU B 48 10.871 5.585 -25.240 1.00 0.00 O ATOM 0 H GLU B 48 10.691 3.197 -21.283 1.00 0.00 H new ATOM 0 HA GLU B 48 13.272 4.454 -20.968 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.831 6.048 -21.692 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.449 6.120 -22.361 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.659 3.522 -23.021 1.00 0.00 H new ATOM 0 HG3 GLU B 48 10.155 4.412 -23.163 1.00 0.00 H new ATOM 1256 N VAL B 49 10.742 5.259 -19.001 1.00 0.00 N ATOM 1257 CA VAL B 49 10.383 5.970 -17.743 1.00 0.00 C ATOM 1258 C VAL B 49 11.328 5.500 -16.640 1.00 0.00 C ATOM 1259 O VAL B 49 12.071 6.278 -16.083 1.00 0.00 O ATOM 1260 CB VAL B 49 8.932 5.652 -17.365 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.546 6.435 -16.106 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.001 6.050 -18.520 1.00 0.00 C ATOM 0 H VAL B 49 10.002 4.675 -19.390 1.00 0.00 H new ATOM 0 HA VAL B 49 10.477 7.048 -17.878 1.00 0.00 H new ATOM 0 HB VAL B 49 8.835 4.584 -17.172 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.514 6.208 -15.838 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.205 6.151 -15.285 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.644 7.504 -16.298 1.00 0.00 H new ATOM 0 HG21 VAL B 49 6.969 5.824 -18.250 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.099 7.118 -18.715 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.273 5.491 -19.416 1.00 0.00 H new ATOM 1272 N ILE B 50 11.343 4.218 -16.352 1.00 0.00 N ATOM 1273 CA ILE B 50 12.284 3.692 -15.311 1.00 0.00 C ATOM 1274 C ILE B 50 13.714 4.120 -15.675 1.00 0.00 C ATOM 1275 O ILE B 50 14.571 4.232 -14.824 1.00 0.00 O ATOM 1276 CB ILE B 50 12.192 2.164 -15.250 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.745 1.753 -14.965 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.096 1.638 -14.133 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.437 0.437 -15.684 1.00 0.00 C ATOM 0 H ILE B 50 10.747 3.517 -16.791 1.00 0.00 H new ATOM 0 HA ILE B 50 12.018 4.095 -14.334 1.00 0.00 H new ATOM 0 HB ILE B 50 12.512 1.745 -16.204 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.593 1.638 -13.892 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.061 2.532 -15.302 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.029 0.551 -14.092 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.127 1.930 -14.331 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.777 2.058 -13.179 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.407 0.144 -15.481 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.572 0.569 -16.758 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.112 -0.340 -15.326 1.00 0.00 H new ATOM 1291 N CYS B 51 13.961 4.376 -16.941 1.00 0.00 N ATOM 1292 CA CYS B 51 15.310 4.822 -17.371 1.00 0.00 C ATOM 1293 C CYS B 51 15.523 6.280 -16.941 1.00 0.00 C ATOM 1294 O CYS B 51 16.551 6.632 -16.403 1.00 0.00 O ATOM 1295 CB CYS B 51 15.414 4.710 -18.897 1.00 0.00 C ATOM 1296 SG CYS B 51 17.157 4.689 -19.382 1.00 0.00 S ATOM 0 H CYS B 51 13.276 4.292 -17.692 1.00 0.00 H new ATOM 0 HA CYS B 51 16.073 4.196 -16.909 1.00 0.00 H new ATOM 0 HB2 CYS B 51 14.919 3.802 -19.240 1.00 0.00 H new ATOM 0 HB3 CYS B 51 14.904 5.549 -19.370 1.00 0.00 H new ATOM 0 HG CYS B 51 17.246 4.592 -20.675 1.00 0.00 H new ATOM 1302 N LYS B 52 14.552 7.130 -17.171 1.00 0.00 N ATOM 1303 CA LYS B 52 14.694 8.571 -16.778 1.00 0.00 C ATOM 1304 C LYS B 52 14.957 8.684 -15.274 1.00 0.00 C ATOM 1305 O LYS B 52 15.642 9.581 -14.819 1.00 0.00 O ATOM 1306 CB LYS B 52 13.407 9.338 -17.094 1.00 0.00 C ATOM 1307 CG LYS B 52 13.029 9.172 -18.567 1.00 0.00 C ATOM 1308 CD LYS B 52 11.500 9.177 -18.700 1.00 0.00 C ATOM 1309 CE LYS B 52 11.021 10.561 -19.148 1.00 0.00 C ATOM 1310 NZ LYS B 52 10.684 10.525 -20.599 1.00 0.00 N ATOM 0 H LYS B 52 13.665 6.890 -17.614 1.00 0.00 H new ATOM 0 HA LYS B 52 15.528 8.992 -17.340 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.597 8.975 -16.462 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.542 10.395 -16.864 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.460 9.980 -19.159 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.437 8.239 -18.956 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.186 8.423 -19.422 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.042 8.915 -17.746 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.148 10.860 -18.568 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.797 11.304 -18.962 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 10.359 11.465 -20.903 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 11.528 10.257 -21.145 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 9.930 9.828 -20.763 1.00 0.00 H new ATOM 1324 N TYR B 53 14.399 7.790 -14.503 1.00 0.00 N ATOM 1325 CA TYR B 53 14.581 7.836 -13.030 1.00 0.00 C ATOM 1326 C TYR B 53 15.633 6.801 -12.593 1.00 0.00 C ATOM 1327 O TYR B 53 16.103 6.831 -11.471 1.00 0.00 O ATOM 1328 CB TYR B 53 13.244 7.500 -12.357 1.00 0.00 C ATOM 1329 CG TYR B 53 12.172 8.514 -12.720 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.711 8.619 -14.039 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.618 9.329 -11.726 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.703 9.530 -14.364 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.609 10.246 -12.053 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.152 10.343 -13.375 1.00 0.00 C ATOM 1335 OH TYR B 53 9.155 11.243 -13.696 1.00 0.00 O ATOM 0 H TYR B 53 13.818 7.022 -14.839 1.00 0.00 H new ATOM 0 HA TYR B 53 14.916 8.832 -12.739 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.922 6.504 -12.660 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.375 7.478 -11.275 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.137 7.992 -14.808 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.968 9.252 -10.707 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.350 9.604 -15.382 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.184 10.877 -11.287 1.00 0.00 H new ATOM 0 HH TYR B 53 8.882 11.730 -12.890 1.00 0.00 H new ATOM 1345 N VAL B 54 15.991 5.874 -13.456 1.00 0.00 N ATOM 1346 CA VAL B 54 16.995 4.824 -13.078 1.00 0.00 C ATOM 1347 C VAL B 54 17.737 4.379 -14.362 1.00 0.00 C ATOM 1348 O VAL B 54 18.088 5.209 -15.177 1.00 0.00 O ATOM 1349 CB VAL B 54 16.288 3.622 -12.402 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.293 2.876 -11.521 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.121 4.089 -11.521 1.00 0.00 C ATOM 0 H VAL B 54 15.630 5.800 -14.407 1.00 0.00 H new ATOM 0 HA VAL B 54 17.712 5.227 -12.362 1.00 0.00 H new ATOM 0 HB VAL B 54 15.901 2.971 -13.186 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.800 2.029 -11.043 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.118 2.516 -12.135 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.677 3.551 -10.756 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.644 3.224 -11.060 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.496 4.754 -10.743 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.393 4.621 -12.133 1.00 0.00 H new ATOM 1361 N GLN B 55 17.991 3.098 -14.561 1.00 0.00 N ATOM 1362 CA GLN B 55 18.702 2.661 -15.800 1.00 0.00 C ATOM 1363 C GLN B 55 18.713 1.133 -15.868 1.00 0.00 C ATOM 1364 O GLN B 55 19.411 0.471 -15.123 1.00 0.00 O ATOM 1365 CB GLN B 55 20.138 3.192 -15.777 1.00 0.00 C ATOM 1366 CG GLN B 55 20.410 4.015 -17.040 1.00 0.00 C ATOM 1367 CD GLN B 55 21.917 4.211 -17.209 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.553 4.853 -16.397 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.520 3.681 -18.238 1.00 0.00 N ATOM 0 H GLN B 55 17.736 2.347 -13.919 1.00 0.00 H new ATOM 0 HA GLN B 55 18.188 3.055 -16.677 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.293 3.808 -14.891 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.841 2.361 -15.715 1.00 0.00 H new ATOM 0 HG2 GLN B 55 19.999 3.508 -17.913 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.913 4.982 -16.970 1.00 0.00 H new ATOM 0 HE21 GLN B 55 21.986 3.142 -18.920 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.525 3.806 -18.360 1.00 0.00 H new ATOM 1378 N ILE B 56 17.937 0.576 -16.756 1.00 0.00 N ATOM 1379 CA ILE B 56 17.879 -0.911 -16.893 1.00 0.00 C ATOM 1380 C ILE B 56 17.791 -1.282 -18.372 1.00 0.00 C ATOM 1381 O ILE B 56 17.573 -0.437 -19.221 1.00 0.00 O ATOM 1382 CB ILE B 56 16.651 -1.461 -16.155 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.445 -0.531 -16.360 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.966 -1.568 -14.665 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.185 -1.367 -16.594 1.00 0.00 C ATOM 0 H ILE B 56 17.335 1.090 -17.399 1.00 0.00 H new ATOM 0 HA ILE B 56 18.780 -1.344 -16.458 1.00 0.00 H new ATOM 0 HB ILE B 56 16.407 -2.446 -16.554 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.313 0.107 -15.486 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.621 0.126 -17.212 1.00 0.00 H new ATOM 0 HG21 ILE B 56 16.096 -1.958 -14.136 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.811 -2.241 -14.519 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.216 -0.582 -14.274 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.331 -0.705 -16.739 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.319 -1.986 -17.481 1.00 0.00 H new ATOM 0 HD13 ILE B 56 14.006 -2.006 -15.729 1.00 0.00 H new ATOM 1397 N ASP B 57 17.953 -2.541 -18.683 1.00 0.00 N ATOM 1398 CA ASP B 57 17.875 -2.982 -20.105 1.00 0.00 C ATOM 1399 C ASP B 57 16.499 -3.616 -20.358 1.00 0.00 C ATOM 1400 O ASP B 57 15.806 -3.953 -19.418 1.00 0.00 O ATOM 1401 CB ASP B 57 18.970 -4.015 -20.374 1.00 0.00 C ATOM 1402 CG ASP B 57 20.261 -3.298 -20.776 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.787 -2.565 -19.955 1.00 0.00 O ATOM 1404 OD2 ASP B 57 20.700 -3.494 -21.896 1.00 0.00 O ATOM 0 H ASP B 57 18.137 -3.285 -18.010 1.00 0.00 H new ATOM 0 HA ASP B 57 18.013 -2.127 -20.767 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.140 -4.621 -19.484 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.657 -4.694 -21.167 1.00 0.00 H new ATOM 1409 N PRO B 58 16.133 -3.775 -21.614 1.00 0.00 N ATOM 1410 CA PRO B 58 14.821 -4.383 -22.002 1.00 0.00 C ATOM 1411 C PRO B 58 14.855 -5.887 -21.754 1.00 0.00 C ATOM 1412 O PRO B 58 13.852 -6.495 -21.430 1.00 0.00 O ATOM 1413 CB PRO B 58 14.685 -4.055 -23.482 1.00 0.00 C ATOM 1414 CG PRO B 58 16.085 -3.823 -24.012 1.00 0.00 C ATOM 1415 CD PRO B 58 16.950 -3.393 -22.827 1.00 0.00 C ATOM 0 HA PRO B 58 13.977 -4.002 -21.427 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.201 -4.873 -24.016 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.066 -3.169 -23.626 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.480 -4.731 -24.467 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.082 -3.055 -24.785 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.915 -3.900 -22.833 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.153 -2.322 -22.850 1.00 0.00 H new ATOM 1423 N GLU B 59 16.013 -6.483 -21.868 1.00 0.00 N ATOM 1424 CA GLU B 59 16.132 -7.943 -21.602 1.00 0.00 C ATOM 1425 C GLU B 59 15.920 -8.204 -20.101 1.00 0.00 C ATOM 1426 O GLU B 59 15.744 -9.334 -19.685 1.00 0.00 O ATOM 1427 CB GLU B 59 17.525 -8.425 -22.012 1.00 0.00 C ATOM 1428 CG GLU B 59 17.618 -8.478 -23.538 1.00 0.00 C ATOM 1429 CD GLU B 59 18.883 -9.235 -23.947 1.00 0.00 C ATOM 1430 OE1 GLU B 59 19.014 -10.384 -23.559 1.00 0.00 O ATOM 1431 OE2 GLU B 59 19.701 -8.652 -24.640 1.00 0.00 O ATOM 0 H GLU B 59 16.881 -6.019 -22.134 1.00 0.00 H new ATOM 0 HA GLU B 59 15.379 -8.482 -22.177 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.286 -7.753 -21.614 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.719 -9.411 -21.591 1.00 0.00 H new ATOM 0 HG2 GLU B 59 16.737 -8.971 -23.950 1.00 0.00 H new ATOM 0 HG3 GLU B 59 17.638 -7.468 -23.947 1.00 0.00 H new ATOM 1438 N MET B 60 15.931 -7.170 -19.284 1.00 0.00 N ATOM 1439 CA MET B 60 15.727 -7.357 -17.822 1.00 0.00 C ATOM 1440 C MET B 60 14.233 -7.260 -17.493 1.00 0.00 C ATOM 1441 O MET B 60 13.779 -7.770 -16.486 1.00 0.00 O ATOM 1442 CB MET B 60 16.487 -6.261 -17.070 1.00 0.00 C ATOM 1443 CG MET B 60 17.973 -6.631 -16.979 1.00 0.00 C ATOM 1444 SD MET B 60 18.339 -7.329 -15.348 1.00 0.00 S ATOM 1445 CE MET B 60 18.534 -5.759 -14.470 1.00 0.00 C ATOM 0 H MET B 60 16.074 -6.204 -19.578 1.00 0.00 H new ATOM 0 HA MET B 60 16.097 -8.338 -17.522 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.371 -5.307 -17.584 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.071 -6.137 -16.070 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.225 -7.352 -17.757 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.587 -5.747 -17.152 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.191 -5.872 -13.442 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.585 -5.469 -14.472 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.944 -4.989 -14.967 1.00 0.00 H new ATOM 1455 N VAL B 61 13.467 -6.602 -18.331 1.00 0.00 N ATOM 1456 CA VAL B 61 12.005 -6.462 -18.067 1.00 0.00 C ATOM 1457 C VAL B 61 11.231 -7.496 -18.890 1.00 0.00 C ATOM 1458 O VAL B 61 11.343 -7.547 -20.100 1.00 0.00 O ATOM 1459 CB VAL B 61 11.553 -5.053 -18.459 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.097 -4.845 -18.041 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.437 -4.021 -17.753 1.00 0.00 C ATOM 0 H VAL B 61 13.795 -6.156 -19.188 1.00 0.00 H new ATOM 0 HA VAL B 61 11.809 -6.627 -17.008 1.00 0.00 H new ATOM 0 HB VAL B 61 11.640 -4.933 -19.539 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.778 -3.841 -18.321 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.466 -5.579 -18.542 1.00 0.00 H new ATOM 0 HG13 VAL B 61 10.008 -4.966 -16.961 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.117 -3.017 -18.031 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.349 -4.144 -16.674 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.475 -4.166 -18.051 1.00 0.00 H new ATOM 1471 N THR B 62 10.448 -8.323 -18.240 1.00 0.00 N ATOM 1472 CA THR B 62 9.666 -9.356 -18.970 1.00 0.00 C ATOM 1473 C THR B 62 8.303 -8.789 -19.371 1.00 0.00 C ATOM 1474 O THR B 62 7.810 -7.850 -18.775 1.00 0.00 O ATOM 1475 CB THR B 62 9.451 -10.575 -18.069 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.650 -10.859 -17.362 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.059 -11.781 -18.924 1.00 0.00 C ATOM 0 H THR B 62 10.320 -8.322 -17.228 1.00 0.00 H new ATOM 0 HA THR B 62 10.218 -9.650 -19.863 1.00 0.00 H new ATOM 0 HB THR B 62 8.653 -10.364 -17.357 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.512 -11.638 -16.784 1.00 0.00 H new ATOM 0 HG21 THR B 62 8.906 -12.648 -18.282 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.137 -11.561 -19.462 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.854 -11.994 -19.638 1.00 0.00 H new ATOM 1485 N VAL B 63 7.692 -9.366 -20.371 1.00 0.00 N ATOM 1486 CA VAL B 63 6.356 -8.889 -20.822 1.00 0.00 C ATOM 1487 C VAL B 63 5.509 -10.100 -21.207 1.00 0.00 C ATOM 1488 O VAL B 63 5.889 -10.884 -22.057 1.00 0.00 O ATOM 1489 CB VAL B 63 6.523 -7.978 -22.036 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.168 -7.384 -22.425 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.492 -6.848 -21.689 1.00 0.00 C ATOM 0 H VAL B 63 8.066 -10.155 -20.898 1.00 0.00 H new ATOM 0 HA VAL B 63 5.869 -8.333 -20.021 1.00 0.00 H new ATOM 0 HB VAL B 63 6.916 -8.556 -22.872 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.291 -6.734 -23.292 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.475 -8.189 -22.670 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.772 -6.805 -21.591 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.614 -6.195 -22.553 1.00 0.00 H new ATOM 0 HG22 VAL B 63 7.095 -6.272 -20.853 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.459 -7.269 -21.413 1.00 0.00 H new ATOM 1501 N GLN B 64 4.373 -10.265 -20.582 1.00 0.00 N ATOM 1502 CA GLN B 64 3.510 -11.435 -20.904 1.00 0.00 C ATOM 1503 C GLN B 64 2.040 -11.017 -20.883 1.00 0.00 C ATOM 1504 O GLN B 64 1.551 -10.483 -19.906 1.00 0.00 O ATOM 1505 CB GLN B 64 3.758 -12.537 -19.870 1.00 0.00 C ATOM 1506 CG GLN B 64 3.499 -11.994 -18.459 1.00 0.00 C ATOM 1507 CD GLN B 64 4.563 -12.528 -17.497 1.00 0.00 C ATOM 1508 OE1 GLN B 64 4.456 -13.635 -17.008 1.00 0.00 O ATOM 1509 NE2 GLN B 64 5.592 -11.780 -17.202 1.00 0.00 N ATOM 0 H GLN B 64 4.007 -9.640 -19.864 1.00 0.00 H new ATOM 0 HA GLN B 64 3.752 -11.808 -21.899 1.00 0.00 H new ATOM 0 HB2 GLN B 64 3.105 -13.387 -20.068 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.784 -12.897 -19.948 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.518 -10.904 -18.469 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.507 -12.292 -18.121 1.00 0.00 H new ATOM 0 HE21 GLN B 64 5.681 -10.851 -17.613 1.00 0.00 H new ATOM 0 HE22 GLN B 64 6.306 -12.125 -16.561 1.00 0.00 H new ATOM 1518 N LEU B 65 1.337 -11.250 -21.964 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.095 -10.861 -22.028 1.00 0.00 C ATOM 1520 C LEU B 65 -0.987 -12.056 -21.693 1.00 0.00 C ATOM 1521 O LEU B 65 -0.677 -13.190 -22.006 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.422 -10.364 -23.437 1.00 0.00 C ATOM 1523 CG LEU B 65 0.006 -11.412 -24.477 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.141 -11.659 -25.462 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.230 -10.905 -25.244 1.00 0.00 C ATOM 0 H LEU B 65 1.701 -11.696 -22.806 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.279 -10.069 -21.302 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.491 -10.169 -23.524 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.090 -9.421 -23.627 1.00 0.00 H new ATOM 0 HG LEU B 65 0.255 -12.342 -23.966 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.835 -12.402 -26.198 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.014 -12.023 -24.920 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.392 -10.728 -25.970 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.532 -11.649 -25.981 1.00 0.00 H new ATOM 0 HD22 LEU B 65 0.981 -9.973 -25.751 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.050 -10.731 -24.547 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.101 -11.793 -21.064 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.047 -12.880 -20.699 1.00 0.00 C ATOM 1539 C GLU B 66 -4.461 -12.440 -21.082 1.00 0.00 C ATOM 1540 O GLU B 66 -4.656 -11.356 -21.598 1.00 0.00 O ATOM 1541 CB GLU B 66 -2.972 -13.136 -19.188 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.742 -13.984 -18.855 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.835 -15.344 -19.554 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.814 -16.036 -19.333 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.924 -15.668 -20.299 1.00 0.00 O ATOM 0 H GLU B 66 -2.397 -10.858 -20.785 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.789 -13.799 -21.226 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -2.924 -12.187 -18.653 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.875 -13.646 -18.853 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.837 -13.465 -19.171 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.669 -14.125 -17.777 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.446 -13.269 -20.846 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.844 -12.887 -21.208 1.00 0.00 C ATOM 1554 C GLN B 67 -7.836 -13.557 -20.255 1.00 0.00 C ATOM 1555 O GLN B 67 -7.526 -14.539 -19.608 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.138 -13.332 -22.644 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.083 -12.748 -23.585 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.464 -13.054 -25.035 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.617 -12.960 -25.405 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.535 -13.416 -25.878 1.00 0.00 N ATOM 0 H GLN B 67 -5.343 -14.190 -20.420 1.00 0.00 H new ATOM 0 HA GLN B 67 -6.949 -11.805 -21.129 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -7.134 -14.420 -22.707 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.132 -12.999 -22.943 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -6.006 -11.671 -23.438 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.104 -13.171 -23.358 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.567 -13.495 -25.567 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.777 -13.620 -26.848 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.031 -13.028 -20.172 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.061 -13.620 -19.269 1.00 0.00 C ATOM 1571 C LYS B 68 -11.244 -14.114 -20.103 1.00 0.00 C ATOM 1572 O LYS B 68 -11.375 -13.778 -21.265 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.546 -12.554 -18.281 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.371 -12.070 -17.420 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.371 -10.539 -17.352 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.629 -10.057 -16.630 1.00 0.00 C ATOM 1577 NZ LYS B 68 -10.621 -10.559 -15.227 1.00 0.00 N ATOM 0 H LYS B 68 -9.337 -12.207 -20.694 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.627 -14.456 -18.720 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.982 -11.715 -18.823 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.330 -12.965 -17.645 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -9.448 -12.487 -16.416 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.430 -12.424 -17.841 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.482 -10.188 -16.828 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.334 -10.120 -18.358 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.670 -8.968 -16.637 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.518 -10.413 -17.150 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -10.841 -9.777 -14.577 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.335 -11.308 -15.122 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -9.681 -10.943 -15.001 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.104 -14.910 -19.519 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.279 -15.431 -20.269 1.00 0.00 C ATOM 1593 C ASP B 69 -14.376 -14.360 -20.320 1.00 0.00 C ATOM 1594 O ASP B 69 -15.477 -14.559 -19.839 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.810 -16.688 -19.571 1.00 0.00 C ATOM 1596 CG ASP B 69 -12.813 -17.835 -19.757 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.784 -18.398 -20.839 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -12.098 -18.130 -18.814 1.00 0.00 O ATOM 0 H ASP B 69 -12.039 -15.221 -18.550 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.980 -15.682 -21.287 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -13.960 -16.491 -18.509 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -14.780 -16.964 -19.985 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.081 -13.225 -20.902 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.100 -12.135 -20.990 1.00 0.00 C ATOM 1605 C GLY B 70 -14.621 -11.058 -21.967 1.00 0.00 C ATOM 1606 O GLY B 70 -14.910 -9.889 -21.800 1.00 0.00 O ATOM 0 H GLY B 70 -13.177 -13.006 -21.321 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.055 -12.543 -21.323 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.266 -11.698 -20.005 1.00 0.00 H new ATOM 1610 N ASP B 71 -13.883 -11.446 -22.978 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.369 -10.458 -23.976 1.00 0.00 C ATOM 1612 C ASP B 71 -12.492 -9.431 -23.261 1.00 0.00 C ATOM 1613 O ASP B 71 -12.597 -8.240 -23.482 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.541 -9.752 -24.667 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.106 -10.656 -25.765 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.384 -10.928 -26.711 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.250 -11.060 -25.643 1.00 0.00 O ATOM 0 H ASP B 71 -13.613 -12.413 -23.156 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.780 -10.979 -24.731 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.318 -9.517 -23.939 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.208 -8.806 -25.095 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.634 -9.895 -22.392 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.747 -8.968 -21.635 1.00 0.00 C ATOM 1624 C ILE B 72 -9.292 -9.423 -21.789 1.00 0.00 C ATOM 1625 O ILE B 72 -9.025 -10.563 -22.119 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.146 -8.979 -20.154 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.683 -8.886 -20.038 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.485 -7.786 -19.452 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.117 -8.705 -18.574 1.00 0.00 C ATOM 0 H ILE B 72 -11.510 -10.884 -22.174 1.00 0.00 H new ATOM 0 HA ILE B 72 -10.850 -7.955 -22.025 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.813 -9.903 -19.681 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.046 -8.049 -20.634 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.137 -9.789 -20.446 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.763 -7.785 -18.398 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.402 -7.866 -19.542 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.821 -6.859 -19.917 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.204 -8.642 -18.522 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.774 -9.555 -17.985 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.681 -7.789 -18.176 1.00 0.00 H new ATOM 1641 N SER B 73 -8.353 -8.539 -21.559 1.00 0.00 N ATOM 1642 CA SER B 73 -6.914 -8.913 -21.699 1.00 0.00 C ATOM 1643 C SER B 73 -6.171 -8.586 -20.404 1.00 0.00 C ATOM 1644 O SER B 73 -6.690 -7.917 -19.531 1.00 0.00 O ATOM 1645 CB SER B 73 -6.295 -8.129 -22.855 1.00 0.00 C ATOM 1646 OG SER B 73 -7.115 -8.264 -24.008 1.00 0.00 O ATOM 0 H SER B 73 -8.523 -7.573 -21.280 1.00 0.00 H new ATOM 0 HA SER B 73 -6.835 -9.981 -21.901 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.198 -7.077 -22.585 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.291 -8.499 -23.064 1.00 0.00 H new ATOM 0 HG SER B 73 -6.721 -7.760 -24.751 1.00 0.00 H new ATOM 1652 N ILE B 74 -4.959 -9.061 -20.277 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.164 -8.799 -19.045 1.00 0.00 C ATOM 1654 C ILE B 74 -2.675 -8.723 -19.417 1.00 0.00 C ATOM 1655 O ILE B 74 -1.970 -9.713 -19.383 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.416 -9.944 -18.047 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.874 -9.876 -17.562 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.456 -9.837 -16.848 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.143 -10.964 -16.511 1.00 0.00 C ATOM 0 H ILE B 74 -4.484 -9.624 -20.982 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.459 -7.854 -18.588 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.237 -10.898 -18.543 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.076 -8.893 -17.136 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.551 -10.003 -18.407 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.649 -10.655 -16.153 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.426 -9.895 -17.200 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.612 -8.885 -16.340 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.179 -10.901 -16.179 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -5.961 -11.946 -16.949 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.480 -10.818 -15.659 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.201 -7.556 -19.771 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.769 -7.406 -20.146 1.00 0.00 C ATOM 1673 C LEU B 75 0.090 -7.273 -18.891 1.00 0.00 C ATOM 1674 O LEU B 75 0.129 -6.235 -18.258 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.597 -6.162 -21.021 1.00 0.00 C ATOM 1676 CG LEU B 75 0.799 -6.168 -21.673 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.660 -6.159 -23.199 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.581 -4.927 -21.229 1.00 0.00 C ATOM 0 H LEU B 75 -2.750 -6.698 -19.816 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.452 -8.289 -20.701 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.368 -6.139 -21.792 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.722 -5.263 -20.418 1.00 0.00 H new ATOM 0 HG LEU B 75 1.332 -7.067 -21.363 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.650 -6.163 -23.655 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.109 -7.043 -23.519 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.121 -5.264 -23.510 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.568 -4.934 -21.692 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.043 -4.029 -21.535 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.689 -4.934 -20.144 1.00 0.00 H new ATOM 1690 N GLU B 76 0.785 -8.321 -18.537 1.00 0.00 N ATOM 1691 CA GLU B 76 1.660 -8.279 -17.332 1.00 0.00 C ATOM 1692 C GLU B 76 3.102 -8.057 -17.788 1.00 0.00 C ATOM 1693 O GLU B 76 3.469 -8.417 -18.889 1.00 0.00 O ATOM 1694 CB GLU B 76 1.569 -9.610 -16.578 1.00 0.00 C ATOM 1695 CG GLU B 76 0.101 -9.988 -16.353 1.00 0.00 C ATOM 1696 CD GLU B 76 0.011 -11.456 -15.933 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.751 -12.255 -16.483 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.796 -11.757 -15.069 1.00 0.00 O ATOM 0 H GLU B 76 0.783 -9.211 -19.036 1.00 0.00 H new ATOM 0 HA GLU B 76 1.342 -7.472 -16.672 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.072 -10.393 -17.145 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.083 -9.530 -15.620 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.336 -9.351 -15.584 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.472 -9.824 -17.266 1.00 0.00 H new ATOM 1705 N LEU B 77 3.924 -7.474 -16.953 1.00 0.00 N ATOM 1706 CA LEU B 77 5.345 -7.241 -17.347 1.00 0.00 C ATOM 1707 C LEU B 77 6.233 -7.269 -16.102 1.00 0.00 C ATOM 1708 O LEU B 77 5.985 -6.582 -15.131 1.00 0.00 O ATOM 1709 CB LEU B 77 5.479 -5.889 -18.057 1.00 0.00 C ATOM 1710 CG LEU B 77 4.829 -4.780 -17.223 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.512 -3.446 -17.530 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.343 -4.682 -17.578 1.00 0.00 C ATOM 0 H LEU B 77 3.673 -7.150 -16.019 1.00 0.00 H new ATOM 0 HA LEU B 77 5.661 -8.029 -18.031 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.532 -5.660 -18.220 1.00 0.00 H new ATOM 0 HB3 LEU B 77 5.007 -5.938 -19.038 1.00 0.00 H new ATOM 0 HG LEU B 77 4.937 -5.010 -16.163 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.051 -2.656 -16.937 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.571 -3.514 -17.282 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.402 -3.216 -18.590 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.879 -3.894 -16.986 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.237 -4.450 -18.638 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.854 -5.632 -17.364 1.00 0.00 H new ATOM 1724 N ASN B 78 7.269 -8.063 -16.128 1.00 0.00 N ATOM 1725 CA ASN B 78 8.182 -8.143 -14.960 1.00 0.00 C ATOM 1726 C ASN B 78 9.283 -7.105 -15.130 1.00 0.00 C ATOM 1727 O ASN B 78 9.745 -6.863 -16.228 1.00 0.00 O ATOM 1728 CB ASN B 78 8.818 -9.528 -14.905 1.00 0.00 C ATOM 1729 CG ASN B 78 7.753 -10.624 -15.061 1.00 0.00 C ATOM 1730 OD1 ASN B 78 8.027 -11.674 -15.609 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.545 -10.427 -14.604 1.00 0.00 N ATOM 0 H ASN B 78 7.521 -8.662 -16.914 1.00 0.00 H new ATOM 0 HA ASN B 78 7.623 -7.959 -14.042 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.562 -9.623 -15.696 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.341 -9.655 -13.957 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.836 -11.153 -14.708 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.311 -9.547 -14.144 1.00 0.00 H new ATOM 1738 N VAL B 79 9.709 -6.492 -14.061 1.00 0.00 N ATOM 1739 CA VAL B 79 10.786 -5.470 -14.169 1.00 0.00 C ATOM 1740 C VAL B 79 11.957 -5.862 -13.268 1.00 0.00 C ATOM 1741 O VAL B 79 12.026 -5.469 -12.119 1.00 0.00 O ATOM 1742 CB VAL B 79 10.242 -4.108 -13.746 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.284 -3.036 -14.056 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.954 -3.810 -14.521 1.00 0.00 C ATOM 0 H VAL B 79 9.358 -6.655 -13.117 1.00 0.00 H new ATOM 0 HA VAL B 79 11.131 -5.414 -15.201 1.00 0.00 H new ATOM 0 HB VAL B 79 10.027 -4.113 -12.677 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.902 -2.060 -13.756 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.201 -3.251 -13.508 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.494 -3.031 -15.126 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.565 -2.838 -14.220 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.167 -3.800 -15.590 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.213 -4.580 -14.305 1.00 0.00 H new ATOM 1754 N THR B 80 12.877 -6.636 -13.786 1.00 0.00 N ATOM 1755 CA THR B 80 14.050 -7.063 -12.971 1.00 0.00 C ATOM 1756 C THR B 80 15.077 -5.930 -12.917 1.00 0.00 C ATOM 1757 O THR B 80 15.873 -5.762 -13.820 1.00 0.00 O ATOM 1758 CB THR B 80 14.691 -8.300 -13.605 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.701 -9.304 -13.783 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.799 -8.828 -12.692 1.00 0.00 C ATOM 0 H THR B 80 12.864 -6.991 -14.742 1.00 0.00 H new ATOM 0 HA THR B 80 13.719 -7.302 -11.960 1.00 0.00 H new ATOM 0 HB THR B 80 15.118 -8.034 -14.572 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.325 -9.236 -14.685 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.255 -9.709 -13.145 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.557 -8.057 -12.556 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.376 -9.095 -11.724 1.00 0.00 H new ATOM 1768 N LEU B 81 15.062 -5.155 -11.863 1.00 0.00 N ATOM 1769 CA LEU B 81 16.030 -4.035 -11.736 1.00 0.00 C ATOM 1770 C LEU B 81 17.298 -4.539 -11.021 1.00 0.00 C ATOM 1771 O LEU B 81 17.194 -5.310 -10.088 1.00 0.00 O ATOM 1772 CB LEU B 81 15.383 -2.924 -10.911 1.00 0.00 C ATOM 1773 CG LEU B 81 14.094 -2.464 -11.596 1.00 0.00 C ATOM 1774 CD1 LEU B 81 13.064 -2.060 -10.537 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.397 -1.265 -12.498 1.00 0.00 C ATOM 0 H LEU B 81 14.414 -5.254 -11.081 1.00 0.00 H new ATOM 0 HA LEU B 81 16.300 -3.656 -12.721 1.00 0.00 H new ATOM 0 HB2 LEU B 81 15.165 -3.283 -9.905 1.00 0.00 H new ATOM 0 HB3 LEU B 81 16.072 -2.085 -10.807 1.00 0.00 H new ATOM 0 HG LEU B 81 13.692 -3.280 -12.197 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.147 -1.733 -11.027 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.848 -2.914 -9.895 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.463 -1.245 -9.933 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.480 -0.936 -12.987 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.800 -0.450 -11.897 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.127 -1.554 -13.254 1.00 0.00 H new ATOM 1787 N PRO B 82 18.463 -4.100 -11.463 1.00 0.00 N ATOM 1788 CA PRO B 82 19.774 -4.509 -10.863 1.00 0.00 C ATOM 1789 C PRO B 82 20.119 -3.621 -9.664 1.00 0.00 C ATOM 1790 O PRO B 82 19.356 -2.750 -9.286 1.00 0.00 O ATOM 1791 CB PRO B 82 20.765 -4.292 -11.997 1.00 0.00 C ATOM 1792 CG PRO B 82 20.166 -3.252 -12.927 1.00 0.00 C ATOM 1793 CD PRO B 82 18.672 -3.143 -12.610 1.00 0.00 C ATOM 0 HA PRO B 82 19.772 -5.533 -10.490 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.725 -3.953 -11.609 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.949 -5.225 -12.531 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.657 -2.289 -12.789 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.315 -3.539 -13.968 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.397 -2.125 -12.334 1.00 0.00 H new ATOM 0 HD3 PRO B 82 18.062 -3.415 -13.471 1.00 0.00 H new