USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 693 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 141 CYS SG : rot 122:sc= 1.83 USER MOD Set 1.2: A 145 GLN : amide:sc= 0.136 X(o=2,f=1.8) USER MOD Set 2.1: A 106 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 107 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 89 LYS NZ :NH3+ -113:sc= 0.603 (180deg=0) USER MOD Set 3.2: A 91 HIS : no HE2:sc= -0.156 K(o=0.45,f=-1.5) USER MOD Single : A 59 MET CE :methyl -176:sc= -0.299 (180deg=-0.303) USER MOD Single : A 69 CYS SG : rot -28:sc= 0.00766 USER MOD Single : A 70 TYR OH : rot -98:sc= 0.197 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ -113:sc= 0.255 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 18:sc= 0.827 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 102 GLN : amide:sc= -0.785 K(o=-0.79,f=-5!) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0.0521 USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN : amide:sc= -0.166 X(o=-0.17,f=-0.17) USER MOD Single : A 119 TYR OH : rot 30:sc= -0.356 USER MOD Single : A 122 GLN : amide:sc= -0.249 K(o=-0.25,f=-1.6) USER MOD Single : A 130 HIS :FLIP no HD1:sc= -0.264 F(o=-1.2,f=-0.26) USER MOD Single : A 131 THR OG1 : rot 173:sc= 2.12 USER MOD Single : A 134 GLN : amide:sc=-0.00239 X(o=-0.0024,f=0) USER MOD Single : A 135 MET CE :methyl 150:sc= -0.514 (180deg=-2.22) USER MOD Single : A 139 SER OG : rot -26:sc= 0.0625 USER MOD Single : A 143 GLN : amide:sc=-0.00301 K(o=-0.003,f=-0.87) USER MOD Single : A 150 HIS : no HE2:sc= -0.202 K(o=-0.2,f=-1.4) USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 59 -4.259 11.628 0.505 1.00 0.00 N ATOM 2 CA MET A 59 -3.991 10.951 -0.761 1.00 0.00 C ATOM 3 C MET A 59 -3.806 9.460 -0.491 1.00 0.00 C ATOM 4 O MET A 59 -3.613 9.052 0.657 1.00 0.00 O ATOM 5 CB MET A 59 -2.805 11.570 -1.508 1.00 0.00 C ATOM 6 CG MET A 59 -1.528 11.676 -0.673 1.00 0.00 C ATOM 7 SD MET A 59 -0.007 11.707 -1.661 1.00 0.00 S ATOM 8 CE MET A 59 0.090 9.962 -2.119 1.00 0.00 C ATOM 0 HA MET A 59 -4.844 11.082 -1.427 1.00 0.00 H new ATOM 0 HB2 MET A 59 -2.597 10.973 -2.396 1.00 0.00 H new ATOM 0 HB3 MET A 59 -3.085 12.566 -1.852 1.00 0.00 H new ATOM 0 HG2 MET A 59 -1.575 12.581 -0.067 1.00 0.00 H new ATOM 0 HG3 MET A 59 -1.485 10.833 0.017 1.00 0.00 H new ATOM 0 HE1 MET A 59 1.010 9.782 -2.674 1.00 0.00 H new ATOM 0 HE2 MET A 59 0.084 9.349 -1.218 1.00 0.00 H new ATOM 0 HE3 MET A 59 -0.766 9.701 -2.741 1.00 0.00 H new ATOM 18 N ALA A 60 -3.870 8.638 -1.539 1.00 0.00 N ATOM 19 CA ALA A 60 -3.537 7.223 -1.479 1.00 0.00 C ATOM 20 C ALA A 60 -2.081 7.091 -1.053 1.00 0.00 C ATOM 21 O ALA A 60 -1.183 7.292 -1.868 1.00 0.00 O ATOM 22 CB ALA A 60 -3.812 6.593 -2.845 1.00 0.00 C ATOM 0 H ALA A 60 -4.160 8.947 -2.467 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.148 6.694 -0.748 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.566 5.532 -2.812 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -4.866 6.714 -3.096 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.200 7.084 -3.602 1.00 0.00 H new ATOM 28 N GLY A 61 -1.860 6.855 0.238 1.00 0.00 N ATOM 29 CA GLY A 61 -0.615 7.174 0.888 1.00 0.00 C ATOM 30 C GLY A 61 -0.656 6.860 2.378 1.00 0.00 C ATOM 31 O GLY A 61 0.176 7.386 3.109 1.00 0.00 O ATOM 0 H GLY A 61 -2.552 6.434 0.857 1.00 0.00 H new ATOM 0 HA2 GLY A 61 0.193 6.612 0.420 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -0.392 8.231 0.746 1.00 0.00 H new ATOM 35 N GLY A 62 -1.611 6.041 2.845 1.00 0.00 N ATOM 36 CA GLY A 62 -2.195 6.066 4.192 1.00 0.00 C ATOM 37 C GLY A 62 -1.240 6.048 5.388 1.00 0.00 C ATOM 38 O GLY A 62 -1.640 6.429 6.490 1.00 0.00 O ATOM 0 H GLY A 62 -2.016 5.307 2.263 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -2.813 6.960 4.272 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.861 5.208 4.283 1.00 0.00 H new ATOM 42 N ALA A 63 -0.006 5.588 5.198 1.00 0.00 N ATOM 43 CA ALA A 63 1.068 5.657 6.192 1.00 0.00 C ATOM 44 C ALA A 63 2.437 5.597 5.533 1.00 0.00 C ATOM 45 O ALA A 63 3.381 5.036 6.091 1.00 0.00 O ATOM 46 CB ALA A 63 0.891 4.527 7.206 1.00 0.00 C ATOM 0 H ALA A 63 0.285 5.145 4.326 1.00 0.00 H new ATOM 0 HA ALA A 63 1.008 6.613 6.711 1.00 0.00 H new ATOM 0 HB1 ALA A 63 1.689 4.575 7.947 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -0.073 4.632 7.703 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.931 3.567 6.692 1.00 0.00 H new ATOM 52 N TRP A 64 2.514 6.086 4.300 1.00 0.00 N ATOM 53 CA TRP A 64 3.676 5.911 3.457 1.00 0.00 C ATOM 54 C TRP A 64 3.900 7.130 2.555 1.00 0.00 C ATOM 55 O TRP A 64 5.047 7.524 2.355 1.00 0.00 O ATOM 56 CB TRP A 64 3.552 4.577 2.711 1.00 0.00 C ATOM 57 CG TRP A 64 2.248 4.257 2.049 1.00 0.00 C ATOM 58 CD1 TRP A 64 1.217 3.565 2.587 1.00 0.00 C ATOM 59 CD2 TRP A 64 1.846 4.586 0.693 1.00 0.00 C ATOM 60 NE1 TRP A 64 0.207 3.441 1.654 1.00 0.00 N ATOM 61 CE2 TRP A 64 0.565 4.016 0.452 1.00 0.00 C ATOM 62 CE3 TRP A 64 2.429 5.342 -0.343 1.00 0.00 C ATOM 63 CZ2 TRP A 64 -0.077 4.155 -0.783 1.00 0.00 C ATOM 64 CZ3 TRP A 64 1.762 5.520 -1.566 1.00 0.00 C ATOM 65 CH2 TRP A 64 0.537 4.884 -1.809 1.00 0.00 C ATOM 0 H TRP A 64 1.763 6.618 3.861 1.00 0.00 H new ATOM 0 HA TRP A 64 4.582 5.854 4.061 1.00 0.00 H new ATOM 0 HB2 TRP A 64 4.329 4.549 1.947 1.00 0.00 H new ATOM 0 HB3 TRP A 64 3.771 3.778 3.419 1.00 0.00 H new ATOM 0 HD1 TRP A 64 1.189 3.170 3.592 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -0.688 2.984 1.830 1.00 0.00 H new ATOM 0 HE3 TRP A 64 3.400 5.790 -0.195 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -1.044 3.701 -0.945 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 2.197 6.152 -2.326 1.00 0.00 H new ATOM 0 HH2 TRP A 64 0.070 4.956 -2.780 1.00 0.00 H new ATOM 76 N GLY A 65 2.828 7.760 2.061 1.00 0.00 N ATOM 77 CA GLY A 65 2.819 8.966 1.238 1.00 0.00 C ATOM 78 C GLY A 65 3.952 8.999 0.217 1.00 0.00 C ATOM 79 O GLY A 65 3.924 8.265 -0.775 1.00 0.00 O ATOM 0 H GLY A 65 1.885 7.415 2.239 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.865 9.036 0.716 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.894 9.841 1.884 1.00 0.00 H new ATOM 83 N ARG A 66 4.972 9.825 0.470 1.00 0.00 N ATOM 84 CA ARG A 66 6.055 10.090 -0.473 1.00 0.00 C ATOM 85 C ARG A 66 6.855 8.844 -0.849 1.00 0.00 C ATOM 86 O ARG A 66 7.512 8.879 -1.890 1.00 0.00 O ATOM 87 CB ARG A 66 6.972 11.210 0.069 1.00 0.00 C ATOM 88 CG ARG A 66 7.519 12.094 -1.064 1.00 0.00 C ATOM 89 CD ARG A 66 6.425 13.049 -1.564 1.00 0.00 C ATOM 90 NE ARG A 66 6.519 13.337 -3.006 1.00 0.00 N ATOM 91 CZ ARG A 66 7.136 14.381 -3.570 1.00 0.00 C ATOM 92 NH1 ARG A 66 7.904 15.189 -2.853 1.00 0.00 N ATOM 93 NH2 ARG A 66 6.981 14.604 -4.866 1.00 0.00 N ATOM 0 H ARG A 66 5.067 10.334 1.349 1.00 0.00 H new ATOM 0 HA ARG A 66 5.591 10.427 -1.400 1.00 0.00 H new ATOM 0 HB2 ARG A 66 6.416 11.826 0.775 1.00 0.00 H new ATOM 0 HB3 ARG A 66 7.803 10.767 0.618 1.00 0.00 H new ATOM 0 HG2 ARG A 66 8.376 12.665 -0.708 1.00 0.00 H new ATOM 0 HG3 ARG A 66 7.871 11.470 -1.885 1.00 0.00 H new ATOM 0 HD2 ARG A 66 5.448 12.616 -1.350 1.00 0.00 H new ATOM 0 HD3 ARG A 66 6.487 13.985 -1.009 1.00 0.00 H new ATOM 0 HE ARG A 66 6.069 12.674 -3.637 1.00 0.00 H new ATOM 0 HH11 ARG A 66 8.032 15.019 -1.855 1.00 0.00 H new ATOM 0 HH12 ARG A 66 8.367 15.981 -3.299 1.00 0.00 H new ATOM 0 HH21 ARG A 66 6.396 13.982 -5.424 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.447 15.397 -5.306 1.00 0.00 H new ATOM 107 N LEU A 67 6.762 7.740 -0.093 1.00 0.00 N ATOM 108 CA LEU A 67 7.340 6.434 -0.418 1.00 0.00 C ATOM 109 C LEU A 67 7.151 6.136 -1.898 1.00 0.00 C ATOM 110 O LEU A 67 8.124 5.917 -2.615 1.00 0.00 O ATOM 111 CB LEU A 67 6.694 5.297 0.408 1.00 0.00 C ATOM 112 CG LEU A 67 7.634 4.681 1.454 1.00 0.00 C ATOM 113 CD1 LEU A 67 7.880 5.626 2.628 1.00 0.00 C ATOM 114 CD2 LEU A 67 7.112 3.338 1.978 1.00 0.00 C ATOM 0 H LEU A 67 6.262 7.736 0.796 1.00 0.00 H new ATOM 0 HA LEU A 67 8.401 6.479 -0.172 1.00 0.00 H new ATOM 0 HB2 LEU A 67 5.809 5.684 0.912 1.00 0.00 H new ATOM 0 HB3 LEU A 67 6.357 4.513 -0.271 1.00 0.00 H new ATOM 0 HG LEU A 67 8.580 4.509 0.941 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.550 5.150 3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.333 6.548 2.264 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.932 5.855 3.115 1.00 0.00 H new ATOM 0 HD21 LEU A 67 7.809 2.939 2.715 1.00 0.00 H new ATOM 0 HD22 LEU A 67 6.136 3.483 2.442 1.00 0.00 H new ATOM 0 HD23 LEU A 67 7.019 2.636 1.150 1.00 0.00 H new ATOM 126 N ALA A 68 5.902 6.125 -2.372 1.00 0.00 N ATOM 127 CA ALA A 68 5.648 5.686 -3.733 1.00 0.00 C ATOM 128 C ALA A 68 6.151 6.686 -4.768 1.00 0.00 C ATOM 129 O ALA A 68 6.318 6.284 -5.908 1.00 0.00 O ATOM 130 CB ALA A 68 4.165 5.413 -3.955 1.00 0.00 C ATOM 0 H ALA A 68 5.076 6.408 -1.845 1.00 0.00 H new ATOM 0 HA ALA A 68 6.205 4.759 -3.867 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.005 5.086 -4.982 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.832 4.633 -3.270 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.596 6.324 -3.771 1.00 0.00 H new ATOM 136 N CYS A 69 6.426 7.946 -4.410 1.00 0.00 N ATOM 137 CA CYS A 69 7.034 8.884 -5.341 1.00 0.00 C ATOM 138 C CYS A 69 8.457 8.418 -5.638 1.00 0.00 C ATOM 139 O CYS A 69 8.886 8.410 -6.789 1.00 0.00 O ATOM 140 CB CYS A 69 7.031 10.299 -4.749 1.00 0.00 C ATOM 141 SG CYS A 69 7.435 11.523 -6.026 1.00 0.00 S ATOM 0 H CYS A 69 6.236 8.331 -3.485 1.00 0.00 H new ATOM 0 HA CYS A 69 6.462 8.915 -6.269 1.00 0.00 H new ATOM 0 HB2 CYS A 69 6.052 10.519 -4.323 1.00 0.00 H new ATOM 0 HB3 CYS A 69 7.754 10.361 -3.936 1.00 0.00 H new ATOM 0 HG CYS A 69 8.176 10.969 -6.939 1.00 0.00 H new ATOM 147 N TYR A 70 9.218 8.028 -4.614 1.00 0.00 N ATOM 148 CA TYR A 70 10.545 7.464 -4.829 1.00 0.00 C ATOM 149 C TYR A 70 10.423 6.174 -5.629 1.00 0.00 C ATOM 150 O TYR A 70 11.137 5.980 -6.610 1.00 0.00 O ATOM 151 CB TYR A 70 11.245 7.235 -3.492 1.00 0.00 C ATOM 152 CG TYR A 70 11.325 8.489 -2.657 1.00 0.00 C ATOM 153 CD1 TYR A 70 12.065 9.588 -3.125 1.00 0.00 C ATOM 154 CD2 TYR A 70 10.578 8.590 -1.471 1.00 0.00 C ATOM 155 CE1 TYR A 70 12.025 10.800 -2.423 1.00 0.00 C ATOM 156 CE2 TYR A 70 10.556 9.791 -0.747 1.00 0.00 C ATOM 157 CZ TYR A 70 11.273 10.904 -1.234 1.00 0.00 C ATOM 158 OH TYR A 70 11.221 12.095 -0.594 1.00 0.00 O ATOM 0 H TYR A 70 8.938 8.093 -3.635 1.00 0.00 H new ATOM 0 HA TYR A 70 11.155 8.164 -5.400 1.00 0.00 H new ATOM 0 HB2 TYR A 70 10.712 6.465 -2.934 1.00 0.00 H new ATOM 0 HB3 TYR A 70 12.252 6.858 -3.673 1.00 0.00 H new ATOM 0 HD1 TYR A 70 12.661 9.499 -4.021 1.00 0.00 H new ATOM 0 HD2 TYR A 70 10.018 7.738 -1.115 1.00 0.00 H new ATOM 0 HE1 TYR A 70 12.571 11.656 -2.793 1.00 0.00 H new ATOM 0 HE2 TYR A 70 9.996 9.863 0.174 1.00 0.00 H new ATOM 0 HH TYR A 70 11.870 12.100 0.140 1.00 0.00 H new ATOM 168 N LEU A 71 9.451 5.330 -5.279 1.00 0.00 N ATOM 169 CA LEU A 71 9.212 4.055 -5.944 1.00 0.00 C ATOM 170 C LEU A 71 8.466 4.234 -7.292 1.00 0.00 C ATOM 171 O LEU A 71 8.020 3.245 -7.884 1.00 0.00 O ATOM 172 CB LEU A 71 8.516 3.079 -4.979 1.00 0.00 C ATOM 173 CG LEU A 71 9.244 2.611 -3.689 1.00 0.00 C ATOM 174 CD1 LEU A 71 10.389 3.453 -3.142 1.00 0.00 C ATOM 175 CD2 LEU A 71 8.231 2.322 -2.572 1.00 0.00 C ATOM 0 H LEU A 71 8.801 5.518 -4.516 1.00 0.00 H new ATOM 0 HA LEU A 71 10.171 3.611 -6.211 1.00 0.00 H new ATOM 0 HB2 LEU A 71 7.577 3.540 -4.672 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.261 2.186 -5.549 1.00 0.00 H new ATOM 0 HG LEU A 71 9.753 1.711 -4.035 1.00 0.00 H new ATOM 0 HD11 LEU A 71 10.785 2.986 -2.240 1.00 0.00 H new ATOM 0 HD12 LEU A 71 11.178 3.524 -3.891 1.00 0.00 H new ATOM 0 HD13 LEU A 71 10.024 4.452 -2.903 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.760 1.995 -1.677 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.666 3.227 -2.350 1.00 0.00 H new ATOM 0 HD23 LEU A 71 7.547 1.538 -2.895 1.00 0.00 H new ATOM 187 N GLU A 72 8.313 5.475 -7.770 1.00 0.00 N ATOM 188 CA GLU A 72 7.900 5.861 -9.119 1.00 0.00 C ATOM 189 C GLU A 72 9.101 6.420 -9.900 1.00 0.00 C ATOM 190 O GLU A 72 9.016 6.492 -11.125 1.00 0.00 O ATOM 191 CB GLU A 72 6.763 6.913 -9.082 1.00 0.00 C ATOM 192 CG GLU A 72 5.344 6.334 -8.950 1.00 0.00 C ATOM 193 CD GLU A 72 4.287 7.448 -8.853 1.00 0.00 C ATOM 194 OE1 GLU A 72 3.864 7.987 -9.905 1.00 0.00 O ATOM 195 OE2 GLU A 72 3.811 7.800 -7.743 1.00 0.00 O ATOM 0 H GLU A 72 8.487 6.290 -7.182 1.00 0.00 H new ATOM 0 HA GLU A 72 7.523 4.970 -9.621 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.942 7.590 -8.246 1.00 0.00 H new ATOM 0 HB3 GLU A 72 6.812 7.511 -9.992 1.00 0.00 H new ATOM 0 HG2 GLU A 72 5.127 5.699 -9.809 1.00 0.00 H new ATOM 0 HG3 GLU A 72 5.289 5.701 -8.064 1.00 0.00 H new ATOM 202 N PHE A 73 10.223 6.778 -9.252 1.00 0.00 N ATOM 203 CA PHE A 73 11.452 7.163 -9.946 1.00 0.00 C ATOM 204 C PHE A 73 12.018 5.921 -10.625 1.00 0.00 C ATOM 205 O PHE A 73 12.166 5.903 -11.851 1.00 0.00 O ATOM 206 CB PHE A 73 12.471 7.860 -9.006 1.00 0.00 C ATOM 207 CG PHE A 73 13.863 7.241 -8.881 1.00 0.00 C ATOM 208 CD1 PHE A 73 14.728 7.150 -9.991 1.00 0.00 C ATOM 209 CD2 PHE A 73 14.284 6.709 -7.650 1.00 0.00 C ATOM 210 CE1 PHE A 73 15.974 6.504 -9.878 1.00 0.00 C ATOM 211 CE2 PHE A 73 15.533 6.076 -7.536 1.00 0.00 C ATOM 212 CZ PHE A 73 16.373 5.951 -8.651 1.00 0.00 C ATOM 0 H PHE A 73 10.298 6.807 -8.235 1.00 0.00 H new ATOM 0 HA PHE A 73 11.228 7.914 -10.704 1.00 0.00 H new ATOM 0 HB2 PHE A 73 12.591 8.889 -9.346 1.00 0.00 H new ATOM 0 HB3 PHE A 73 12.032 7.903 -8.009 1.00 0.00 H new ATOM 0 HD1 PHE A 73 14.432 7.580 -10.937 1.00 0.00 H new ATOM 0 HD2 PHE A 73 13.642 6.787 -6.785 1.00 0.00 H new ATOM 0 HE1 PHE A 73 16.624 6.434 -10.737 1.00 0.00 H new ATOM 0 HE2 PHE A 73 15.849 5.682 -6.581 1.00 0.00 H new ATOM 0 HZ PHE A 73 17.318 5.434 -8.567 1.00 0.00 H new ATOM 222 N LEU A 74 12.335 4.899 -9.826 1.00 0.00 N ATOM 223 CA LEU A 74 13.015 3.709 -10.304 1.00 0.00 C ATOM 224 C LEU A 74 12.002 2.674 -10.755 1.00 0.00 C ATOM 225 O LEU A 74 10.887 2.560 -10.240 1.00 0.00 O ATOM 226 CB LEU A 74 14.035 3.162 -9.291 1.00 0.00 C ATOM 227 CG LEU A 74 13.518 2.422 -8.044 1.00 0.00 C ATOM 228 CD1 LEU A 74 14.713 2.021 -7.173 1.00 0.00 C ATOM 229 CD2 LEU A 74 12.557 3.230 -7.181 1.00 0.00 C ATOM 0 H LEU A 74 12.124 4.881 -8.828 1.00 0.00 H new ATOM 0 HA LEU A 74 13.611 3.984 -11.174 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.700 2.483 -9.826 1.00 0.00 H new ATOM 0 HB3 LEU A 74 14.643 4.000 -8.949 1.00 0.00 H new ATOM 0 HG LEU A 74 12.961 1.562 -8.417 1.00 0.00 H new ATOM 0 HD11 LEU A 74 14.357 1.496 -6.287 1.00 0.00 H new ATOM 0 HD12 LEU A 74 15.374 1.367 -7.741 1.00 0.00 H new ATOM 0 HD13 LEU A 74 15.259 2.915 -6.871 1.00 0.00 H new ATOM 0 HD21 LEU A 74 12.244 2.631 -6.326 1.00 0.00 H new ATOM 0 HD22 LEU A 74 13.056 4.133 -6.829 1.00 0.00 H new ATOM 0 HD23 LEU A 74 11.682 3.505 -7.770 1.00 0.00 H new ATOM 241 N LYS A 75 12.430 1.893 -11.732 1.00 0.00 N ATOM 242 CA LYS A 75 11.659 0.883 -12.429 1.00 0.00 C ATOM 243 C LYS A 75 12.305 -0.462 -12.149 1.00 0.00 C ATOM 244 O LYS A 75 13.121 -0.589 -11.235 1.00 0.00 O ATOM 245 CB LYS A 75 11.540 1.272 -13.920 1.00 0.00 C ATOM 246 CG LYS A 75 10.102 1.679 -14.275 1.00 0.00 C ATOM 247 CD LYS A 75 9.171 0.462 -14.400 1.00 0.00 C ATOM 248 CE LYS A 75 7.712 0.861 -14.649 1.00 0.00 C ATOM 249 NZ LYS A 75 7.020 1.382 -13.450 1.00 0.00 N ATOM 0 H LYS A 75 13.387 1.953 -12.080 1.00 0.00 H new ATOM 0 HA LYS A 75 10.629 0.810 -12.079 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.219 2.097 -14.139 1.00 0.00 H new ATOM 0 HB3 LYS A 75 11.847 0.432 -14.543 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.717 2.353 -13.509 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.104 2.232 -15.214 1.00 0.00 H new ATOM 0 HD2 LYS A 75 9.515 -0.172 -15.217 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.231 -0.132 -13.488 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.681 1.619 -15.432 1.00 0.00 H new ATOM 0 HE3 LYS A 75 7.167 -0.006 -15.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 6.040 1.630 -13.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 7.017 0.654 -12.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.515 2.228 -13.104 1.00 0.00 H new ATOM 263 N LYS A 76 11.847 -1.507 -12.834 1.00 0.00 N ATOM 264 CA LYS A 76 12.041 -2.889 -12.414 1.00 0.00 C ATOM 265 C LYS A 76 13.497 -3.318 -12.305 1.00 0.00 C ATOM 266 O LYS A 76 13.733 -4.331 -11.659 1.00 0.00 O ATOM 267 CB LYS A 76 11.273 -3.831 -13.347 1.00 0.00 C ATOM 268 CG LYS A 76 9.747 -3.676 -13.258 1.00 0.00 C ATOM 269 CD LYS A 76 9.202 -3.905 -11.841 1.00 0.00 C ATOM 270 CE LYS A 76 7.713 -4.251 -11.848 1.00 0.00 C ATOM 271 NZ LYS A 76 6.854 -3.131 -12.283 1.00 0.00 N ATOM 0 H LYS A 76 11.325 -1.415 -13.706 1.00 0.00 H new ATOM 0 HA LYS A 76 11.645 -2.952 -11.400 1.00 0.00 H new ATOM 0 HB2 LYS A 76 11.589 -3.649 -14.374 1.00 0.00 H new ATOM 0 HB3 LYS A 76 11.540 -4.861 -13.110 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.469 -2.676 -13.591 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.275 -4.382 -13.941 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.759 -4.712 -11.364 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.363 -3.009 -11.242 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.548 -5.103 -12.507 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.415 -4.561 -10.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 6.273 -2.808 -11.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.449 -2.347 -12.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.234 -3.449 -13.055 1.00 0.00 H new ATOM 285 N GLU A 77 14.444 -2.567 -12.858 1.00 0.00 N ATOM 286 CA GLU A 77 15.857 -2.699 -12.523 1.00 0.00 C ATOM 287 C GLU A 77 16.031 -2.694 -11.004 1.00 0.00 C ATOM 288 O GLU A 77 16.293 -3.719 -10.373 1.00 0.00 O ATOM 289 CB GLU A 77 16.688 -1.565 -13.151 1.00 0.00 C ATOM 290 CG GLU A 77 16.714 -1.576 -14.683 1.00 0.00 C ATOM 291 CD GLU A 77 15.868 -0.499 -15.366 1.00 0.00 C ATOM 292 OE1 GLU A 77 15.643 0.605 -14.829 1.00 0.00 O ATOM 293 OE2 GLU A 77 15.362 -0.791 -16.474 1.00 0.00 O ATOM 0 H GLU A 77 14.252 -1.847 -13.554 1.00 0.00 H new ATOM 0 HA GLU A 77 16.216 -3.645 -12.928 1.00 0.00 H new ATOM 0 HB2 GLU A 77 16.290 -0.608 -12.813 1.00 0.00 H new ATOM 0 HB3 GLU A 77 17.711 -1.633 -12.781 1.00 0.00 H new ATOM 0 HG2 GLU A 77 17.747 -1.464 -15.012 1.00 0.00 H new ATOM 0 HG3 GLU A 77 16.374 -2.553 -15.027 1.00 0.00 H new ATOM 300 N GLU A 78 15.841 -1.529 -10.401 1.00 0.00 N ATOM 301 CA GLU A 78 16.347 -1.235 -9.077 1.00 0.00 C ATOM 302 C GLU A 78 15.185 -1.224 -8.086 1.00 0.00 C ATOM 303 O GLU A 78 15.397 -1.421 -6.897 1.00 0.00 O ATOM 304 CB GLU A 78 17.149 0.074 -9.158 1.00 0.00 C ATOM 305 CG GLU A 78 18.536 -0.158 -9.772 1.00 0.00 C ATOM 306 CD GLU A 78 19.158 1.148 -10.256 1.00 0.00 C ATOM 307 OE1 GLU A 78 18.922 1.506 -11.433 1.00 0.00 O ATOM 308 OE2 GLU A 78 19.921 1.800 -9.514 1.00 0.00 O ATOM 0 H GLU A 78 15.326 -0.757 -10.825 1.00 0.00 H new ATOM 0 HA GLU A 78 17.032 -1.998 -8.707 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.601 0.802 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 78 17.257 0.499 -8.160 1.00 0.00 H new ATOM 0 HG2 GLU A 78 19.189 -0.622 -9.033 1.00 0.00 H new ATOM 0 HG3 GLU A 78 18.454 -0.854 -10.606 1.00 0.00 H new ATOM 315 N LEU A 79 13.940 -1.112 -8.564 1.00 0.00 N ATOM 316 CA LEU A 79 12.739 -1.386 -7.790 1.00 0.00 C ATOM 317 C LEU A 79 12.740 -2.855 -7.374 1.00 0.00 C ATOM 318 O LEU A 79 12.406 -3.167 -6.230 1.00 0.00 O ATOM 319 CB LEU A 79 11.504 -1.032 -8.646 1.00 0.00 C ATOM 320 CG LEU A 79 10.128 -0.995 -7.950 1.00 0.00 C ATOM 321 CD1 LEU A 79 9.535 -2.388 -7.725 1.00 0.00 C ATOM 322 CD2 LEU A 79 10.141 -0.203 -6.641 1.00 0.00 C ATOM 0 H LEU A 79 13.743 -0.821 -9.522 1.00 0.00 H new ATOM 0 HA LEU A 79 12.710 -0.780 -6.884 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.678 -0.054 -9.095 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.446 -1.752 -9.463 1.00 0.00 H new ATOM 0 HG LEU A 79 9.478 -0.468 -8.648 1.00 0.00 H new ATOM 0 HD11 LEU A 79 8.567 -2.296 -7.232 1.00 0.00 H new ATOM 0 HD12 LEU A 79 9.407 -2.888 -8.685 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.208 -2.973 -7.098 1.00 0.00 H new ATOM 0 HD21 LEU A 79 9.145 -0.214 -6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.850 -0.657 -5.948 1.00 0.00 H new ATOM 0 HD23 LEU A 79 10.438 0.826 -6.842 1.00 0.00 H new ATOM 334 N LYS A 80 13.107 -3.770 -8.285 1.00 0.00 N ATOM 335 CA LYS A 80 13.182 -5.179 -7.920 1.00 0.00 C ATOM 336 C LYS A 80 14.339 -5.410 -6.967 1.00 0.00 C ATOM 337 O LYS A 80 14.073 -6.030 -5.947 1.00 0.00 O ATOM 338 CB LYS A 80 13.221 -6.127 -9.130 1.00 0.00 C ATOM 339 CG LYS A 80 13.190 -7.617 -8.734 1.00 0.00 C ATOM 340 CD LYS A 80 11.909 -8.082 -8.007 1.00 0.00 C ATOM 341 CE LYS A 80 12.210 -9.137 -6.933 1.00 0.00 C ATOM 342 NZ LYS A 80 12.408 -10.493 -7.479 1.00 0.00 N ATOM 0 H LYS A 80 13.349 -3.560 -9.253 1.00 0.00 H new ATOM 0 HA LYS A 80 12.254 -5.428 -7.405 1.00 0.00 H new ATOM 0 HB2 LYS A 80 12.372 -5.912 -9.779 1.00 0.00 H new ATOM 0 HB3 LYS A 80 14.123 -5.930 -9.709 1.00 0.00 H new ATOM 0 HG2 LYS A 80 13.315 -8.218 -9.635 1.00 0.00 H new ATOM 0 HG3 LYS A 80 14.047 -7.823 -8.092 1.00 0.00 H new ATOM 0 HD2 LYS A 80 11.422 -7.223 -7.545 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.208 -8.494 -8.734 1.00 0.00 H new ATOM 0 HE2 LYS A 80 13.104 -8.841 -6.385 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.389 -9.159 -6.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 12.607 -11.155 -6.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 11.548 -10.795 -7.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 13.209 -10.487 -8.142 1.00 0.00 H new ATOM 356 N GLU A 81 15.554 -4.911 -7.230 1.00 0.00 N ATOM 357 CA GLU A 81 16.651 -5.045 -6.264 1.00 0.00 C ATOM 358 C GLU A 81 16.219 -4.513 -4.906 1.00 0.00 C ATOM 359 O GLU A 81 16.375 -5.219 -3.921 1.00 0.00 O ATOM 360 CB GLU A 81 17.960 -4.395 -6.745 1.00 0.00 C ATOM 361 CG GLU A 81 18.783 -5.378 -7.596 1.00 0.00 C ATOM 362 CD GLU A 81 20.061 -5.922 -6.960 1.00 0.00 C ATOM 363 OE1 GLU A 81 21.076 -5.196 -6.892 1.00 0.00 O ATOM 364 OE2 GLU A 81 20.035 -7.124 -6.598 1.00 0.00 O ATOM 0 H GLU A 81 15.800 -4.419 -8.089 1.00 0.00 H new ATOM 0 HA GLU A 81 16.873 -6.108 -6.168 1.00 0.00 H new ATOM 0 HB2 GLU A 81 17.734 -3.503 -7.330 1.00 0.00 H new ATOM 0 HB3 GLU A 81 18.547 -4.072 -5.885 1.00 0.00 H new ATOM 0 HG2 GLU A 81 18.145 -6.222 -7.856 1.00 0.00 H new ATOM 0 HG3 GLU A 81 19.050 -4.882 -8.529 1.00 0.00 H new ATOM 371 N PHE A 82 15.583 -3.345 -4.836 1.00 0.00 N ATOM 372 CA PHE A 82 15.106 -2.799 -3.576 1.00 0.00 C ATOM 373 C PHE A 82 14.203 -3.784 -2.845 1.00 0.00 C ATOM 374 O PHE A 82 14.385 -3.988 -1.652 1.00 0.00 O ATOM 375 CB PHE A 82 14.380 -1.473 -3.840 1.00 0.00 C ATOM 376 CG PHE A 82 13.999 -0.666 -2.614 1.00 0.00 C ATOM 377 CD1 PHE A 82 12.913 -1.041 -1.797 1.00 0.00 C ATOM 378 CD2 PHE A 82 14.717 0.505 -2.323 1.00 0.00 C ATOM 379 CE1 PHE A 82 12.568 -0.255 -0.682 1.00 0.00 C ATOM 380 CE2 PHE A 82 14.345 1.314 -1.238 1.00 0.00 C ATOM 381 CZ PHE A 82 13.277 0.929 -0.414 1.00 0.00 C ATOM 0 H PHE A 82 15.387 -2.758 -5.647 1.00 0.00 H new ATOM 0 HA PHE A 82 15.962 -2.615 -2.927 1.00 0.00 H new ATOM 0 HB2 PHE A 82 15.015 -0.854 -4.474 1.00 0.00 H new ATOM 0 HB3 PHE A 82 13.473 -1.685 -4.407 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.346 -1.931 -2.027 1.00 0.00 H new ATOM 0 HD2 PHE A 82 15.560 0.785 -2.937 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.760 -0.561 -0.034 1.00 0.00 H new ATOM 0 HE2 PHE A 82 14.880 2.231 -1.038 1.00 0.00 H new ATOM 0 HZ PHE A 82 12.999 1.544 0.429 1.00 0.00 H new ATOM 391 N GLN A 83 13.246 -4.415 -3.528 1.00 0.00 N ATOM 392 CA GLN A 83 12.420 -5.437 -2.906 1.00 0.00 C ATOM 393 C GLN A 83 13.263 -6.648 -2.482 1.00 0.00 C ATOM 394 O GLN A 83 13.098 -7.136 -1.369 1.00 0.00 O ATOM 395 CB GLN A 83 11.292 -5.839 -3.865 1.00 0.00 C ATOM 396 CG GLN A 83 10.238 -6.688 -3.146 1.00 0.00 C ATOM 397 CD GLN A 83 9.193 -7.212 -4.117 1.00 0.00 C ATOM 398 OE1 GLN A 83 8.363 -6.455 -4.624 1.00 0.00 O ATOM 399 NE2 GLN A 83 9.198 -8.499 -4.405 1.00 0.00 N ATOM 0 H GLN A 83 13.029 -4.233 -4.508 1.00 0.00 H new ATOM 0 HA GLN A 83 11.974 -5.031 -1.998 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.825 -4.945 -4.278 1.00 0.00 H new ATOM 0 HB3 GLN A 83 11.705 -6.399 -4.704 1.00 0.00 H new ATOM 0 HG2 GLN A 83 10.723 -7.525 -2.644 1.00 0.00 H new ATOM 0 HG3 GLN A 83 9.753 -6.091 -2.374 1.00 0.00 H new ATOM 0 HE21 GLN A 83 9.891 -9.114 -3.978 1.00 0.00 H new ATOM 0 HE22 GLN A 83 8.509 -8.879 -5.054 1.00 0.00 H new ATOM 408 N LEU A 84 14.131 -7.133 -3.369 1.00 0.00 N ATOM 409 CA LEU A 84 14.892 -8.360 -3.302 1.00 0.00 C ATOM 410 C LEU A 84 15.855 -8.287 -2.125 1.00 0.00 C ATOM 411 O LEU A 84 15.725 -9.035 -1.160 1.00 0.00 O ATOM 412 CB LEU A 84 15.594 -8.485 -4.671 1.00 0.00 C ATOM 413 CG LEU A 84 16.156 -9.864 -4.980 1.00 0.00 C ATOM 414 CD1 LEU A 84 16.511 -9.966 -6.468 1.00 0.00 C ATOM 415 CD2 LEU A 84 17.391 -10.211 -4.149 1.00 0.00 C ATOM 0 H LEU A 84 14.331 -6.622 -4.229 1.00 0.00 H new ATOM 0 HA LEU A 84 14.282 -9.247 -3.128 1.00 0.00 H new ATOM 0 HB2 LEU A 84 14.884 -8.215 -5.453 1.00 0.00 H new ATOM 0 HB3 LEU A 84 16.407 -7.760 -4.714 1.00 0.00 H new ATOM 0 HG LEU A 84 15.375 -10.579 -4.719 1.00 0.00 H new ATOM 0 HD11 LEU A 84 16.913 -10.957 -6.679 1.00 0.00 H new ATOM 0 HD12 LEU A 84 15.616 -9.802 -7.068 1.00 0.00 H new ATOM 0 HD13 LEU A 84 17.257 -9.212 -6.717 1.00 0.00 H new ATOM 0 HD21 LEU A 84 17.742 -11.207 -4.418 1.00 0.00 H new ATOM 0 HD22 LEU A 84 18.178 -9.483 -4.346 1.00 0.00 H new ATOM 0 HD23 LEU A 84 17.134 -10.190 -3.090 1.00 0.00 H new ATOM 427 N LEU A 85 16.797 -7.354 -2.210 1.00 0.00 N ATOM 428 CA LEU A 85 17.846 -7.082 -1.245 1.00 0.00 C ATOM 429 C LEU A 85 17.251 -6.872 0.147 1.00 0.00 C ATOM 430 O LEU A 85 17.694 -7.506 1.107 1.00 0.00 O ATOM 431 CB LEU A 85 18.629 -5.843 -1.713 1.00 0.00 C ATOM 432 CG LEU A 85 19.302 -5.957 -3.098 1.00 0.00 C ATOM 433 CD1 LEU A 85 19.890 -4.599 -3.480 1.00 0.00 C ATOM 434 CD2 LEU A 85 20.385 -7.027 -3.168 1.00 0.00 C ATOM 0 H LEU A 85 16.848 -6.726 -3.012 1.00 0.00 H new ATOM 0 HA LEU A 85 18.525 -7.932 -1.179 1.00 0.00 H new ATOM 0 HB2 LEU A 85 17.949 -4.992 -1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.398 -5.622 -0.973 1.00 0.00 H new ATOM 0 HG LEU A 85 18.529 -6.262 -3.803 1.00 0.00 H new ATOM 0 HD11 LEU A 85 20.367 -4.671 -4.457 1.00 0.00 H new ATOM 0 HD12 LEU A 85 19.094 -3.856 -3.519 1.00 0.00 H new ATOM 0 HD13 LEU A 85 20.629 -4.300 -2.736 1.00 0.00 H new ATOM 0 HD21 LEU A 85 20.812 -7.048 -4.171 1.00 0.00 H new ATOM 0 HD22 LEU A 85 21.168 -6.800 -2.445 1.00 0.00 H new ATOM 0 HD23 LEU A 85 19.951 -8.000 -2.938 1.00 0.00 H new ATOM 446 N LEU A 86 16.213 -6.034 0.265 1.00 0.00 N ATOM 447 CA LEU A 86 15.519 -5.744 1.510 1.00 0.00 C ATOM 448 C LEU A 86 14.898 -7.025 2.048 1.00 0.00 C ATOM 449 O LEU A 86 15.165 -7.409 3.182 1.00 0.00 O ATOM 450 CB LEU A 86 14.452 -4.677 1.228 1.00 0.00 C ATOM 451 CG LEU A 86 13.705 -4.061 2.421 1.00 0.00 C ATOM 452 CD1 LEU A 86 12.626 -3.131 1.858 1.00 0.00 C ATOM 453 CD2 LEU A 86 13.003 -5.075 3.316 1.00 0.00 C ATOM 0 H LEU A 86 15.827 -5.528 -0.532 1.00 0.00 H new ATOM 0 HA LEU A 86 16.207 -5.363 2.265 1.00 0.00 H new ATOM 0 HB2 LEU A 86 14.930 -3.865 0.680 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.710 -5.117 0.562 1.00 0.00 H new ATOM 0 HG LEU A 86 14.452 -3.556 3.033 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.074 -2.675 2.680 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.095 -2.351 1.258 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.940 -3.705 1.235 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.502 -4.554 4.132 1.00 0.00 H new ATOM 0 HD22 LEU A 86 12.267 -5.628 2.732 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.737 -5.769 3.725 1.00 0.00 H new ATOM 465 N ALA A 87 14.056 -7.704 1.272 1.00 0.00 N ATOM 466 CA ALA A 87 13.355 -8.880 1.762 1.00 0.00 C ATOM 467 C ALA A 87 14.335 -10.008 2.108 1.00 0.00 C ATOM 468 O ALA A 87 14.008 -10.859 2.937 1.00 0.00 O ATOM 469 CB ALA A 87 12.337 -9.342 0.720 1.00 0.00 C ATOM 0 H ALA A 87 13.846 -7.458 0.305 1.00 0.00 H new ATOM 0 HA ALA A 87 12.829 -8.615 2.679 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.813 -10.223 1.089 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.618 -8.544 0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.853 -9.589 -0.208 1.00 0.00 H new ATOM 475 N ASN A 88 15.531 -10.026 1.513 1.00 0.00 N ATOM 476 CA ASN A 88 16.606 -10.956 1.850 1.00 0.00 C ATOM 477 C ASN A 88 17.358 -10.512 3.108 1.00 0.00 C ATOM 478 O ASN A 88 17.858 -11.369 3.841 1.00 0.00 O ATOM 479 CB ASN A 88 17.568 -11.129 0.661 1.00 0.00 C ATOM 480 CG ASN A 88 16.984 -11.988 -0.460 1.00 0.00 C ATOM 481 OD1 ASN A 88 15.814 -12.371 -0.448 1.00 0.00 O ATOM 482 ND2 ASN A 88 17.780 -12.354 -1.444 1.00 0.00 N ATOM 0 H ASN A 88 15.782 -9.378 0.766 1.00 0.00 H new ATOM 0 HA ASN A 88 16.154 -11.924 2.066 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.825 -10.147 0.263 1.00 0.00 H new ATOM 0 HB3 ASN A 88 18.495 -11.582 1.013 1.00 0.00 H new ATOM 0 HD21 ASN A 88 17.426 -12.952 -2.191 1.00 0.00 H new ATOM 0 HD22 ASN A 88 18.750 -12.040 -1.459 1.00 0.00 H new ATOM 489 N LYS A 89 17.435 -9.210 3.403 1.00 0.00 N ATOM 490 CA LYS A 89 17.814 -8.679 4.714 1.00 0.00 C ATOM 491 C LYS A 89 16.787 -9.114 5.756 1.00 0.00 C ATOM 492 O LYS A 89 17.160 -9.530 6.855 1.00 0.00 O ATOM 493 CB LYS A 89 17.988 -7.139 4.623 1.00 0.00 C ATOM 494 CG LYS A 89 17.620 -6.337 5.886 1.00 0.00 C ATOM 495 CD LYS A 89 18.532 -6.694 7.066 1.00 0.00 C ATOM 496 CE LYS A 89 17.762 -6.842 8.381 1.00 0.00 C ATOM 497 NZ LYS A 89 18.394 -7.849 9.258 1.00 0.00 N ATOM 0 H LYS A 89 17.231 -8.480 2.720 1.00 0.00 H new ATOM 0 HA LYS A 89 18.775 -9.083 5.032 1.00 0.00 H new ATOM 0 HB2 LYS A 89 19.027 -6.926 4.373 1.00 0.00 H new ATOM 0 HB3 LYS A 89 17.379 -6.774 3.796 1.00 0.00 H new ATOM 0 HG2 LYS A 89 17.697 -5.270 5.676 1.00 0.00 H new ATOM 0 HG3 LYS A 89 16.582 -6.535 6.154 1.00 0.00 H new ATOM 0 HD2 LYS A 89 19.054 -7.626 6.848 1.00 0.00 H new ATOM 0 HD3 LYS A 89 19.293 -5.921 7.179 1.00 0.00 H new ATOM 0 HE2 LYS A 89 17.725 -5.881 8.894 1.00 0.00 H new ATOM 0 HE3 LYS A 89 16.732 -7.132 8.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 17.762 -8.669 9.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 19.296 -8.156 8.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 18.570 -7.432 10.194 1.00 0.00 H new ATOM 511 N ALA A 90 15.499 -9.004 5.443 1.00 0.00 N ATOM 512 CA ALA A 90 14.396 -9.299 6.338 1.00 0.00 C ATOM 513 C ALA A 90 14.133 -10.810 6.405 1.00 0.00 C ATOM 514 O ALA A 90 13.042 -11.296 6.107 1.00 0.00 O ATOM 515 CB ALA A 90 13.174 -8.487 5.916 1.00 0.00 C ATOM 0 H ALA A 90 15.188 -8.695 4.522 1.00 0.00 H new ATOM 0 HA ALA A 90 14.649 -9.001 7.355 1.00 0.00 H new ATOM 0 HB1 ALA A 90 12.343 -8.706 6.586 1.00 0.00 H new ATOM 0 HB2 ALA A 90 13.409 -7.424 5.965 1.00 0.00 H new ATOM 0 HB3 ALA A 90 12.897 -8.751 4.895 1.00 0.00 H new ATOM 521 N HIS A 91 15.161 -11.542 6.822 1.00 0.00 N ATOM 522 CA HIS A 91 15.113 -12.917 7.283 1.00 0.00 C ATOM 523 C HIS A 91 13.939 -13.154 8.240 1.00 0.00 C ATOM 524 O HIS A 91 13.824 -12.489 9.270 1.00 0.00 O ATOM 525 CB HIS A 91 16.459 -13.253 7.947 1.00 0.00 C ATOM 526 CG HIS A 91 17.033 -12.272 8.964 1.00 0.00 C ATOM 527 ND1 HIS A 91 18.289 -12.370 9.516 1.00 0.00 N ATOM 528 CD2 HIS A 91 16.467 -11.133 9.482 1.00 0.00 C ATOM 529 CE1 HIS A 91 18.473 -11.326 10.338 1.00 0.00 C ATOM 530 NE2 HIS A 91 17.397 -10.520 10.334 1.00 0.00 N ATOM 0 H HIS A 91 16.108 -11.163 6.847 1.00 0.00 H new ATOM 0 HA HIS A 91 14.949 -13.579 6.433 1.00 0.00 H new ATOM 0 HB2 HIS A 91 16.353 -14.219 8.441 1.00 0.00 H new ATOM 0 HB3 HIS A 91 17.197 -13.379 7.155 1.00 0.00 H new ATOM 0 HD1 HIS A 91 18.966 -13.111 9.332 1.00 0.00 H new ATOM 0 HD2 HIS A 91 15.472 -10.770 9.269 1.00 0.00 H new ATOM 0 HE1 HIS A 91 19.364 -11.156 10.923 1.00 0.00 H new ATOM 538 N SER A 92 13.085 -14.119 7.915 1.00 0.00 N ATOM 539 CA SER A 92 12.045 -14.613 8.801 1.00 0.00 C ATOM 540 C SER A 92 11.724 -16.069 8.426 1.00 0.00 C ATOM 541 O SER A 92 12.363 -16.633 7.529 1.00 0.00 O ATOM 542 CB SER A 92 10.860 -13.636 8.776 1.00 0.00 C ATOM 543 OG SER A 92 10.332 -13.434 7.477 1.00 0.00 O ATOM 0 H SER A 92 13.100 -14.587 7.009 1.00 0.00 H new ATOM 0 HA SER A 92 12.362 -14.648 9.843 1.00 0.00 H new ATOM 0 HB2 SER A 92 10.072 -14.014 9.427 1.00 0.00 H new ATOM 0 HB3 SER A 92 11.179 -12.677 9.185 1.00 0.00 H new ATOM 0 HG SER A 92 9.581 -12.806 7.523 1.00 0.00 H new ATOM 549 N ARG A 93 10.784 -16.706 9.136 1.00 0.00 N ATOM 550 CA ARG A 93 10.762 -18.155 9.367 1.00 0.00 C ATOM 551 C ARG A 93 12.142 -18.600 9.878 1.00 0.00 C ATOM 552 O ARG A 93 12.896 -17.823 10.464 1.00 0.00 O ATOM 553 CB ARG A 93 10.258 -18.953 8.135 1.00 0.00 C ATOM 554 CG ARG A 93 8.793 -18.694 7.760 1.00 0.00 C ATOM 555 CD ARG A 93 8.325 -19.720 6.712 1.00 0.00 C ATOM 556 NE ARG A 93 6.891 -19.613 6.392 1.00 0.00 N ATOM 557 CZ ARG A 93 5.858 -20.017 7.142 1.00 0.00 C ATOM 558 NH1 ARG A 93 6.046 -20.527 8.356 1.00 0.00 N ATOM 559 NH2 ARG A 93 4.624 -19.903 6.671 1.00 0.00 N ATOM 0 H ARG A 93 10.003 -16.218 9.574 1.00 0.00 H new ATOM 0 HA ARG A 93 10.028 -18.384 10.140 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.887 -18.709 7.279 1.00 0.00 H new ATOM 0 HB3 ARG A 93 10.386 -20.018 8.331 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.165 -18.758 8.649 1.00 0.00 H new ATOM 0 HG3 ARG A 93 8.684 -17.684 7.365 1.00 0.00 H new ATOM 0 HD2 ARG A 93 8.905 -19.587 5.799 1.00 0.00 H new ATOM 0 HD3 ARG A 93 8.534 -20.725 7.079 1.00 0.00 H new ATOM 0 HE ARG A 93 6.659 -19.182 5.497 1.00 0.00 H new ATOM 0 HH11 ARG A 93 6.990 -20.616 8.731 1.00 0.00 H new ATOM 0 HH12 ARG A 93 5.246 -20.829 8.912 1.00 0.00 H new ATOM 0 HH21 ARG A 93 4.467 -19.510 5.743 1.00 0.00 H new ATOM 0 HH22 ARG A 93 3.832 -20.209 7.236 1.00 0.00 H new ATOM 573 N SER A 94 12.449 -19.882 9.752 1.00 0.00 N ATOM 574 CA SER A 94 13.782 -20.440 9.822 1.00 0.00 C ATOM 575 C SER A 94 13.786 -21.634 8.869 1.00 0.00 C ATOM 576 O SER A 94 12.716 -22.072 8.430 1.00 0.00 O ATOM 577 CB SER A 94 14.106 -20.833 11.265 1.00 0.00 C ATOM 578 OG SER A 94 14.287 -19.676 12.058 1.00 0.00 O ATOM 0 H SER A 94 11.736 -20.593 9.590 1.00 0.00 H new ATOM 0 HA SER A 94 14.553 -19.728 9.527 1.00 0.00 H new ATOM 0 HB2 SER A 94 13.299 -21.440 11.674 1.00 0.00 H new ATOM 0 HB3 SER A 94 15.008 -21.444 11.289 1.00 0.00 H new ATOM 0 HG SER A 94 13.890 -18.903 11.604 1.00 0.00 H new ATOM 584 N SER A 95 14.984 -22.130 8.552 1.00 0.00 N ATOM 585 CA SER A 95 15.285 -22.857 7.322 1.00 0.00 C ATOM 586 C SER A 95 15.093 -21.939 6.103 1.00 0.00 C ATOM 587 O SER A 95 14.469 -20.880 6.188 1.00 0.00 O ATOM 588 CB SER A 95 14.498 -24.176 7.227 1.00 0.00 C ATOM 589 OG SER A 95 14.670 -24.961 8.397 1.00 0.00 O ATOM 0 H SER A 95 15.794 -22.033 9.164 1.00 0.00 H new ATOM 0 HA SER A 95 16.334 -23.153 7.337 1.00 0.00 H new ATOM 0 HB2 SER A 95 13.439 -23.961 7.082 1.00 0.00 H new ATOM 0 HB3 SER A 95 14.831 -24.739 6.355 1.00 0.00 H new ATOM 0 HG SER A 95 14.158 -25.792 8.311 1.00 0.00 H new ATOM 595 N SER A 96 15.687 -22.328 4.971 1.00 0.00 N ATOM 596 CA SER A 96 15.944 -21.436 3.842 1.00 0.00 C ATOM 597 C SER A 96 16.640 -20.127 4.284 1.00 0.00 C ATOM 598 O SER A 96 17.173 -20.027 5.395 1.00 0.00 O ATOM 599 CB SER A 96 14.643 -21.196 3.057 1.00 0.00 C ATOM 600 OG SER A 96 14.023 -22.404 2.660 1.00 0.00 O ATOM 0 H SER A 96 16.006 -23.284 4.813 1.00 0.00 H new ATOM 0 HA SER A 96 16.649 -21.919 3.166 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.951 -20.621 3.672 1.00 0.00 H new ATOM 0 HB3 SER A 96 14.860 -20.595 2.174 1.00 0.00 H new ATOM 0 HG SER A 96 13.201 -22.203 2.167 1.00 0.00 H new ATOM 606 N GLY A 97 16.694 -19.145 3.382 1.00 0.00 N ATOM 607 CA GLY A 97 17.096 -17.779 3.665 1.00 0.00 C ATOM 608 C GLY A 97 15.927 -16.907 3.254 1.00 0.00 C ATOM 609 O GLY A 97 15.118 -16.524 4.101 1.00 0.00 O ATOM 0 H GLY A 97 16.449 -19.291 2.403 1.00 0.00 H new ATOM 0 HA2 GLY A 97 17.326 -17.651 4.723 1.00 0.00 H new ATOM 0 HA3 GLY A 97 17.995 -17.514 3.109 1.00 0.00 H new ATOM 613 N GLU A 98 15.767 -16.689 1.946 1.00 0.00 N ATOM 614 CA GLU A 98 14.484 -16.235 1.427 1.00 0.00 C ATOM 615 C GLU A 98 13.453 -17.339 1.661 1.00 0.00 C ATOM 616 O GLU A 98 13.723 -18.523 1.436 1.00 0.00 O ATOM 617 CB GLU A 98 14.560 -15.821 -0.052 1.00 0.00 C ATOM 618 CG GLU A 98 14.859 -16.948 -1.049 1.00 0.00 C ATOM 619 CD GLU A 98 14.808 -16.413 -2.477 1.00 0.00 C ATOM 620 OE1 GLU A 98 15.808 -15.821 -2.935 1.00 0.00 O ATOM 621 OE2 GLU A 98 13.772 -16.583 -3.165 1.00 0.00 O ATOM 0 H GLU A 98 16.496 -16.817 1.244 1.00 0.00 H new ATOM 0 HA GLU A 98 14.182 -15.333 1.960 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.612 -15.359 -0.329 1.00 0.00 H new ATOM 0 HB3 GLU A 98 15.330 -15.056 -0.156 1.00 0.00 H new ATOM 0 HG2 GLU A 98 15.843 -17.372 -0.846 1.00 0.00 H new ATOM 0 HG3 GLU A 98 14.134 -17.753 -0.928 1.00 0.00 H new ATOM 628 N THR A 99 12.276 -16.957 2.136 1.00 0.00 N ATOM 629 CA THR A 99 11.153 -17.857 2.326 1.00 0.00 C ATOM 630 C THR A 99 10.530 -18.243 0.971 1.00 0.00 C ATOM 631 O THR A 99 10.759 -17.547 -0.032 1.00 0.00 O ATOM 632 CB THR A 99 10.148 -17.152 3.258 1.00 0.00 C ATOM 633 OG1 THR A 99 10.067 -15.749 3.039 1.00 0.00 O ATOM 634 CG2 THR A 99 10.577 -17.333 4.714 1.00 0.00 C ATOM 0 H THR A 99 12.074 -15.994 2.404 1.00 0.00 H new ATOM 0 HA THR A 99 11.473 -18.792 2.785 1.00 0.00 H new ATOM 0 HB THR A 99 9.180 -17.606 3.044 1.00 0.00 H new ATOM 0 HG1 THR A 99 9.414 -15.359 3.657 1.00 0.00 H new ATOM 0 HG21 THR A 99 9.863 -16.833 5.368 1.00 0.00 H new ATOM 0 HG22 THR A 99 10.607 -18.396 4.955 1.00 0.00 H new ATOM 0 HG23 THR A 99 11.567 -16.900 4.858 1.00 0.00 H new ATOM 642 N PRO A 100 9.693 -19.294 0.925 1.00 0.00 N ATOM 643 CA PRO A 100 8.810 -19.540 -0.207 1.00 0.00 C ATOM 644 C PRO A 100 7.665 -18.518 -0.213 1.00 0.00 C ATOM 645 O PRO A 100 7.539 -17.716 0.720 1.00 0.00 O ATOM 646 CB PRO A 100 8.312 -20.975 -0.007 1.00 0.00 C ATOM 647 CG PRO A 100 8.239 -21.093 1.513 1.00 0.00 C ATOM 648 CD PRO A 100 9.442 -20.270 1.979 1.00 0.00 C ATOM 0 HA PRO A 100 9.306 -19.431 -1.171 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.340 -21.135 -0.473 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.997 -21.706 -0.438 1.00 0.00 H new ATOM 0 HG2 PRO A 100 7.302 -20.696 1.904 1.00 0.00 H new ATOM 0 HG3 PRO A 100 8.308 -22.130 1.841 1.00 0.00 H new ATOM 0 HD2 PRO A 100 9.233 -19.775 2.927 1.00 0.00 H new ATOM 0 HD3 PRO A 100 10.313 -20.906 2.137 1.00 0.00 H new ATOM 656 N ALA A 101 6.789 -18.616 -1.214 1.00 0.00 N ATOM 657 CA ALA A 101 5.621 -17.775 -1.435 1.00 0.00 C ATOM 658 C ALA A 101 5.996 -16.296 -1.545 1.00 0.00 C ATOM 659 O ALA A 101 5.592 -15.465 -0.730 1.00 0.00 O ATOM 660 CB ALA A 101 4.546 -18.073 -0.386 1.00 0.00 C ATOM 0 H ALA A 101 6.886 -19.331 -1.935 1.00 0.00 H new ATOM 0 HA ALA A 101 5.184 -18.021 -2.403 1.00 0.00 H new ATOM 0 HB1 ALA A 101 3.679 -17.437 -0.563 1.00 0.00 H new ATOM 0 HB2 ALA A 101 4.249 -19.119 -0.456 1.00 0.00 H new ATOM 0 HB3 ALA A 101 4.944 -17.875 0.609 1.00 0.00 H new ATOM 666 N GLN A 102 6.765 -15.973 -2.587 1.00 0.00 N ATOM 667 CA GLN A 102 7.055 -14.604 -2.967 1.00 0.00 C ATOM 668 C GLN A 102 5.751 -13.882 -3.344 1.00 0.00 C ATOM 669 O GLN A 102 4.841 -14.507 -3.903 1.00 0.00 O ATOM 670 CB GLN A 102 8.084 -14.554 -4.119 1.00 0.00 C ATOM 671 CG GLN A 102 9.458 -15.180 -3.805 1.00 0.00 C ATOM 672 CD GLN A 102 10.273 -14.370 -2.793 1.00 0.00 C ATOM 673 OE1 GLN A 102 9.741 -13.840 -1.823 1.00 0.00 O ATOM 674 NE2 GLN A 102 11.580 -14.256 -2.950 1.00 0.00 N ATOM 0 H GLN A 102 7.204 -16.667 -3.192 1.00 0.00 H new ATOM 0 HA GLN A 102 7.501 -14.088 -2.117 1.00 0.00 H new ATOM 0 HB2 GLN A 102 7.660 -15.064 -4.984 1.00 0.00 H new ATOM 0 HB3 GLN A 102 8.235 -13.513 -4.404 1.00 0.00 H new ATOM 0 HG2 GLN A 102 9.311 -16.189 -3.419 1.00 0.00 H new ATOM 0 HG3 GLN A 102 10.028 -15.273 -4.730 1.00 0.00 H new ATOM 0 HE21 GLN A 102 12.037 -14.691 -3.751 1.00 0.00 H new ATOM 0 HE22 GLN A 102 12.132 -13.733 -2.270 1.00 0.00 H new ATOM 683 N PRO A 103 5.638 -12.583 -3.038 1.00 0.00 N ATOM 684 CA PRO A 103 4.409 -11.824 -3.216 1.00 0.00 C ATOM 685 C PRO A 103 4.189 -11.440 -4.684 1.00 0.00 C ATOM 686 O PRO A 103 5.129 -11.390 -5.488 1.00 0.00 O ATOM 687 CB PRO A 103 4.575 -10.595 -2.310 1.00 0.00 C ATOM 688 CG PRO A 103 6.089 -10.381 -2.267 1.00 0.00 C ATOM 689 CD PRO A 103 6.645 -11.799 -2.346 1.00 0.00 C ATOM 0 HA PRO A 103 3.525 -12.402 -2.948 1.00 0.00 H new ATOM 0 HB2 PRO A 103 4.059 -9.725 -2.716 1.00 0.00 H new ATOM 0 HB3 PRO A 103 4.167 -10.772 -1.315 1.00 0.00 H new ATOM 0 HG2 PRO A 103 6.432 -9.767 -3.100 1.00 0.00 H new ATOM 0 HG3 PRO A 103 6.398 -9.878 -1.351 1.00 0.00 H new ATOM 0 HD2 PRO A 103 7.593 -11.818 -2.884 1.00 0.00 H new ATOM 0 HD3 PRO A 103 6.836 -12.200 -1.350 1.00 0.00 H new ATOM 697 N GLU A 104 2.954 -11.081 -5.028 1.00 0.00 N ATOM 698 CA GLU A 104 2.488 -10.827 -6.390 1.00 0.00 C ATOM 699 C GLU A 104 2.207 -9.356 -6.664 1.00 0.00 C ATOM 700 O GLU A 104 1.662 -8.989 -7.709 1.00 0.00 O ATOM 701 CB GLU A 104 1.279 -11.714 -6.733 1.00 0.00 C ATOM 702 CG GLU A 104 1.577 -13.219 -6.691 1.00 0.00 C ATOM 703 CD GLU A 104 1.182 -13.924 -5.391 1.00 0.00 C ATOM 704 OE1 GLU A 104 1.175 -13.290 -4.312 1.00 0.00 O ATOM 705 OE2 GLU A 104 0.901 -15.143 -5.457 1.00 0.00 O ATOM 0 H GLU A 104 2.218 -10.953 -4.334 1.00 0.00 H new ATOM 0 HA GLU A 104 3.308 -11.098 -7.055 1.00 0.00 H new ATOM 0 HB2 GLU A 104 0.471 -11.494 -6.035 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.920 -11.453 -7.729 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.056 -13.700 -7.519 1.00 0.00 H new ATOM 0 HG3 GLU A 104 2.644 -13.367 -6.856 1.00 0.00 H new ATOM 712 N LYS A 105 2.686 -8.489 -5.783 1.00 0.00 N ATOM 713 CA LYS A 105 2.709 -7.057 -6.036 1.00 0.00 C ATOM 714 C LYS A 105 3.960 -6.738 -6.854 1.00 0.00 C ATOM 715 O LYS A 105 4.938 -7.492 -6.810 1.00 0.00 O ATOM 716 CB LYS A 105 2.620 -6.291 -4.703 1.00 0.00 C ATOM 717 CG LYS A 105 1.253 -6.499 -4.019 1.00 0.00 C ATOM 718 CD LYS A 105 1.230 -5.911 -2.601 1.00 0.00 C ATOM 719 CE LYS A 105 -0.188 -5.910 -2.008 1.00 0.00 C ATOM 720 NZ LYS A 105 -0.661 -7.248 -1.603 1.00 0.00 N ATOM 0 H LYS A 105 3.068 -8.758 -4.876 1.00 0.00 H new ATOM 0 HA LYS A 105 1.847 -6.735 -6.620 1.00 0.00 H new ATOM 0 HB2 LYS A 105 3.415 -6.625 -4.037 1.00 0.00 H new ATOM 0 HB3 LYS A 105 2.780 -5.228 -4.882 1.00 0.00 H new ATOM 0 HG2 LYS A 105 0.472 -6.032 -4.619 1.00 0.00 H new ATOM 0 HG3 LYS A 105 1.027 -7.564 -3.974 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.893 -6.488 -1.957 1.00 0.00 H new ATOM 0 HD3 LYS A 105 1.616 -4.892 -2.624 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -0.210 -5.249 -1.142 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -0.879 -5.496 -2.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -1.622 -7.173 -1.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -0.672 -7.878 -2.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -0.023 -7.638 -0.880 1.00 0.00 H new ATOM 734 N THR A 106 3.924 -5.657 -7.632 1.00 0.00 N ATOM 735 CA THR A 106 4.968 -5.283 -8.587 1.00 0.00 C ATOM 736 C THR A 106 5.176 -3.784 -8.694 1.00 0.00 C ATOM 737 O THR A 106 6.057 -3.353 -9.441 1.00 0.00 O ATOM 738 CB THR A 106 4.656 -5.890 -9.970 1.00 0.00 C ATOM 739 OG1 THR A 106 3.384 -5.468 -10.429 1.00 0.00 O ATOM 740 CG2 THR A 106 4.653 -7.411 -9.988 1.00 0.00 C ATOM 0 H THR A 106 3.146 -4.998 -7.615 1.00 0.00 H new ATOM 0 HA THR A 106 5.905 -5.691 -8.208 1.00 0.00 H new ATOM 0 HB THR A 106 5.459 -5.535 -10.616 1.00 0.00 H new ATOM 0 HG1 THR A 106 3.206 -5.863 -11.308 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.426 -7.763 -10.994 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.633 -7.780 -9.687 1.00 0.00 H new ATOM 0 HG23 THR A 106 3.898 -7.782 -9.295 1.00 0.00 H new ATOM 748 N SER A 107 4.399 -2.982 -7.970 1.00 0.00 N ATOM 749 CA SER A 107 4.391 -1.550 -8.174 1.00 0.00 C ATOM 750 C SER A 107 4.712 -0.843 -6.869 1.00 0.00 C ATOM 751 O SER A 107 4.247 -1.273 -5.814 1.00 0.00 O ATOM 752 CB SER A 107 3.031 -1.122 -8.740 1.00 0.00 C ATOM 753 OG SER A 107 2.636 -1.998 -9.787 1.00 0.00 O ATOM 0 H SER A 107 3.768 -3.308 -7.237 1.00 0.00 H new ATOM 0 HA SER A 107 5.157 -1.269 -8.897 1.00 0.00 H new ATOM 0 HB2 SER A 107 2.281 -1.129 -7.949 1.00 0.00 H new ATOM 0 HB3 SER A 107 3.090 -0.100 -9.114 1.00 0.00 H new ATOM 0 HG SER A 107 1.766 -1.716 -10.139 1.00 0.00 H new ATOM 759 N GLY A 108 5.488 0.236 -6.941 1.00 0.00 N ATOM 760 CA GLY A 108 5.965 1.009 -5.807 1.00 0.00 C ATOM 761 C GLY A 108 4.871 1.326 -4.802 1.00 0.00 C ATOM 762 O GLY A 108 4.993 0.998 -3.626 1.00 0.00 O ATOM 0 H GLY A 108 5.813 0.608 -7.833 1.00 0.00 H new ATOM 0 HA2 GLY A 108 6.761 0.457 -5.307 1.00 0.00 H new ATOM 0 HA3 GLY A 108 6.401 1.941 -6.167 1.00 0.00 H new ATOM 766 N MET A 109 3.786 1.921 -5.285 1.00 0.00 N ATOM 767 CA MET A 109 2.605 2.285 -4.511 1.00 0.00 C ATOM 768 C MET A 109 1.983 1.123 -3.723 1.00 0.00 C ATOM 769 O MET A 109 1.381 1.362 -2.680 1.00 0.00 O ATOM 770 CB MET A 109 1.592 2.956 -5.454 1.00 0.00 C ATOM 771 CG MET A 109 1.235 2.042 -6.636 1.00 0.00 C ATOM 772 SD MET A 109 -0.127 2.596 -7.689 1.00 0.00 S ATOM 773 CE MET A 109 0.739 3.867 -8.647 1.00 0.00 C ATOM 0 H MET A 109 3.702 2.174 -6.270 1.00 0.00 H new ATOM 0 HA MET A 109 2.917 2.985 -3.736 1.00 0.00 H new ATOM 0 HB2 MET A 109 0.687 3.206 -4.900 1.00 0.00 H new ATOM 0 HB3 MET A 109 2.006 3.892 -5.828 1.00 0.00 H new ATOM 0 HG2 MET A 109 2.122 1.923 -7.258 1.00 0.00 H new ATOM 0 HG3 MET A 109 0.986 1.056 -6.244 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.048 4.322 -9.356 1.00 0.00 H new ATOM 0 HE2 MET A 109 1.123 4.632 -7.973 1.00 0.00 H new ATOM 0 HE3 MET A 109 1.568 3.412 -9.189 1.00 0.00 H new ATOM 783 N GLU A 110 2.126 -0.128 -4.174 1.00 0.00 N ATOM 784 CA GLU A 110 1.558 -1.281 -3.494 1.00 0.00 C ATOM 785 C GLU A 110 2.604 -1.972 -2.623 1.00 0.00 C ATOM 786 O GLU A 110 2.262 -2.449 -1.543 1.00 0.00 O ATOM 787 CB GLU A 110 0.981 -2.256 -4.528 1.00 0.00 C ATOM 788 CG GLU A 110 -0.336 -1.744 -5.124 1.00 0.00 C ATOM 789 CD GLU A 110 -0.950 -2.758 -6.086 1.00 0.00 C ATOM 790 OE1 GLU A 110 -0.432 -2.872 -7.222 1.00 0.00 O ATOM 791 OE2 GLU A 110 -1.947 -3.422 -5.730 1.00 0.00 O ATOM 0 H GLU A 110 2.641 -0.362 -5.023 1.00 0.00 H new ATOM 0 HA GLU A 110 0.755 -0.942 -2.839 1.00 0.00 H new ATOM 0 HB2 GLU A 110 1.706 -2.409 -5.327 1.00 0.00 H new ATOM 0 HB3 GLU A 110 0.815 -3.226 -4.059 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.041 -1.531 -4.320 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -0.158 -0.805 -5.649 1.00 0.00 H new ATOM 798 N VAL A 111 3.872 -1.992 -3.041 1.00 0.00 N ATOM 799 CA VAL A 111 5.001 -2.378 -2.200 1.00 0.00 C ATOM 800 C VAL A 111 5.007 -1.479 -0.953 1.00 0.00 C ATOM 801 O VAL A 111 5.211 -2.003 0.134 1.00 0.00 O ATOM 802 CB VAL A 111 6.299 -2.315 -3.038 1.00 0.00 C ATOM 803 CG1 VAL A 111 7.569 -2.482 -2.192 1.00 0.00 C ATOM 804 CG2 VAL A 111 6.309 -3.420 -4.115 1.00 0.00 C ATOM 0 H VAL A 111 4.145 -1.736 -3.990 1.00 0.00 H new ATOM 0 HA VAL A 111 4.920 -3.406 -1.846 1.00 0.00 H new ATOM 0 HB VAL A 111 6.305 -1.323 -3.491 1.00 0.00 H new ATOM 0 HG11 VAL A 111 8.446 -2.429 -2.837 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.617 -1.687 -1.448 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.547 -3.449 -1.689 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.231 -3.357 -4.693 1.00 0.00 H new ATOM 0 HG22 VAL A 111 6.248 -4.397 -3.635 1.00 0.00 H new ATOM 0 HG23 VAL A 111 5.455 -3.288 -4.779 1.00 0.00 H new ATOM 814 N ALA A 112 4.720 -0.175 -1.068 1.00 0.00 N ATOM 815 CA ALA A 112 4.661 0.757 0.056 1.00 0.00 C ATOM 816 C ALA A 112 3.625 0.325 1.088 1.00 0.00 C ATOM 817 O ALA A 112 3.963 0.051 2.241 1.00 0.00 O ATOM 818 CB ALA A 112 4.361 2.180 -0.433 1.00 0.00 C ATOM 0 H ALA A 112 4.519 0.266 -1.965 1.00 0.00 H new ATOM 0 HA ALA A 112 5.639 0.750 0.538 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.322 2.857 0.420 1.00 0.00 H new ATOM 0 HB2 ALA A 112 5.146 2.503 -1.117 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.402 2.192 -0.951 1.00 0.00 H new ATOM 824 N SER A 113 2.357 0.241 0.692 1.00 0.00 N ATOM 825 CA SER A 113 1.288 -0.148 1.600 1.00 0.00 C ATOM 826 C SER A 113 1.471 -1.578 2.127 1.00 0.00 C ATOM 827 O SER A 113 0.955 -1.914 3.194 1.00 0.00 O ATOM 828 CB SER A 113 -0.056 0.039 0.890 1.00 0.00 C ATOM 829 OG SER A 113 -0.012 -0.314 -0.481 1.00 0.00 O ATOM 0 H SER A 113 2.046 0.439 -0.259 1.00 0.00 H new ATOM 0 HA SER A 113 1.316 0.494 2.481 1.00 0.00 H new ATOM 0 HB2 SER A 113 -0.812 -0.565 1.391 1.00 0.00 H new ATOM 0 HB3 SER A 113 -0.367 1.080 0.982 1.00 0.00 H new ATOM 0 HG SER A 113 -0.895 -0.177 -0.883 1.00 0.00 H new ATOM 835 N TYR A 114 2.186 -2.431 1.391 1.00 0.00 N ATOM 836 CA TYR A 114 2.509 -3.796 1.793 1.00 0.00 C ATOM 837 C TYR A 114 3.586 -3.769 2.874 1.00 0.00 C ATOM 838 O TYR A 114 3.480 -4.473 3.870 1.00 0.00 O ATOM 839 CB TYR A 114 2.954 -4.568 0.546 1.00 0.00 C ATOM 840 CG TYR A 114 3.744 -5.831 0.776 1.00 0.00 C ATOM 841 CD1 TYR A 114 5.145 -5.758 0.876 1.00 0.00 C ATOM 842 CD2 TYR A 114 3.098 -7.075 0.824 1.00 0.00 C ATOM 843 CE1 TYR A 114 5.908 -6.930 1.010 1.00 0.00 C ATOM 844 CE2 TYR A 114 3.850 -8.249 0.971 1.00 0.00 C ATOM 845 CZ TYR A 114 5.256 -8.187 1.076 1.00 0.00 C ATOM 846 OH TYR A 114 5.931 -9.353 1.263 1.00 0.00 O ATOM 0 H TYR A 114 2.564 -2.183 0.477 1.00 0.00 H new ATOM 0 HA TYR A 114 1.641 -4.299 2.220 1.00 0.00 H new ATOM 0 HB2 TYR A 114 2.065 -4.823 -0.031 1.00 0.00 H new ATOM 0 HB3 TYR A 114 3.554 -3.900 -0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 114 5.636 -4.797 0.850 1.00 0.00 H new ATOM 0 HD2 TYR A 114 2.022 -7.128 0.748 1.00 0.00 H new ATOM 0 HE1 TYR A 114 6.985 -6.874 1.062 1.00 0.00 H new ATOM 0 HE2 TYR A 114 3.351 -9.206 1.004 1.00 0.00 H new ATOM 0 HH TYR A 114 5.296 -10.099 1.279 1.00 0.00 H new ATOM 856 N LEU A 115 4.604 -2.929 2.714 1.00 0.00 N ATOM 857 CA LEU A 115 5.662 -2.714 3.689 1.00 0.00 C ATOM 858 C LEU A 115 5.074 -2.221 5.009 1.00 0.00 C ATOM 859 O LEU A 115 5.353 -2.804 6.062 1.00 0.00 O ATOM 860 CB LEU A 115 6.676 -1.727 3.085 1.00 0.00 C ATOM 861 CG LEU A 115 8.027 -2.352 2.747 1.00 0.00 C ATOM 862 CD1 LEU A 115 7.937 -3.623 1.891 1.00 0.00 C ATOM 863 CD2 LEU A 115 8.904 -1.343 2.000 1.00 0.00 C ATOM 0 H LEU A 115 4.717 -2.362 1.874 1.00 0.00 H new ATOM 0 HA LEU A 115 6.180 -3.646 3.915 1.00 0.00 H new ATOM 0 HB2 LEU A 115 6.251 -1.294 2.179 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.832 -0.908 3.787 1.00 0.00 H new ATOM 0 HG LEU A 115 8.459 -2.632 3.708 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.940 -4.003 1.697 1.00 0.00 H new ATOM 0 HD12 LEU A 115 7.360 -4.379 2.422 1.00 0.00 H new ATOM 0 HD13 LEU A 115 7.447 -3.391 0.945 1.00 0.00 H new ATOM 0 HD21 LEU A 115 9.865 -1.800 1.764 1.00 0.00 H new ATOM 0 HD22 LEU A 115 8.408 -1.044 1.076 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.064 -0.466 2.627 1.00 0.00 H new ATOM 875 N VAL A 116 4.209 -1.206 4.936 1.00 0.00 N ATOM 876 CA VAL A 116 3.436 -0.708 6.075 1.00 0.00 C ATOM 877 C VAL A 116 2.667 -1.863 6.723 1.00 0.00 C ATOM 878 O VAL A 116 2.671 -1.968 7.950 1.00 0.00 O ATOM 879 CB VAL A 116 2.512 0.462 5.657 1.00 0.00 C ATOM 880 CG1 VAL A 116 1.516 0.882 6.749 1.00 0.00 C ATOM 881 CG2 VAL A 116 3.349 1.686 5.273 1.00 0.00 C ATOM 0 H VAL A 116 4.024 -0.700 4.070 1.00 0.00 H new ATOM 0 HA VAL A 116 4.119 -0.303 6.822 1.00 0.00 H new ATOM 0 HB VAL A 116 1.936 0.094 4.808 1.00 0.00 H new ATOM 0 HG11 VAL A 116 0.903 1.706 6.385 1.00 0.00 H new ATOM 0 HG12 VAL A 116 0.875 0.037 7.002 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.062 1.201 7.637 1.00 0.00 H new ATOM 0 HG21 VAL A 116 2.688 2.502 4.981 1.00 0.00 H new ATOM 0 HG22 VAL A 116 3.953 1.996 6.126 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.003 1.432 4.438 1.00 0.00 H new ATOM 891 N ALA A 117 2.014 -2.731 5.946 1.00 0.00 N ATOM 892 CA ALA A 117 1.320 -3.883 6.501 1.00 0.00 C ATOM 893 C ALA A 117 2.309 -4.796 7.243 1.00 0.00 C ATOM 894 O ALA A 117 2.171 -5.008 8.450 1.00 0.00 O ATOM 895 CB ALA A 117 0.537 -4.620 5.408 1.00 0.00 C ATOM 0 H ALA A 117 1.955 -2.653 4.931 1.00 0.00 H new ATOM 0 HA ALA A 117 0.589 -3.544 7.234 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.025 -5.478 5.843 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -0.197 -3.945 4.968 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.225 -4.962 4.635 1.00 0.00 H new ATOM 901 N GLN A 118 3.320 -5.311 6.544 1.00 0.00 N ATOM 902 CA GLN A 118 4.216 -6.349 7.029 1.00 0.00 C ATOM 903 C GLN A 118 5.016 -5.925 8.256 1.00 0.00 C ATOM 904 O GLN A 118 5.212 -6.741 9.162 1.00 0.00 O ATOM 905 CB GLN A 118 5.189 -6.726 5.907 1.00 0.00 C ATOM 906 CG GLN A 118 4.548 -7.501 4.758 1.00 0.00 C ATOM 907 CD GLN A 118 3.913 -8.794 5.254 1.00 0.00 C ATOM 908 OE1 GLN A 118 4.567 -9.632 5.869 1.00 0.00 O ATOM 909 NE2 GLN A 118 2.626 -8.985 5.026 1.00 0.00 N ATOM 0 H GLN A 118 3.541 -5.005 5.596 1.00 0.00 H new ATOM 0 HA GLN A 118 3.598 -7.197 7.326 1.00 0.00 H new ATOM 0 HB2 GLN A 118 5.639 -5.816 5.510 1.00 0.00 H new ATOM 0 HB3 GLN A 118 5.997 -7.324 6.328 1.00 0.00 H new ATOM 0 HG2 GLN A 118 3.791 -6.882 4.276 1.00 0.00 H new ATOM 0 HG3 GLN A 118 5.301 -7.728 4.004 1.00 0.00 H new ATOM 0 HE21 GLN A 118 2.089 -8.285 4.515 1.00 0.00 H new ATOM 0 HE22 GLN A 118 2.169 -9.833 5.361 1.00 0.00 H new ATOM 918 N TYR A 119 5.506 -4.685 8.281 1.00 0.00 N ATOM 919 CA TYR A 119 6.440 -4.227 9.315 1.00 0.00 C ATOM 920 C TYR A 119 5.929 -3.051 10.147 1.00 0.00 C ATOM 921 O TYR A 119 6.383 -2.887 11.286 1.00 0.00 O ATOM 922 CB TYR A 119 7.792 -3.878 8.681 1.00 0.00 C ATOM 923 CG TYR A 119 8.481 -5.045 8.009 1.00 0.00 C ATOM 924 CD1 TYR A 119 8.175 -5.368 6.676 1.00 0.00 C ATOM 925 CD2 TYR A 119 9.400 -5.828 8.730 1.00 0.00 C ATOM 926 CE1 TYR A 119 8.697 -6.535 6.093 1.00 0.00 C ATOM 927 CE2 TYR A 119 9.942 -6.987 8.142 1.00 0.00 C ATOM 928 CZ TYR A 119 9.557 -7.370 6.836 1.00 0.00 C ATOM 929 OH TYR A 119 9.992 -8.549 6.321 1.00 0.00 O ATOM 0 H TYR A 119 5.270 -3.972 7.591 1.00 0.00 H new ATOM 0 HA TYR A 119 6.549 -5.058 10.012 1.00 0.00 H new ATOM 0 HB2 TYR A 119 7.643 -3.087 7.946 1.00 0.00 H new ATOM 0 HB3 TYR A 119 8.450 -3.477 9.452 1.00 0.00 H new ATOM 0 HD1 TYR A 119 7.536 -4.717 6.098 1.00 0.00 H new ATOM 0 HD2 TYR A 119 9.689 -5.542 9.730 1.00 0.00 H new ATOM 0 HE1 TYR A 119 8.440 -6.792 5.076 1.00 0.00 H new ATOM 0 HE2 TYR A 119 10.654 -7.586 8.690 1.00 0.00 H new ATOM 0 HH TYR A 119 10.047 -8.479 5.345 1.00 0.00 H new ATOM 939 N GLY A 120 5.003 -2.251 9.621 1.00 0.00 N ATOM 940 CA GLY A 120 4.598 -0.968 10.183 1.00 0.00 C ATOM 941 C GLY A 120 5.341 0.165 9.477 1.00 0.00 C ATOM 942 O GLY A 120 6.406 -0.044 8.902 1.00 0.00 O ATOM 0 H GLY A 120 4.500 -2.487 8.766 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.522 -0.835 10.071 1.00 0.00 H new ATOM 0 HA3 GLY A 120 4.812 -0.945 11.252 1.00 0.00 H new ATOM 946 N GLU A 121 4.784 1.376 9.540 1.00 0.00 N ATOM 947 CA GLU A 121 5.264 2.582 8.848 1.00 0.00 C ATOM 948 C GLU A 121 6.711 2.967 9.150 1.00 0.00 C ATOM 949 O GLU A 121 7.361 3.557 8.292 1.00 0.00 O ATOM 950 CB GLU A 121 4.330 3.765 9.148 1.00 0.00 C ATOM 951 CG GLU A 121 4.097 4.015 10.650 1.00 0.00 C ATOM 952 CD GLU A 121 4.598 5.348 11.223 1.00 0.00 C ATOM 953 OE1 GLU A 121 5.644 5.896 10.806 1.00 0.00 O ATOM 954 OE2 GLU A 121 3.961 5.774 12.219 1.00 0.00 O ATOM 0 H GLU A 121 3.949 1.555 10.098 1.00 0.00 H new ATOM 0 HA GLU A 121 5.248 2.334 7.787 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.748 4.667 8.701 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.369 3.587 8.667 1.00 0.00 H new ATOM 0 HG2 GLU A 121 3.026 3.945 10.842 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.574 3.207 11.205 1.00 0.00 H new ATOM 961 N GLN A 122 7.210 2.610 10.335 1.00 0.00 N ATOM 962 CA GLN A 122 8.590 2.812 10.739 1.00 0.00 C ATOM 963 C GLN A 122 9.516 2.019 9.855 1.00 0.00 C ATOM 964 O GLN A 122 10.163 2.591 8.991 1.00 0.00 O ATOM 965 CB GLN A 122 8.761 2.467 12.216 1.00 0.00 C ATOM 966 CG GLN A 122 8.519 3.705 13.082 1.00 0.00 C ATOM 967 CD GLN A 122 9.651 4.728 12.949 1.00 0.00 C ATOM 968 OE1 GLN A 122 10.653 4.505 12.279 1.00 0.00 O ATOM 969 NE2 GLN A 122 9.555 5.874 13.596 1.00 0.00 N ATOM 0 H GLN A 122 6.644 2.161 11.055 1.00 0.00 H new ATOM 0 HA GLN A 122 8.853 3.863 10.618 1.00 0.00 H new ATOM 0 HB2 GLN A 122 8.063 1.678 12.495 1.00 0.00 H new ATOM 0 HB3 GLN A 122 9.765 2.082 12.393 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.575 4.169 12.795 1.00 0.00 H new ATOM 0 HG3 GLN A 122 8.423 3.404 14.125 1.00 0.00 H new ATOM 0 HE21 GLN A 122 8.728 6.075 14.158 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.308 6.559 13.534 1.00 0.00 H new ATOM 978 N ARG A 123 9.576 0.705 10.048 1.00 0.00 N ATOM 979 CA ARG A 123 10.468 -0.151 9.265 1.00 0.00 C ATOM 980 C ARG A 123 10.123 -0.085 7.790 1.00 0.00 C ATOM 981 O ARG A 123 11.008 -0.310 6.963 1.00 0.00 O ATOM 982 CB ARG A 123 10.391 -1.605 9.737 1.00 0.00 C ATOM 983 CG ARG A 123 11.343 -1.924 10.888 1.00 0.00 C ATOM 984 CD ARG A 123 10.775 -1.348 12.178 1.00 0.00 C ATOM 985 NE ARG A 123 11.603 -1.718 13.329 1.00 0.00 N ATOM 986 CZ ARG A 123 11.662 -1.037 14.474 1.00 0.00 C ATOM 987 NH1 ARG A 123 11.012 0.112 14.588 1.00 0.00 N ATOM 988 NH2 ARG A 123 12.374 -1.493 15.491 1.00 0.00 N ATOM 0 H ARG A 123 9.017 0.207 10.741 1.00 0.00 H new ATOM 0 HA ARG A 123 11.483 0.217 9.413 1.00 0.00 H new ATOM 0 HB2 ARG A 123 9.370 -1.823 10.050 1.00 0.00 H new ATOM 0 HB3 ARG A 123 10.615 -2.263 8.898 1.00 0.00 H new ATOM 0 HG2 ARG A 123 11.471 -3.002 10.982 1.00 0.00 H new ATOM 0 HG3 ARG A 123 12.328 -1.502 10.689 1.00 0.00 H new ATOM 0 HD2 ARG A 123 10.718 -0.262 12.101 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.758 -1.711 12.326 1.00 0.00 H new ATOM 0 HE ARG A 123 12.176 -2.558 13.248 1.00 0.00 H new ATOM 0 HH11 ARG A 123 10.470 0.471 13.802 1.00 0.00 H new ATOM 0 HH12 ARG A 123 11.054 0.637 15.462 1.00 0.00 H new ATOM 0 HH21 ARG A 123 12.884 -2.372 15.403 1.00 0.00 H new ATOM 0 HH22 ARG A 123 12.413 -0.965 16.363 1.00 0.00 H new ATOM 1002 N ALA A 124 8.879 0.255 7.456 1.00 0.00 N ATOM 1003 CA ALA A 124 8.513 0.435 6.062 1.00 0.00 C ATOM 1004 C ALA A 124 9.367 1.496 5.371 1.00 0.00 C ATOM 1005 O ALA A 124 9.482 1.440 4.150 1.00 0.00 O ATOM 1006 CB ALA A 124 7.029 0.771 5.927 1.00 0.00 C ATOM 0 H ALA A 124 8.122 0.408 8.123 1.00 0.00 H new ATOM 0 HA ALA A 124 8.705 -0.513 5.560 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.780 0.901 4.874 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.433 -0.041 6.343 1.00 0.00 H new ATOM 0 HB3 ALA A 124 6.814 1.693 6.467 1.00 0.00 H new ATOM 1012 N TRP A 125 10.033 2.378 6.120 1.00 0.00 N ATOM 1013 CA TRP A 125 11.135 3.170 5.615 1.00 0.00 C ATOM 1014 C TRP A 125 12.427 2.807 6.340 1.00 0.00 C ATOM 1015 O TRP A 125 13.356 2.356 5.701 1.00 0.00 O ATOM 1016 CB TRP A 125 10.753 4.650 5.624 1.00 0.00 C ATOM 1017 CG TRP A 125 11.169 5.440 4.420 1.00 0.00 C ATOM 1018 CD1 TRP A 125 11.580 6.719 4.490 1.00 0.00 C ATOM 1019 CD2 TRP A 125 11.206 5.079 2.995 1.00 0.00 C ATOM 1020 NE1 TRP A 125 11.811 7.201 3.218 1.00 0.00 N ATOM 1021 CE2 TRP A 125 11.594 6.235 2.253 1.00 0.00 C ATOM 1022 CE3 TRP A 125 10.941 3.913 2.237 1.00 0.00 C ATOM 1023 CZ2 TRP A 125 11.670 6.234 0.847 1.00 0.00 C ATOM 1024 CZ3 TRP A 125 11.029 3.894 0.836 1.00 0.00 C ATOM 1025 CH2 TRP A 125 11.347 5.063 0.135 1.00 0.00 C ATOM 0 H TRP A 125 9.814 2.557 7.100 1.00 0.00 H new ATOM 0 HA TRP A 125 11.341 2.939 4.570 1.00 0.00 H new ATOM 0 HB2 TRP A 125 9.671 4.725 5.728 1.00 0.00 H new ATOM 0 HB3 TRP A 125 11.191 5.113 6.508 1.00 0.00 H new ATOM 0 HD1 TRP A 125 11.709 7.282 5.402 1.00 0.00 H new ATOM 0 HE1 TRP A 125 12.106 8.156 3.014 1.00 0.00 H new ATOM 0 HE3 TRP A 125 10.662 3.007 2.754 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 11.974 7.125 0.318 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 10.851 2.975 0.298 1.00 0.00 H new ATOM 0 HH2 TRP A 125 11.345 5.067 -0.945 1.00 0.00 H new ATOM 1036 N ASP A 126 12.503 2.901 7.659 1.00 0.00 N ATOM 1037 CA ASP A 126 13.693 2.660 8.492 1.00 0.00 C ATOM 1038 C ASP A 126 14.459 1.350 8.229 1.00 0.00 C ATOM 1039 O ASP A 126 15.666 1.304 8.465 1.00 0.00 O ATOM 1040 CB ASP A 126 13.235 2.648 9.955 1.00 0.00 C ATOM 1041 CG ASP A 126 14.373 2.706 10.975 1.00 0.00 C ATOM 1042 OD1 ASP A 126 14.778 3.809 11.402 1.00 0.00 O ATOM 1043 OD2 ASP A 126 14.781 1.635 11.483 1.00 0.00 O ATOM 0 H ASP A 126 11.692 3.163 8.219 1.00 0.00 H new ATOM 0 HA ASP A 126 14.393 3.457 8.242 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.571 3.496 10.122 1.00 0.00 H new ATOM 0 HB3 ASP A 126 12.650 1.745 10.132 1.00 0.00 H new ATOM 1048 N LEU A 127 13.794 0.272 7.786 1.00 0.00 N ATOM 1049 CA LEU A 127 14.446 -0.946 7.305 1.00 0.00 C ATOM 1050 C LEU A 127 14.719 -0.761 5.811 1.00 0.00 C ATOM 1051 O LEU A 127 15.854 -0.898 5.360 1.00 0.00 O ATOM 1052 CB LEU A 127 13.570 -2.177 7.658 1.00 0.00 C ATOM 1053 CG LEU A 127 13.484 -3.325 6.633 1.00 0.00 C ATOM 1054 CD1 LEU A 127 14.853 -3.951 6.439 1.00 0.00 C ATOM 1055 CD2 LEU A 127 12.506 -4.415 7.092 1.00 0.00 C ATOM 0 H LEU A 127 12.776 0.226 7.753 1.00 0.00 H new ATOM 0 HA LEU A 127 15.405 -1.131 7.789 1.00 0.00 H new ATOM 0 HB2 LEU A 127 13.942 -2.593 8.594 1.00 0.00 H new ATOM 0 HB3 LEU A 127 12.557 -1.822 7.847 1.00 0.00 H new ATOM 0 HG LEU A 127 13.125 -2.901 5.695 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.783 -4.761 5.713 1.00 0.00 H new ATOM 0 HD12 LEU A 127 15.550 -3.196 6.074 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.211 -4.346 7.390 1.00 0.00 H new ATOM 0 HD21 LEU A 127 12.470 -5.209 6.346 1.00 0.00 H new ATOM 0 HD22 LEU A 127 12.841 -4.827 8.044 1.00 0.00 H new ATOM 0 HD23 LEU A 127 11.512 -3.985 7.212 1.00 0.00 H new ATOM 1067 N ALA A 128 13.683 -0.424 5.045 1.00 0.00 N ATOM 1068 CA ALA A 128 13.722 -0.266 3.599 1.00 0.00 C ATOM 1069 C ALA A 128 14.805 0.700 3.098 1.00 0.00 C ATOM 1070 O ALA A 128 15.280 0.540 1.978 1.00 0.00 O ATOM 1071 CB ALA A 128 12.332 0.170 3.160 1.00 0.00 C ATOM 0 H ALA A 128 12.757 -0.247 5.435 1.00 0.00 H new ATOM 0 HA ALA A 128 14.000 -1.220 3.151 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.316 0.301 2.078 1.00 0.00 H new ATOM 0 HB2 ALA A 128 11.605 -0.591 3.444 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.077 1.113 3.643 1.00 0.00 H new ATOM 1077 N LEU A 129 15.223 1.666 3.915 1.00 0.00 N ATOM 1078 CA LEU A 129 16.286 2.618 3.676 1.00 0.00 C ATOM 1079 C LEU A 129 17.583 1.890 3.404 1.00 0.00 C ATOM 1080 O LEU A 129 18.319 2.329 2.533 1.00 0.00 O ATOM 1081 CB LEU A 129 16.473 3.541 4.903 1.00 0.00 C ATOM 1082 CG LEU A 129 15.973 4.984 4.739 1.00 0.00 C ATOM 1083 CD1 LEU A 129 16.714 5.761 3.647 1.00 0.00 C ATOM 1084 CD2 LEU A 129 14.472 5.084 4.491 1.00 0.00 C ATOM 0 H LEU A 129 14.789 1.807 4.827 1.00 0.00 H new ATOM 0 HA LEU A 129 16.015 3.222 2.810 1.00 0.00 H new ATOM 0 HB2 LEU A 129 15.958 3.093 5.752 1.00 0.00 H new ATOM 0 HB3 LEU A 129 17.534 3.571 5.153 1.00 0.00 H new ATOM 0 HG LEU A 129 16.192 5.443 5.703 1.00 0.00 H new ATOM 0 HD11 LEU A 129 16.312 6.772 3.583 1.00 0.00 H new ATOM 0 HD12 LEU A 129 17.776 5.807 3.890 1.00 0.00 H new ATOM 0 HD13 LEU A 129 16.583 5.257 2.689 1.00 0.00 H new ATOM 0 HD21 LEU A 129 14.190 6.131 4.385 1.00 0.00 H new ATOM 0 HD22 LEU A 129 14.217 4.545 3.578 1.00 0.00 H new ATOM 0 HD23 LEU A 129 13.934 4.647 5.332 1.00 0.00 H new ATOM 1096 N HIS A 130 17.886 0.802 4.122 1.00 0.00 N ATOM 1097 CA HIS A 130 19.221 0.207 4.125 1.00 0.00 C ATOM 1098 C HIS A 130 19.683 -0.220 2.723 1.00 0.00 C ATOM 1099 O HIS A 130 20.885 -0.336 2.478 1.00 0.00 O ATOM 1100 CB HIS A 130 19.300 -0.934 5.166 1.00 0.00 C ATOM 1101 CG HIS A 130 19.325 -2.344 4.622 1.00 0.00 C ATOM 1102 ND1 HIS A 130 18.495 -2.861 3.666 1.00 0.00 N flip ATOM 1103 CD2 HIS A 130 20.264 -3.306 4.923 1.00 0.00 C flip ATOM 1104 CE1 HIS A 130 18.946 -4.153 3.368 1.00 0.00 C flip ATOM 1105 NE2 HIS A 130 20.018 -4.372 4.150 1.00 0.00 N flip ATOM 0 H HIS A 130 17.214 0.314 4.714 1.00 0.00 H new ATOM 0 HA HIS A 130 19.931 0.976 4.430 1.00 0.00 H new ATOM 0 HB2 HIS A 130 20.196 -0.785 5.768 1.00 0.00 H new ATOM 0 HB3 HIS A 130 18.446 -0.843 5.837 1.00 0.00 H new ATOM 0 HD2 HIS A 130 21.056 -3.217 5.651 1.00 0.00 H new ATOM 0 HE1 HIS A 130 18.517 -4.838 2.652 1.00 0.00 H new ATOM 0 HE2 HIS A 130 20.568 -5.231 4.154 1.00 0.00 H new ATOM 1113 N THR A 131 18.737 -0.413 1.802 1.00 0.00 N ATOM 1114 CA THR A 131 18.977 -0.776 0.415 1.00 0.00 C ATOM 1115 C THR A 131 19.772 0.321 -0.299 1.00 0.00 C ATOM 1116 O THR A 131 20.475 0.030 -1.264 1.00 0.00 O ATOM 1117 CB THR A 131 17.613 -0.998 -0.254 1.00 0.00 C ATOM 1118 OG1 THR A 131 16.935 0.240 -0.269 1.00 0.00 O ATOM 1119 CG2 THR A 131 16.731 -2.033 0.425 1.00 0.00 C ATOM 0 H THR A 131 17.745 -0.315 2.017 1.00 0.00 H new ATOM 0 HA THR A 131 19.571 -1.688 0.357 1.00 0.00 H new ATOM 0 HB THR A 131 17.810 -1.388 -1.252 1.00 0.00 H new ATOM 0 HG1 THR A 131 16.112 0.156 -0.794 1.00 0.00 H new ATOM 0 HG21 THR A 131 15.790 -2.121 -0.118 1.00 0.00 H new ATOM 0 HG22 THR A 131 17.239 -2.997 0.429 1.00 0.00 H new ATOM 0 HG23 THR A 131 16.531 -1.724 1.451 1.00 0.00 H new ATOM 1127 N TRP A 132 19.676 1.569 0.182 1.00 0.00 N ATOM 1128 CA TRP A 132 20.351 2.720 -0.418 1.00 0.00 C ATOM 1129 C TRP A 132 21.851 2.462 -0.436 1.00 0.00 C ATOM 1130 O TRP A 132 22.532 2.829 -1.386 1.00 0.00 O ATOM 1131 CB TRP A 132 20.044 4.048 0.312 1.00 0.00 C ATOM 1132 CG TRP A 132 20.956 4.433 1.454 1.00 0.00 C ATOM 1133 CD1 TRP A 132 20.689 4.302 2.773 1.00 0.00 C ATOM 1134 CD2 TRP A 132 22.314 4.987 1.391 1.00 0.00 C ATOM 1135 NE1 TRP A 132 21.792 4.656 3.513 1.00 0.00 N ATOM 1136 CE2 TRP A 132 22.818 5.101 2.719 1.00 0.00 C ATOM 1137 CE3 TRP A 132 23.179 5.392 0.350 1.00 0.00 C ATOM 1138 CZ2 TRP A 132 24.100 5.587 3.005 1.00 0.00 C ATOM 1139 CZ3 TRP A 132 24.483 5.853 0.621 1.00 0.00 C ATOM 1140 CH2 TRP A 132 24.943 5.951 1.946 1.00 0.00 C ATOM 0 H TRP A 132 19.122 1.806 1.005 1.00 0.00 H new ATOM 0 HA TRP A 132 19.971 2.834 -1.433 1.00 0.00 H new ATOM 0 HB2 TRP A 132 20.066 4.852 -0.424 1.00 0.00 H new ATOM 0 HB3 TRP A 132 19.025 3.995 0.696 1.00 0.00 H new ATOM 0 HD1 TRP A 132 19.748 3.968 3.184 1.00 0.00 H new ATOM 0 HE1 TRP A 132 21.841 4.595 4.530 1.00 0.00 H new ATOM 0 HE3 TRP A 132 22.835 5.348 -0.673 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 24.435 5.680 4.028 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 25.133 6.133 -0.195 1.00 0.00 H new ATOM 0 HH2 TRP A 132 25.943 6.306 2.147 1.00 0.00 H new ATOM 1151 N GLU A 133 22.357 1.856 0.637 1.00 0.00 N ATOM 1152 CA GLU A 133 23.773 1.697 0.901 1.00 0.00 C ATOM 1153 C GLU A 133 24.330 0.616 -0.036 1.00 0.00 C ATOM 1154 O GLU A 133 25.428 0.775 -0.564 1.00 0.00 O ATOM 1155 CB GLU A 133 23.937 1.362 2.394 1.00 0.00 C ATOM 1156 CG GLU A 133 25.154 2.032 3.037 1.00 0.00 C ATOM 1157 CD GLU A 133 25.126 1.837 4.552 1.00 0.00 C ATOM 1158 OE1 GLU A 133 24.314 2.484 5.266 1.00 0.00 O ATOM 1159 OE2 GLU A 133 25.837 0.930 5.046 1.00 0.00 O ATOM 0 H GLU A 133 21.768 1.452 1.365 1.00 0.00 H new ATOM 0 HA GLU A 133 24.341 2.606 0.702 1.00 0.00 H new ATOM 0 HB2 GLU A 133 23.038 1.669 2.929 1.00 0.00 H new ATOM 0 HB3 GLU A 133 24.023 0.282 2.509 1.00 0.00 H new ATOM 0 HG2 GLU A 133 26.070 1.609 2.626 1.00 0.00 H new ATOM 0 HG3 GLU A 133 25.160 3.096 2.800 1.00 0.00 H new ATOM 1166 N GLN A 134 23.546 -0.438 -0.308 1.00 0.00 N ATOM 1167 CA GLN A 134 23.888 -1.494 -1.256 1.00 0.00 C ATOM 1168 C GLN A 134 23.735 -1.033 -2.704 1.00 0.00 C ATOM 1169 O GLN A 134 24.665 -1.208 -3.490 1.00 0.00 O ATOM 1170 CB GLN A 134 23.000 -2.732 -1.046 1.00 0.00 C ATOM 1171 CG GLN A 134 23.554 -3.684 0.016 1.00 0.00 C ATOM 1172 CD GLN A 134 23.095 -5.113 -0.245 1.00 0.00 C ATOM 1173 OE1 GLN A 134 22.277 -5.656 0.495 1.00 0.00 O ATOM 1174 NE2 GLN A 134 23.626 -5.759 -1.270 1.00 0.00 N ATOM 0 H GLN A 134 22.639 -0.577 0.137 1.00 0.00 H new ATOM 0 HA GLN A 134 24.932 -1.746 -1.070 1.00 0.00 H new ATOM 0 HB2 GLN A 134 22.000 -2.411 -0.754 1.00 0.00 H new ATOM 0 HB3 GLN A 134 22.900 -3.267 -1.991 1.00 0.00 H new ATOM 0 HG2 GLN A 134 24.643 -3.642 0.016 1.00 0.00 H new ATOM 0 HG3 GLN A 134 23.223 -3.366 1.004 1.00 0.00 H new ATOM 0 HE21 GLN A 134 24.303 -5.291 -1.872 1.00 0.00 H new ATOM 0 HE22 GLN A 134 23.358 -6.725 -1.458 1.00 0.00 H new ATOM 1183 N MET A 135 22.552 -0.535 -3.082 1.00 0.00 N ATOM 1184 CA MET A 135 22.254 -0.154 -4.448 1.00 0.00 C ATOM 1185 C MET A 135 22.961 1.151 -4.819 1.00 0.00 C ATOM 1186 O MET A 135 23.059 1.451 -6.003 1.00 0.00 O ATOM 1187 CB MET A 135 20.744 0.038 -4.602 1.00 0.00 C ATOM 1188 CG MET A 135 19.868 -1.203 -4.417 1.00 0.00 C ATOM 1189 SD MET A 135 18.134 -0.827 -4.039 1.00 0.00 S ATOM 1190 CE MET A 135 17.783 0.272 -5.431 1.00 0.00 C ATOM 0 H MET A 135 21.776 -0.388 -2.437 1.00 0.00 H new ATOM 0 HA MET A 135 22.607 -0.945 -5.110 1.00 0.00 H new ATOM 0 HB2 MET A 135 20.422 0.791 -3.883 1.00 0.00 H new ATOM 0 HB3 MET A 135 20.553 0.444 -5.595 1.00 0.00 H new ATOM 0 HG2 MET A 135 19.910 -1.804 -5.325 1.00 0.00 H new ATOM 0 HG3 MET A 135 20.282 -1.811 -3.613 1.00 0.00 H new ATOM 0 HE1 MET A 135 16.730 0.194 -5.700 1.00 0.00 H new ATOM 0 HE2 MET A 135 18.010 1.300 -5.149 1.00 0.00 H new ATOM 0 HE3 MET A 135 18.398 -0.014 -6.285 1.00 0.00 H new ATOM 1200 N GLY A 136 23.418 1.946 -3.847 1.00 0.00 N ATOM 1201 CA GLY A 136 24.222 3.147 -4.021 1.00 0.00 C ATOM 1202 C GLY A 136 23.430 4.445 -4.182 1.00 0.00 C ATOM 1203 O GLY A 136 24.038 5.483 -4.456 1.00 0.00 O ATOM 0 H GLY A 136 23.223 1.753 -2.865 1.00 0.00 H new ATOM 0 HA2 GLY A 136 24.884 3.249 -3.161 1.00 0.00 H new ATOM 0 HA3 GLY A 136 24.856 3.016 -4.898 1.00 0.00 H new ATOM 1207 N LEU A 137 22.102 4.456 -4.022 1.00 0.00 N ATOM 1208 CA LEU A 137 21.265 5.566 -4.484 1.00 0.00 C ATOM 1209 C LEU A 137 21.324 6.738 -3.509 1.00 0.00 C ATOM 1210 O LEU A 137 20.562 6.814 -2.547 1.00 0.00 O ATOM 1211 CB LEU A 137 19.802 5.146 -4.719 1.00 0.00 C ATOM 1212 CG LEU A 137 19.477 4.409 -6.033 1.00 0.00 C ATOM 1213 CD1 LEU A 137 19.823 5.229 -7.274 1.00 0.00 C ATOM 1214 CD2 LEU A 137 20.202 3.078 -6.117 1.00 0.00 C ATOM 0 H LEU A 137 21.582 3.702 -3.573 1.00 0.00 H new ATOM 0 HA LEU A 137 21.672 5.880 -5.445 1.00 0.00 H new ATOM 0 HB2 LEU A 137 19.498 4.506 -3.890 1.00 0.00 H new ATOM 0 HB3 LEU A 137 19.183 6.042 -4.674 1.00 0.00 H new ATOM 0 HG LEU A 137 18.399 4.246 -6.015 1.00 0.00 H new ATOM 0 HD11 LEU A 137 19.572 4.659 -8.168 1.00 0.00 H new ATOM 0 HD12 LEU A 137 19.255 6.159 -7.266 1.00 0.00 H new ATOM 0 HD13 LEU A 137 20.889 5.455 -7.275 1.00 0.00 H new ATOM 0 HD21 LEU A 137 19.950 2.585 -7.056 1.00 0.00 H new ATOM 0 HD22 LEU A 137 21.278 3.246 -6.073 1.00 0.00 H new ATOM 0 HD23 LEU A 137 19.899 2.445 -5.283 1.00 0.00 H new ATOM 1226 N ARG A 138 22.202 7.695 -3.805 1.00 0.00 N ATOM 1227 CA ARG A 138 22.365 8.941 -3.065 1.00 0.00 C ATOM 1228 C ARG A 138 21.046 9.685 -2.960 1.00 0.00 C ATOM 1229 O ARG A 138 20.581 9.925 -1.854 1.00 0.00 O ATOM 1230 CB ARG A 138 23.411 9.823 -3.757 1.00 0.00 C ATOM 1231 CG ARG A 138 24.300 10.597 -2.788 1.00 0.00 C ATOM 1232 CD ARG A 138 25.384 11.279 -3.630 1.00 0.00 C ATOM 1233 NE ARG A 138 26.112 12.307 -2.884 1.00 0.00 N ATOM 1234 CZ ARG A 138 25.695 13.561 -2.680 1.00 0.00 C ATOM 1235 NH1 ARG A 138 24.532 13.999 -3.142 1.00 0.00 N ATOM 1236 NH2 ARG A 138 26.470 14.429 -2.050 1.00 0.00 N ATOM 0 H ARG A 138 22.842 7.619 -4.596 1.00 0.00 H new ATOM 0 HA ARG A 138 22.703 8.702 -2.057 1.00 0.00 H new ATOM 0 HB2 ARG A 138 24.039 9.197 -4.391 1.00 0.00 H new ATOM 0 HB3 ARG A 138 22.901 10.530 -4.412 1.00 0.00 H new ATOM 0 HG2 ARG A 138 23.719 11.335 -2.235 1.00 0.00 H new ATOM 0 HG3 ARG A 138 24.746 9.927 -2.053 1.00 0.00 H new ATOM 0 HD2 ARG A 138 26.088 10.527 -3.987 1.00 0.00 H new ATOM 0 HD3 ARG A 138 24.925 11.730 -4.510 1.00 0.00 H new ATOM 0 HE ARG A 138 27.014 12.044 -2.486 1.00 0.00 H new ATOM 0 HH11 ARG A 138 23.925 13.373 -3.671 1.00 0.00 H new ATOM 0 HH12 ARG A 138 24.244 14.962 -2.968 1.00 0.00 H new ATOM 0 HH21 ARG A 138 27.391 14.143 -1.717 1.00 0.00 H new ATOM 0 HH22 ARG A 138 26.147 15.384 -1.897 1.00 0.00 H new ATOM 1250 N SER A 139 20.422 10.043 -4.088 1.00 0.00 N ATOM 1251 CA SER A 139 19.272 10.927 -4.051 1.00 0.00 C ATOM 1252 C SER A 139 18.066 10.266 -3.376 1.00 0.00 C ATOM 1253 O SER A 139 17.167 11.004 -2.956 1.00 0.00 O ATOM 1254 CB SER A 139 18.935 11.439 -5.453 1.00 0.00 C ATOM 1255 OG SER A 139 18.055 12.556 -5.371 1.00 0.00 O ATOM 0 H SER A 139 20.696 9.735 -5.021 1.00 0.00 H new ATOM 0 HA SER A 139 19.535 11.790 -3.439 1.00 0.00 H new ATOM 0 HB2 SER A 139 19.849 11.725 -5.973 1.00 0.00 H new ATOM 0 HB3 SER A 139 18.471 10.644 -6.037 1.00 0.00 H new ATOM 0 HG SER A 139 17.539 12.506 -4.539 1.00 0.00 H new ATOM 1261 N LEU A 140 18.035 8.929 -3.258 1.00 0.00 N ATOM 1262 CA LEU A 140 17.079 8.243 -2.405 1.00 0.00 C ATOM 1263 C LEU A 140 17.430 8.532 -0.961 1.00 0.00 C ATOM 1264 O LEU A 140 16.620 9.155 -0.287 1.00 0.00 O ATOM 1265 CB LEU A 140 17.031 6.724 -2.639 1.00 0.00 C ATOM 1266 CG LEU A 140 16.328 6.289 -3.934 1.00 0.00 C ATOM 1267 CD1 LEU A 140 16.193 4.761 -3.949 1.00 0.00 C ATOM 1268 CD2 LEU A 140 14.947 6.932 -4.070 1.00 0.00 C ATOM 0 H LEU A 140 18.673 8.305 -3.753 1.00 0.00 H new ATOM 0 HA LEU A 140 16.086 8.619 -2.653 1.00 0.00 H new ATOM 0 HB2 LEU A 140 18.051 6.341 -2.651 1.00 0.00 H new ATOM 0 HB3 LEU A 140 16.525 6.257 -1.794 1.00 0.00 H new ATOM 0 HG LEU A 140 16.933 6.621 -4.778 1.00 0.00 H new ATOM 0 HD11 LEU A 140 15.694 4.449 -4.867 1.00 0.00 H new ATOM 0 HD12 LEU A 140 17.183 4.308 -3.902 1.00 0.00 H new ATOM 0 HD13 LEU A 140 15.605 4.439 -3.089 1.00 0.00 H new ATOM 0 HD21 LEU A 140 14.481 6.600 -4.998 1.00 0.00 H new ATOM 0 HD22 LEU A 140 14.324 6.638 -3.226 1.00 0.00 H new ATOM 0 HD23 LEU A 140 15.051 8.017 -4.084 1.00 0.00 H new ATOM 1280 N CYS A 141 18.617 8.122 -0.496 1.00 0.00 N ATOM 1281 CA CYS A 141 19.038 8.300 0.892 1.00 0.00 C ATOM 1282 C CYS A 141 18.854 9.743 1.369 1.00 0.00 C ATOM 1283 O CYS A 141 18.466 9.964 2.519 1.00 0.00 O ATOM 1284 CB CYS A 141 20.508 7.903 1.031 1.00 0.00 C ATOM 1285 SG CYS A 141 20.895 7.795 2.797 1.00 0.00 S ATOM 0 H CYS A 141 19.313 7.656 -1.078 1.00 0.00 H new ATOM 0 HA CYS A 141 18.410 7.662 1.514 1.00 0.00 H new ATOM 0 HB2 CYS A 141 20.692 6.947 0.542 1.00 0.00 H new ATOM 0 HB3 CYS A 141 21.149 8.639 0.545 1.00 0.00 H new ATOM 0 HG CYS A 141 21.328 6.601 3.074 1.00 0.00 H new ATOM 1291 N ALA A 142 19.151 10.692 0.478 1.00 0.00 N ATOM 1292 CA ALA A 142 18.931 12.111 0.618 1.00 0.00 C ATOM 1293 C ALA A 142 17.432 12.369 0.836 1.00 0.00 C ATOM 1294 O ALA A 142 16.990 12.480 1.976 1.00 0.00 O ATOM 1295 CB ALA A 142 19.531 12.820 -0.612 1.00 0.00 C ATOM 0 H ALA A 142 19.581 10.460 -0.418 1.00 0.00 H new ATOM 0 HA ALA A 142 19.434 12.524 1.492 1.00 0.00 H new ATOM 0 HB1 ALA A 142 19.374 13.895 -0.525 1.00 0.00 H new ATOM 0 HB2 ALA A 142 20.600 12.612 -0.666 1.00 0.00 H new ATOM 0 HB3 ALA A 142 19.044 12.455 -1.516 1.00 0.00 H new ATOM 1301 N GLN A 143 16.613 12.438 -0.220 1.00 0.00 N ATOM 1302 CA GLN A 143 15.230 12.910 -0.079 1.00 0.00 C ATOM 1303 C GLN A 143 14.365 12.027 0.832 1.00 0.00 C ATOM 1304 O GLN A 143 13.440 12.538 1.461 1.00 0.00 O ATOM 1305 CB GLN A 143 14.557 13.083 -1.443 1.00 0.00 C ATOM 1306 CG GLN A 143 15.062 14.315 -2.208 1.00 0.00 C ATOM 1307 CD GLN A 143 14.200 14.638 -3.433 1.00 0.00 C ATOM 1308 OE1 GLN A 143 13.009 14.330 -3.499 1.00 0.00 O ATOM 1309 NE2 GLN A 143 14.760 15.303 -4.424 1.00 0.00 N ATOM 0 H GLN A 143 16.879 12.177 -1.170 1.00 0.00 H new ATOM 0 HA GLN A 143 15.306 13.882 0.409 1.00 0.00 H new ATOM 0 HB2 GLN A 143 14.733 12.191 -2.045 1.00 0.00 H new ATOM 0 HB3 GLN A 143 13.479 13.166 -1.303 1.00 0.00 H new ATOM 0 HG2 GLN A 143 15.073 15.175 -1.539 1.00 0.00 H new ATOM 0 HG3 GLN A 143 16.091 14.145 -2.526 1.00 0.00 H new ATOM 0 HE21 GLN A 143 15.746 15.560 -4.373 1.00 0.00 H new ATOM 0 HE22 GLN A 143 14.207 15.561 -5.242 1.00 0.00 H new ATOM 1318 N ALA A 144 14.689 10.741 0.991 1.00 0.00 N ATOM 1319 CA ALA A 144 14.046 9.849 1.950 1.00 0.00 C ATOM 1320 C ALA A 144 14.073 10.400 3.383 1.00 0.00 C ATOM 1321 O ALA A 144 13.212 10.008 4.176 1.00 0.00 O ATOM 1322 CB ALA A 144 14.708 8.467 1.891 1.00 0.00 C ATOM 0 H ALA A 144 15.420 10.285 0.445 1.00 0.00 H new ATOM 0 HA ALA A 144 12.996 9.768 1.670 1.00 0.00 H new ATOM 0 HB1 ALA A 144 14.226 7.802 2.608 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.603 8.056 0.887 1.00 0.00 H new ATOM 0 HB3 ALA A 144 15.766 8.560 2.136 1.00 0.00 H new ATOM 1328 N GLN A 145 15.026 11.280 3.716 1.00 0.00 N ATOM 1329 CA GLN A 145 15.407 11.632 5.078 1.00 0.00 C ATOM 1330 C GLN A 145 15.672 13.142 5.203 1.00 0.00 C ATOM 1331 O GLN A 145 16.448 13.571 6.055 1.00 0.00 O ATOM 1332 CB GLN A 145 16.619 10.785 5.494 1.00 0.00 C ATOM 1333 CG GLN A 145 16.310 9.281 5.470 1.00 0.00 C ATOM 1334 CD GLN A 145 17.457 8.463 6.035 1.00 0.00 C ATOM 1335 OE1 GLN A 145 17.360 7.944 7.143 1.00 0.00 O ATOM 1336 NE2 GLN A 145 18.553 8.364 5.302 1.00 0.00 N ATOM 0 H GLN A 145 15.569 11.782 3.014 1.00 0.00 H new ATOM 0 HA GLN A 145 14.587 11.411 5.761 1.00 0.00 H new ATOM 0 HB2 GLN A 145 17.453 10.994 4.824 1.00 0.00 H new ATOM 0 HB3 GLN A 145 16.935 11.073 6.496 1.00 0.00 H new ATOM 0 HG2 GLN A 145 15.406 9.086 6.046 1.00 0.00 H new ATOM 0 HG3 GLN A 145 16.109 8.967 4.446 1.00 0.00 H new ATOM 0 HE21 GLN A 145 18.595 8.809 4.385 1.00 0.00 H new ATOM 0 HE22 GLN A 145 19.356 7.842 5.653 1.00 0.00 H new ATOM 1345 N GLU A 146 15.061 13.975 4.360 1.00 0.00 N ATOM 1346 CA GLU A 146 15.288 15.421 4.302 1.00 0.00 C ATOM 1347 C GLU A 146 13.973 16.221 4.363 1.00 0.00 C ATOM 1348 O GLU A 146 13.804 17.254 3.705 1.00 0.00 O ATOM 1349 CB GLU A 146 16.157 15.724 3.073 1.00 0.00 C ATOM 1350 CG GLU A 146 17.633 15.386 3.332 1.00 0.00 C ATOM 1351 CD GLU A 146 18.616 16.174 2.457 1.00 0.00 C ATOM 1352 OE1 GLU A 146 18.427 16.270 1.219 1.00 0.00 O ATOM 1353 OE2 GLU A 146 19.607 16.714 3.012 1.00 0.00 O ATOM 0 H GLU A 146 14.374 13.654 3.678 1.00 0.00 H new ATOM 0 HA GLU A 146 15.831 15.753 5.187 1.00 0.00 H new ATOM 0 HB2 GLU A 146 15.795 15.150 2.220 1.00 0.00 H new ATOM 0 HB3 GLU A 146 16.064 16.778 2.811 1.00 0.00 H new ATOM 0 HG2 GLU A 146 17.861 15.579 4.380 1.00 0.00 H new ATOM 0 HG3 GLU A 146 17.786 14.320 3.163 1.00 0.00 H new ATOM 1360 N GLY A 147 13.040 15.746 5.184 1.00 0.00 N ATOM 1361 CA GLY A 147 11.798 16.420 5.561 1.00 0.00 C ATOM 1362 C GLY A 147 10.680 16.247 4.533 1.00 0.00 C ATOM 1363 O GLY A 147 9.623 16.862 4.668 1.00 0.00 O ATOM 0 H GLY A 147 13.134 14.833 5.628 1.00 0.00 H new ATOM 0 HA2 GLY A 147 11.461 16.034 6.523 1.00 0.00 H new ATOM 0 HA3 GLY A 147 11.996 17.483 5.696 1.00 0.00 H new ATOM 1367 N ALA A 148 10.904 15.415 3.514 1.00 0.00 N ATOM 1368 CA ALA A 148 10.163 15.344 2.259 1.00 0.00 C ATOM 1369 C ALA A 148 8.722 14.809 2.362 1.00 0.00 C ATOM 1370 O ALA A 148 8.097 14.587 1.321 1.00 0.00 O ATOM 1371 CB ALA A 148 10.977 14.492 1.291 1.00 0.00 C ATOM 0 H ALA A 148 11.658 14.729 3.549 1.00 0.00 H new ATOM 0 HA ALA A 148 10.036 16.369 1.910 1.00 0.00 H new ATOM 0 HB1 ALA A 148 10.450 14.418 0.340 1.00 0.00 H new ATOM 0 HB2 ALA A 148 11.952 14.953 1.131 1.00 0.00 H new ATOM 0 HB3 ALA A 148 11.112 13.495 1.709 1.00 0.00 H new ATOM 1377 N GLY A 149 8.196 14.601 3.572 1.00 0.00 N ATOM 1378 CA GLY A 149 6.845 14.128 3.850 1.00 0.00 C ATOM 1379 C GLY A 149 5.791 14.802 2.972 1.00 0.00 C ATOM 1380 O GLY A 149 5.790 16.028 2.830 1.00 0.00 O ATOM 0 H GLY A 149 8.731 14.767 4.424 1.00 0.00 H new ATOM 0 HA2 GLY A 149 6.804 13.050 3.697 1.00 0.00 H new ATOM 0 HA3 GLY A 149 6.609 14.311 4.898 1.00 0.00 H new ATOM 1384 N HIS A 150 4.924 13.971 2.394 1.00 0.00 N ATOM 1385 CA HIS A 150 3.790 14.251 1.521 1.00 0.00 C ATOM 1386 C HIS A 150 4.029 15.206 0.340 1.00 0.00 C ATOM 1387 O HIS A 150 5.107 15.762 0.120 1.00 0.00 O ATOM 1388 CB HIS A 150 2.549 14.604 2.363 1.00 0.00 C ATOM 1389 CG HIS A 150 1.592 13.446 2.492 1.00 0.00 C ATOM 1390 ND1 HIS A 150 1.263 12.791 3.649 1.00 0.00 N ATOM 1391 CD2 HIS A 150 0.917 12.828 1.475 1.00 0.00 C ATOM 1392 CE1 HIS A 150 0.415 11.798 3.342 1.00 0.00 C ATOM 1393 NE2 HIS A 150 0.184 11.769 2.021 1.00 0.00 N ATOM 0 H HIS A 150 5.013 12.966 2.547 1.00 0.00 H new ATOM 0 HA HIS A 150 3.609 13.318 0.987 1.00 0.00 H new ATOM 0 HB2 HIS A 150 2.866 14.922 3.356 1.00 0.00 H new ATOM 0 HB3 HIS A 150 2.033 15.449 1.907 1.00 0.00 H new ATOM 0 HD1 HIS A 150 1.604 13.019 4.583 1.00 0.00 H new ATOM 0 HD2 HIS A 150 0.945 13.109 0.433 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -0.021 11.117 4.058 1.00 0.00 H new ATOM 1401 N SER A 151 3.001 15.313 -0.498 1.00 0.00 N ATOM 1402 CA SER A 151 2.975 16.013 -1.768 1.00 0.00 C ATOM 1403 C SER A 151 1.500 16.015 -2.166 1.00 0.00 C ATOM 1404 O SER A 151 0.732 16.790 -1.595 1.00 0.00 O ATOM 1405 CB SER A 151 3.931 15.285 -2.733 1.00 0.00 C ATOM 1406 OG SER A 151 3.705 15.508 -4.109 1.00 0.00 O ATOM 0 H SER A 151 2.102 14.879 -0.287 1.00 0.00 H new ATOM 0 HA SER A 151 3.329 17.044 -1.756 1.00 0.00 H new ATOM 0 HB2 SER A 151 4.952 15.586 -2.499 1.00 0.00 H new ATOM 0 HB3 SER A 151 3.863 14.214 -2.542 1.00 0.00 H new ATOM 0 HG SER A 151 4.362 15.005 -4.634 1.00 0.00 H new TER 1412 SER A 151