USER MOD reduce.3.24.130724 H: found=0, std=0, add=1069, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1069 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 109 TYR OH : rot 150:sc= -0.874 USER MOD Set 1.2: A 113 LYS NZ :NH3+ -134:sc= 0.408 (180deg=-0.176) USER MOD Set 2.1: A 76 LYS NZ :NH3+ -117:sc= -1.65! (180deg=0) USER MOD Set 2.2: A 129 ASN : amide:sc= -5.25! K(o=-6.9!,f=-0.22) USER MOD Single : A 5 SER OG : rot 180:sc= -0.561 USER MOD Single : A 9 GLN : amide:sc= -4.59! C(o=-4.6!,f=-6.9!) USER MOD Single : A 11 LYS NZ :NH3+ -160:sc= -1.2 (180deg=-1.87) USER MOD Single : A 12 GLN : amide:sc= -0.0693 K(o=-0.069,f=-2.3!) USER MOD Single : A 15 GLN : amide:sc= -0.28 K(o=-0.28,f=-1.4) USER MOD Single : A 17 TYR OH : rot -30:sc= -0.213 USER MOD Single : A 20 ASN : amide:sc= -5.3! C(o=-5.3!,f=-9.5!) USER MOD Single : A 24 LYS NZ :NH3+ 137:sc= -0.245 (180deg=-1.22!) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -68:sc= -0.448 USER MOD Single : A 36 MET CE :methyl 141:sc= -3.77! (180deg=-7.67!) USER MOD Single : A 37 GLN : amide:sc= -0.0981 K(o=-0.098,f=-2!) USER MOD Single : A 38 LYS NZ :NH3+ 159:sc= -0.1 (180deg=-0.626) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0.0124 USER MOD Single : A 44 ASN : amide:sc= -0.428 K(o=-0.43,f=-2.1) USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -62:sc= 1.06 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.0827 USER MOD Single : A 61 ASN : amide:sc= -0.487 K(o=-0.49,f=-4!) USER MOD Single : A 74 ASN : amide:sc= -0.248 X(o=-0.25,f=-0.13) USER MOD Single : A 75 LYS NZ :NH3+ 157:sc= -2.9 (180deg=-4.1!) USER MOD Single : A 79 GLN : amide:sc= -2.67! K(o=-2.7!,f=-0.31) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.0172 X(o=-0.017,f=-0.03) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 65:sc= 0.836 USER MOD Single : A 93 SER OG : rot 66:sc= 1.03 USER MOD Single : A 97 THR OG1 : rot 73:sc= 0.0102 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -1.11 K(o=-1.1,f=-0.12) USER MOD Single : A 102 TYR OH : rot 147:sc= -1.18! USER MOD Single : A 103 MET CE :methyl -170:sc= -0.0343 (180deg=-0.0421) USER MOD Single : A 104 LYS NZ :NH3+ -146:sc= -0.262 (180deg=-1.4!) USER MOD Single : A 105 TYR OH : rot 180:sc= -2.69! USER MOD Single : A 107 TYR OH : rot 150:sc= 0 USER MOD Single : A 111 CYS SG : rot 88:sc= 0.547 USER MOD Single : A 114 LYS NZ :NH3+ -118:sc= -1.29 (180deg=-2.74!) USER MOD Single : A 115 ASN : amide:sc= -0.169 K(o=-0.17,f=-1.9!) USER MOD Single : A 117 SER OG : rot 110:sc= -2.85! USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.545 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 3 100.846 -14.013 11.891 1.00 0.00 N ATOM 2 CA GLY A 3 101.732 -14.646 12.908 1.00 0.00 C ATOM 3 C GLY A 3 103.134 -14.039 12.814 1.00 0.00 C ATOM 4 O GLY A 3 104.071 -14.679 12.381 1.00 0.00 O ATOM 0 HA2 GLY A 3 101.324 -14.492 13.907 1.00 0.00 H new ATOM 0 HA3 GLY A 3 101.779 -15.723 12.745 1.00 0.00 H new ATOM 8 N TRP A 4 103.282 -12.804 13.214 1.00 0.00 N ATOM 9 CA TRP A 4 104.619 -12.137 13.152 1.00 0.00 C ATOM 10 C TRP A 4 105.284 -12.192 14.529 1.00 0.00 C ATOM 11 O TRP A 4 104.665 -11.914 15.537 1.00 0.00 O ATOM 12 CB TRP A 4 104.425 -10.676 12.735 1.00 0.00 C ATOM 13 CG TRP A 4 105.750 -9.988 12.665 1.00 0.00 C ATOM 14 CD1 TRP A 4 106.536 -9.924 11.565 1.00 0.00 C ATOM 15 CD2 TRP A 4 106.452 -9.259 13.713 1.00 0.00 C ATOM 16 NE1 TRP A 4 107.677 -9.204 11.872 1.00 0.00 N ATOM 17 CE2 TRP A 4 107.671 -8.773 13.184 1.00 0.00 C ATOM 18 CE3 TRP A 4 106.153 -8.977 15.058 1.00 0.00 C ATOM 19 CZ2 TRP A 4 108.562 -8.032 13.963 1.00 0.00 C ATOM 20 CZ3 TRP A 4 107.046 -8.231 15.844 1.00 0.00 C ATOM 21 CH2 TRP A 4 108.249 -7.760 15.298 1.00 0.00 C ATOM 0 H TRP A 4 102.530 -12.223 13.584 1.00 0.00 H new ATOM 0 HA TRP A 4 105.253 -12.648 12.428 1.00 0.00 H new ATOM 0 HB2 TRP A 4 103.929 -10.628 11.766 1.00 0.00 H new ATOM 0 HB3 TRP A 4 103.778 -10.167 13.450 1.00 0.00 H new ATOM 0 HD1 TRP A 4 106.310 -10.363 10.605 1.00 0.00 H new ATOM 0 HE1 TRP A 4 108.430 -9.015 11.211 1.00 0.00 H new ATOM 0 HE3 TRP A 4 105.230 -9.337 15.489 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 109.487 -7.671 13.537 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 106.805 -8.019 16.875 1.00 0.00 H new ATOM 0 HH2 TRP A 4 108.932 -7.188 15.908 1.00 0.00 H new ATOM 32 N SER A 5 106.546 -12.546 14.579 1.00 0.00 N ATOM 33 CA SER A 5 107.268 -12.618 15.890 1.00 0.00 C ATOM 34 C SER A 5 108.663 -12.013 15.724 1.00 0.00 C ATOM 35 O SER A 5 109.139 -11.818 14.624 1.00 0.00 O ATOM 36 CB SER A 5 107.391 -14.076 16.338 1.00 0.00 C ATOM 37 OG SER A 5 108.323 -14.749 15.505 1.00 0.00 O ATOM 0 H SER A 5 107.110 -12.789 13.765 1.00 0.00 H new ATOM 0 HA SER A 5 106.711 -12.062 16.644 1.00 0.00 H new ATOM 0 HB2 SER A 5 107.716 -14.122 17.377 1.00 0.00 H new ATOM 0 HB3 SER A 5 106.419 -14.567 16.286 1.00 0.00 H new ATOM 0 HG SER A 5 108.404 -15.682 15.792 1.00 0.00 H new ATOM 43 N PHE A 6 109.313 -11.696 16.809 1.00 0.00 N ATOM 44 CA PHE A 6 110.669 -11.082 16.716 1.00 0.00 C ATOM 45 C PHE A 6 111.645 -12.020 16.002 1.00 0.00 C ATOM 46 O PHE A 6 112.317 -11.628 15.068 1.00 0.00 O ATOM 47 CB PHE A 6 111.189 -10.792 18.143 1.00 0.00 C ATOM 48 CG PHE A 6 110.919 -9.355 18.514 1.00 0.00 C ATOM 49 CD1 PHE A 6 111.879 -8.386 18.220 1.00 0.00 C ATOM 50 CD2 PHE A 6 109.724 -8.998 19.144 1.00 0.00 C ATOM 51 CE1 PHE A 6 111.647 -7.048 18.557 1.00 0.00 C ATOM 52 CE2 PHE A 6 109.488 -7.660 19.482 1.00 0.00 C ATOM 53 CZ PHE A 6 110.451 -6.684 19.189 1.00 0.00 C ATOM 0 H PHE A 6 108.964 -11.835 17.757 1.00 0.00 H new ATOM 0 HA PHE A 6 110.597 -10.157 16.143 1.00 0.00 H new ATOM 0 HB2 PHE A 6 110.703 -11.457 18.857 1.00 0.00 H new ATOM 0 HB3 PHE A 6 112.259 -10.994 18.196 1.00 0.00 H new ATOM 0 HD1 PHE A 6 112.800 -8.669 17.733 1.00 0.00 H new ATOM 0 HD2 PHE A 6 108.984 -9.752 19.370 1.00 0.00 H new ATOM 0 HE1 PHE A 6 112.389 -6.297 18.330 1.00 0.00 H new ATOM 0 HE2 PHE A 6 108.565 -7.380 19.968 1.00 0.00 H new ATOM 0 HZ PHE A 6 110.271 -5.652 19.451 1.00 0.00 H new ATOM 63 N GLU A 7 111.761 -13.238 16.442 1.00 0.00 N ATOM 64 CA GLU A 7 112.732 -14.145 15.782 1.00 0.00 C ATOM 65 C GLU A 7 112.290 -14.461 14.349 1.00 0.00 C ATOM 66 O GLU A 7 113.100 -14.800 13.509 1.00 0.00 O ATOM 67 CB GLU A 7 112.888 -15.438 16.587 1.00 0.00 C ATOM 68 CG GLU A 7 111.548 -16.173 16.669 1.00 0.00 C ATOM 69 CD GLU A 7 111.726 -17.460 17.476 1.00 0.00 C ATOM 70 OE1 GLU A 7 112.863 -17.820 17.734 1.00 0.00 O ATOM 71 OE2 GLU A 7 110.723 -18.061 17.824 1.00 0.00 O ATOM 0 H GLU A 7 111.234 -13.640 17.218 1.00 0.00 H new ATOM 0 HA GLU A 7 113.697 -13.641 15.741 1.00 0.00 H new ATOM 0 HB2 GLU A 7 113.635 -16.079 16.119 1.00 0.00 H new ATOM 0 HB3 GLU A 7 113.248 -15.210 17.590 1.00 0.00 H new ATOM 0 HG2 GLU A 7 110.799 -15.536 17.139 1.00 0.00 H new ATOM 0 HG3 GLU A 7 111.186 -16.405 15.668 1.00 0.00 H new ATOM 78 N GLU A 8 111.019 -14.361 14.055 1.00 0.00 N ATOM 79 CA GLU A 8 110.565 -14.669 12.667 1.00 0.00 C ATOM 80 C GLU A 8 111.191 -13.669 11.697 1.00 0.00 C ATOM 81 O GLU A 8 111.626 -14.022 10.625 1.00 0.00 O ATOM 82 CB GLU A 8 109.037 -14.580 12.580 1.00 0.00 C ATOM 83 CG GLU A 8 108.577 -14.898 11.151 1.00 0.00 C ATOM 84 CD GLU A 8 107.052 -14.826 11.078 1.00 0.00 C ATOM 85 OE1 GLU A 8 106.432 -14.732 12.124 1.00 0.00 O ATOM 86 OE2 GLU A 8 106.529 -14.868 9.976 1.00 0.00 O ATOM 0 H GLU A 8 110.285 -14.083 14.707 1.00 0.00 H new ATOM 0 HA GLU A 8 110.876 -15.680 12.405 1.00 0.00 H new ATOM 0 HB2 GLU A 8 108.583 -15.279 13.282 1.00 0.00 H new ATOM 0 HB3 GLU A 8 108.705 -13.582 12.865 1.00 0.00 H new ATOM 0 HG2 GLU A 8 109.019 -14.190 10.449 1.00 0.00 H new ATOM 0 HG3 GLU A 8 108.919 -15.891 10.860 1.00 0.00 H new ATOM 93 N GLN A 9 111.248 -12.423 12.058 1.00 0.00 N ATOM 94 CA GLN A 9 111.861 -11.421 11.145 1.00 0.00 C ATOM 95 C GLN A 9 113.376 -11.675 11.086 1.00 0.00 C ATOM 96 O GLN A 9 114.006 -11.578 10.048 1.00 0.00 O ATOM 97 CB GLN A 9 111.569 -10.005 11.685 1.00 0.00 C ATOM 98 CG GLN A 9 111.479 -9.000 10.530 1.00 0.00 C ATOM 99 CD GLN A 9 112.712 -9.127 9.635 1.00 0.00 C ATOM 100 OE1 GLN A 9 112.592 -9.299 8.438 1.00 0.00 O ATOM 101 NE2 GLN A 9 113.901 -9.048 10.168 1.00 0.00 N ATOM 0 H GLN A 9 110.899 -12.053 12.942 1.00 0.00 H new ATOM 0 HA GLN A 9 111.444 -11.506 10.141 1.00 0.00 H new ATOM 0 HB2 GLN A 9 110.634 -10.008 12.246 1.00 0.00 H new ATOM 0 HB3 GLN A 9 112.355 -9.704 12.377 1.00 0.00 H new ATOM 0 HG2 GLN A 9 110.576 -9.181 9.948 1.00 0.00 H new ATOM 0 HG3 GLN A 9 111.407 -7.986 10.923 1.00 0.00 H new ATOM 0 HE21 GLN A 9 114.001 -8.904 11.173 1.00 0.00 H new ATOM 0 HE22 GLN A 9 114.730 -9.131 9.580 1.00 0.00 H new ATOM 110 N PHE A 10 113.955 -11.988 12.212 1.00 0.00 N ATOM 111 CA PHE A 10 115.423 -12.239 12.277 1.00 0.00 C ATOM 112 C PHE A 10 115.814 -13.489 11.471 1.00 0.00 C ATOM 113 O PHE A 10 116.726 -13.455 10.671 1.00 0.00 O ATOM 114 CB PHE A 10 115.804 -12.444 13.742 1.00 0.00 C ATOM 115 CG PHE A 10 117.281 -12.702 13.860 1.00 0.00 C ATOM 116 CD1 PHE A 10 117.762 -14.013 13.797 1.00 0.00 C ATOM 117 CD2 PHE A 10 118.169 -11.633 14.031 1.00 0.00 C ATOM 118 CE1 PHE A 10 119.135 -14.259 13.903 1.00 0.00 C ATOM 119 CE2 PHE A 10 119.543 -11.878 14.138 1.00 0.00 C ATOM 120 CZ PHE A 10 120.026 -13.192 14.074 1.00 0.00 C ATOM 0 H PHE A 10 113.466 -12.082 13.102 1.00 0.00 H new ATOM 0 HA PHE A 10 115.950 -11.386 11.848 1.00 0.00 H new ATOM 0 HB2 PHE A 10 115.533 -11.562 14.323 1.00 0.00 H new ATOM 0 HB3 PHE A 10 115.246 -13.283 14.157 1.00 0.00 H new ATOM 0 HD1 PHE A 10 117.074 -14.835 13.667 1.00 0.00 H new ATOM 0 HD2 PHE A 10 117.794 -10.621 14.080 1.00 0.00 H new ATOM 0 HE1 PHE A 10 119.508 -15.271 13.853 1.00 0.00 H new ATOM 0 HE2 PHE A 10 120.230 -11.055 14.270 1.00 0.00 H new ATOM 0 HZ PHE A 10 121.086 -13.382 14.157 1.00 0.00 H new ATOM 130 N LYS A 11 115.153 -14.599 11.670 1.00 0.00 N ATOM 131 CA LYS A 11 115.545 -15.820 10.903 1.00 0.00 C ATOM 132 C LYS A 11 115.401 -15.551 9.406 1.00 0.00 C ATOM 133 O LYS A 11 116.132 -16.096 8.600 1.00 0.00 O ATOM 134 CB LYS A 11 114.682 -17.019 11.314 1.00 0.00 C ATOM 135 CG LYS A 11 113.223 -16.756 10.954 1.00 0.00 C ATOM 136 CD LYS A 11 112.333 -17.841 11.574 1.00 0.00 C ATOM 137 CE LYS A 11 112.772 -19.225 11.082 1.00 0.00 C ATOM 138 NZ LYS A 11 113.134 -19.153 9.638 1.00 0.00 N ATOM 0 H LYS A 11 114.373 -14.714 12.317 1.00 0.00 H new ATOM 0 HA LYS A 11 116.585 -16.059 11.127 1.00 0.00 H new ATOM 0 HB2 LYS A 11 115.033 -17.920 10.811 1.00 0.00 H new ATOM 0 HB3 LYS A 11 114.775 -17.195 12.386 1.00 0.00 H new ATOM 0 HG2 LYS A 11 112.921 -15.773 11.316 1.00 0.00 H new ATOM 0 HG3 LYS A 11 113.102 -16.748 9.871 1.00 0.00 H new ATOM 0 HD2 LYS A 11 112.395 -17.796 12.661 1.00 0.00 H new ATOM 0 HD3 LYS A 11 111.291 -17.665 11.307 1.00 0.00 H new ATOM 0 HE2 LYS A 11 113.625 -19.575 11.664 1.00 0.00 H new ATOM 0 HE3 LYS A 11 111.968 -19.946 11.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 113.101 -20.106 9.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 112.460 -18.537 9.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 114.094 -18.766 9.540 1.00 0.00 H new ATOM 152 N GLN A 12 114.490 -14.703 9.015 1.00 0.00 N ATOM 153 CA GLN A 12 114.359 -14.413 7.565 1.00 0.00 C ATOM 154 C GLN A 12 115.682 -13.841 7.067 1.00 0.00 C ATOM 155 O GLN A 12 116.141 -14.181 6.006 1.00 0.00 O ATOM 156 CB GLN A 12 113.223 -13.417 7.315 1.00 0.00 C ATOM 157 CG GLN A 12 111.881 -14.127 7.504 1.00 0.00 C ATOM 158 CD GLN A 12 110.747 -13.101 7.509 1.00 0.00 C ATOM 159 OE1 GLN A 12 110.978 -11.925 7.707 1.00 0.00 O ATOM 160 NE2 GLN A 12 109.522 -13.500 7.303 1.00 0.00 N ATOM 0 H GLN A 12 113.842 -14.207 9.627 1.00 0.00 H new ATOM 0 HA GLN A 12 114.122 -15.331 7.027 1.00 0.00 H new ATOM 0 HB2 GLN A 12 113.303 -12.576 8.003 1.00 0.00 H new ATOM 0 HB3 GLN A 12 113.294 -13.011 6.306 1.00 0.00 H new ATOM 0 HG2 GLN A 12 111.726 -14.850 6.703 1.00 0.00 H new ATOM 0 HG3 GLN A 12 111.883 -14.685 8.441 1.00 0.00 H new ATOM 0 HE21 GLN A 12 109.328 -14.488 7.137 1.00 0.00 H new ATOM 0 HE22 GLN A 12 108.758 -12.824 7.308 1.00 0.00 H new ATOM 169 N VAL A 13 116.331 -12.997 7.822 1.00 0.00 N ATOM 170 CA VAL A 13 117.637 -12.473 7.327 1.00 0.00 C ATOM 171 C VAL A 13 118.554 -13.677 7.075 1.00 0.00 C ATOM 172 O VAL A 13 119.405 -13.659 6.212 1.00 0.00 O ATOM 173 CB VAL A 13 118.258 -11.487 8.350 1.00 0.00 C ATOM 174 CG1 VAL A 13 119.162 -12.218 9.364 1.00 0.00 C ATOM 175 CG2 VAL A 13 119.090 -10.434 7.605 1.00 0.00 C ATOM 0 H VAL A 13 116.026 -12.655 8.733 1.00 0.00 H new ATOM 0 HA VAL A 13 117.500 -11.914 6.402 1.00 0.00 H new ATOM 0 HB VAL A 13 117.443 -11.012 8.896 1.00 0.00 H new ATOM 0 HG11 VAL A 13 119.580 -11.496 10.065 1.00 0.00 H new ATOM 0 HG12 VAL A 13 118.574 -12.956 9.910 1.00 0.00 H new ATOM 0 HG13 VAL A 13 119.972 -12.720 8.834 1.00 0.00 H new ATOM 0 HG21 VAL A 13 119.527 -9.740 8.324 1.00 0.00 H new ATOM 0 HG22 VAL A 13 119.886 -10.927 7.047 1.00 0.00 H new ATOM 0 HG23 VAL A 13 118.449 -9.885 6.915 1.00 0.00 H new ATOM 185 N ARG A 14 118.375 -14.729 7.822 1.00 0.00 N ATOM 186 CA ARG A 14 119.222 -15.935 7.613 1.00 0.00 C ATOM 187 C ARG A 14 119.105 -16.373 6.149 1.00 0.00 C ATOM 188 O ARG A 14 120.091 -16.600 5.475 1.00 0.00 O ATOM 189 CB ARG A 14 118.713 -17.058 8.540 1.00 0.00 C ATOM 190 CG ARG A 14 119.841 -18.042 8.876 1.00 0.00 C ATOM 191 CD ARG A 14 120.273 -18.801 7.622 1.00 0.00 C ATOM 192 NE ARG A 14 121.092 -19.982 8.016 1.00 0.00 N ATOM 193 CZ ARG A 14 122.204 -19.811 8.678 1.00 0.00 C ATOM 194 NH1 ARG A 14 122.901 -18.721 8.511 1.00 0.00 N ATOM 195 NH2 ARG A 14 122.616 -20.730 9.508 1.00 0.00 N ATOM 0 H ARG A 14 117.681 -14.806 8.566 1.00 0.00 H new ATOM 0 HA ARG A 14 120.265 -15.717 7.842 1.00 0.00 H new ATOM 0 HB2 ARG A 14 118.316 -16.625 9.459 1.00 0.00 H new ATOM 0 HB3 ARG A 14 117.893 -17.590 8.058 1.00 0.00 H new ATOM 0 HG2 ARG A 14 120.691 -17.503 9.294 1.00 0.00 H new ATOM 0 HG3 ARG A 14 119.504 -18.746 9.637 1.00 0.00 H new ATOM 0 HD2 ARG A 14 119.397 -19.123 7.059 1.00 0.00 H new ATOM 0 HD3 ARG A 14 120.849 -18.147 6.968 1.00 0.00 H new ATOM 0 HE ARG A 14 120.784 -20.922 7.769 1.00 0.00 H new ATOM 0 HH11 ARG A 14 122.577 -18.003 7.863 1.00 0.00 H new ATOM 0 HH12 ARG A 14 123.770 -18.587 9.028 1.00 0.00 H new ATOM 0 HH21 ARG A 14 122.069 -21.581 9.639 1.00 0.00 H new ATOM 0 HH22 ARG A 14 123.485 -20.597 10.026 1.00 0.00 H new ATOM 209 N GLN A 15 117.908 -16.498 5.653 1.00 0.00 N ATOM 210 CA GLN A 15 117.737 -16.936 4.241 1.00 0.00 C ATOM 211 C GLN A 15 118.396 -15.924 3.281 1.00 0.00 C ATOM 212 O GLN A 15 118.809 -16.283 2.198 1.00 0.00 O ATOM 213 CB GLN A 15 116.237 -17.131 3.937 1.00 0.00 C ATOM 214 CG GLN A 15 115.567 -15.808 3.517 1.00 0.00 C ATOM 215 CD GLN A 15 114.103 -15.792 3.984 1.00 0.00 C ATOM 216 OE1 GLN A 15 113.653 -14.833 4.578 1.00 0.00 O ATOM 217 NE2 GLN A 15 113.344 -16.826 3.742 1.00 0.00 N ATOM 0 H GLN A 15 117.043 -16.317 6.162 1.00 0.00 H new ATOM 0 HA GLN A 15 118.237 -17.893 4.091 1.00 0.00 H new ATOM 0 HB2 GLN A 15 116.119 -17.868 3.142 1.00 0.00 H new ATOM 0 HB3 GLN A 15 115.735 -17.530 4.819 1.00 0.00 H new ATOM 0 HG2 GLN A 15 116.105 -14.964 3.949 1.00 0.00 H new ATOM 0 HG3 GLN A 15 115.614 -15.694 2.434 1.00 0.00 H new ATOM 0 HE21 GLN A 15 113.723 -17.631 3.243 1.00 0.00 H new ATOM 0 HE22 GLN A 15 112.372 -16.829 4.052 1.00 0.00 H new ATOM 226 N LEU A 16 118.515 -14.668 3.661 1.00 0.00 N ATOM 227 CA LEU A 16 119.169 -13.687 2.735 1.00 0.00 C ATOM 228 C LEU A 16 120.643 -14.087 2.554 1.00 0.00 C ATOM 229 O LEU A 16 121.149 -14.152 1.453 1.00 0.00 O ATOM 230 CB LEU A 16 119.088 -12.253 3.315 1.00 0.00 C ATOM 231 CG LEU A 16 117.812 -11.549 2.836 1.00 0.00 C ATOM 232 CD1 LEU A 16 116.588 -12.385 3.204 1.00 0.00 C ATOM 233 CD2 LEU A 16 117.713 -10.175 3.505 1.00 0.00 C ATOM 0 H LEU A 16 118.195 -14.289 4.552 1.00 0.00 H new ATOM 0 HA LEU A 16 118.653 -13.699 1.775 1.00 0.00 H new ATOM 0 HB2 LEU A 16 119.100 -12.294 4.404 1.00 0.00 H new ATOM 0 HB3 LEU A 16 119.963 -11.680 3.008 1.00 0.00 H new ATOM 0 HG LEU A 16 117.849 -11.430 1.753 1.00 0.00 H new ATOM 0 HD11 LEU A 16 115.685 -11.879 2.861 1.00 0.00 H new ATOM 0 HD12 LEU A 16 116.659 -13.363 2.728 1.00 0.00 H new ATOM 0 HD13 LEU A 16 116.545 -12.510 4.286 1.00 0.00 H new ATOM 0 HD21 LEU A 16 116.808 -9.670 3.168 1.00 0.00 H new ATOM 0 HD22 LEU A 16 117.678 -10.299 4.587 1.00 0.00 H new ATOM 0 HD23 LEU A 16 118.583 -9.576 3.237 1.00 0.00 H new ATOM 245 N TYR A 17 121.333 -14.364 3.623 1.00 0.00 N ATOM 246 CA TYR A 17 122.762 -14.768 3.498 1.00 0.00 C ATOM 247 C TYR A 17 122.854 -16.084 2.716 1.00 0.00 C ATOM 248 O TYR A 17 123.745 -16.279 1.914 1.00 0.00 O ATOM 249 CB TYR A 17 123.376 -14.942 4.892 1.00 0.00 C ATOM 250 CG TYR A 17 123.710 -13.587 5.475 1.00 0.00 C ATOM 251 CD1 TYR A 17 124.971 -13.022 5.246 1.00 0.00 C ATOM 252 CD2 TYR A 17 122.761 -12.899 6.242 1.00 0.00 C ATOM 253 CE1 TYR A 17 125.286 -11.769 5.784 1.00 0.00 C ATOM 254 CE2 TYR A 17 123.077 -11.646 6.782 1.00 0.00 C ATOM 255 CZ TYR A 17 124.338 -11.081 6.553 1.00 0.00 C ATOM 256 OH TYR A 17 124.648 -9.846 7.086 1.00 0.00 O ATOM 0 H TYR A 17 120.972 -14.329 4.576 1.00 0.00 H new ATOM 0 HA TYR A 17 123.313 -13.994 2.964 1.00 0.00 H new ATOM 0 HB2 TYR A 17 122.678 -15.467 5.544 1.00 0.00 H new ATOM 0 HB3 TYR A 17 124.276 -15.554 4.830 1.00 0.00 H new ATOM 0 HD1 TYR A 17 125.701 -13.554 4.654 1.00 0.00 H new ATOM 0 HD2 TYR A 17 121.788 -13.334 6.417 1.00 0.00 H new ATOM 0 HE1 TYR A 17 126.258 -11.333 5.607 1.00 0.00 H new ATOM 0 HE2 TYR A 17 122.348 -11.115 7.376 1.00 0.00 H new ATOM 0 HH TYR A 17 125.611 -9.799 7.264 1.00 0.00 H new ATOM 266 N GLU A 18 121.952 -16.996 2.960 1.00 0.00 N ATOM 267 CA GLU A 18 122.003 -18.311 2.244 1.00 0.00 C ATOM 268 C GLU A 18 121.654 -18.153 0.755 1.00 0.00 C ATOM 269 O GLU A 18 121.626 -19.122 0.023 1.00 0.00 O ATOM 270 CB GLU A 18 121.008 -19.283 2.880 1.00 0.00 C ATOM 271 CG GLU A 18 121.500 -19.691 4.268 1.00 0.00 C ATOM 272 CD GLU A 18 120.499 -20.662 4.896 1.00 0.00 C ATOM 273 OE1 GLU A 18 119.426 -20.819 4.337 1.00 0.00 O ATOM 274 OE2 GLU A 18 120.822 -21.234 5.925 1.00 0.00 O ATOM 0 H GLU A 18 121.183 -16.891 3.622 1.00 0.00 H new ATOM 0 HA GLU A 18 123.019 -18.696 2.327 1.00 0.00 H new ATOM 0 HB2 GLU A 18 120.026 -18.816 2.955 1.00 0.00 H new ATOM 0 HB3 GLU A 18 120.894 -20.165 2.250 1.00 0.00 H new ATOM 0 HG2 GLU A 18 122.481 -20.160 4.195 1.00 0.00 H new ATOM 0 HG3 GLU A 18 121.614 -18.810 4.899 1.00 0.00 H new ATOM 281 N ILE A 19 121.377 -16.962 0.290 1.00 0.00 N ATOM 282 CA ILE A 19 121.027 -16.810 -1.156 1.00 0.00 C ATOM 283 C ILE A 19 122.166 -17.354 -2.031 1.00 0.00 C ATOM 284 O ILE A 19 121.927 -18.053 -2.996 1.00 0.00 O ATOM 285 CB ILE A 19 120.775 -15.331 -1.483 1.00 0.00 C ATOM 286 CG1 ILE A 19 119.471 -14.886 -0.818 1.00 0.00 C ATOM 287 CG2 ILE A 19 120.648 -15.146 -2.999 1.00 0.00 C ATOM 288 CD1 ILE A 19 119.345 -13.358 -0.885 1.00 0.00 C ATOM 0 H ILE A 19 121.377 -16.101 0.837 1.00 0.00 H new ATOM 0 HA ILE A 19 120.119 -17.377 -1.362 1.00 0.00 H new ATOM 0 HB ILE A 19 121.609 -14.734 -1.114 1.00 0.00 H new ATOM 0 HG12 ILE A 19 118.621 -15.352 -1.317 1.00 0.00 H new ATOM 0 HG13 ILE A 19 119.451 -15.216 0.221 1.00 0.00 H new ATOM 0 HG21 ILE A 19 120.469 -14.094 -3.224 1.00 0.00 H new ATOM 0 HG22 ILE A 19 121.569 -15.469 -3.483 1.00 0.00 H new ATOM 0 HG23 ILE A 19 119.815 -15.743 -3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 19 118.414 -13.048 -0.410 1.00 0.00 H new ATOM 0 HD12 ILE A 19 120.187 -12.900 -0.366 1.00 0.00 H new ATOM 0 HD13 ILE A 19 119.344 -13.038 -1.927 1.00 0.00 H new ATOM 300 N ASN A 20 123.397 -17.050 -1.713 1.00 0.00 N ATOM 301 CA ASN A 20 124.517 -17.571 -2.548 1.00 0.00 C ATOM 302 C ASN A 20 125.851 -17.320 -1.841 1.00 0.00 C ATOM 303 O ASN A 20 125.904 -16.737 -0.777 1.00 0.00 O ATOM 304 CB ASN A 20 124.513 -16.869 -3.909 1.00 0.00 C ATOM 305 CG ASN A 20 124.761 -15.372 -3.722 1.00 0.00 C ATOM 306 OD1 ASN A 20 125.119 -14.932 -2.648 1.00 0.00 O ATOM 307 ND2 ASN A 20 124.583 -14.564 -4.731 1.00 0.00 N ATOM 0 H ASN A 20 123.673 -16.470 -0.920 1.00 0.00 H new ATOM 0 HA ASN A 20 124.387 -18.643 -2.695 1.00 0.00 H new ATOM 0 HB2 ASN A 20 125.283 -17.297 -4.551 1.00 0.00 H new ATOM 0 HB3 ASN A 20 123.557 -17.029 -4.408 1.00 0.00 H new ATOM 0 HD21 ASN A 20 124.745 -13.563 -4.618 1.00 0.00 H new ATOM 0 HD22 ASN A 20 124.282 -14.933 -5.633 1.00 0.00 H new ATOM 314 N ASP A 21 126.932 -17.775 -2.421 1.00 0.00 N ATOM 315 CA ASP A 21 128.272 -17.590 -1.786 1.00 0.00 C ATOM 316 C ASP A 21 128.954 -16.335 -2.335 1.00 0.00 C ATOM 317 O ASP A 21 130.154 -16.180 -2.228 1.00 0.00 O ATOM 318 CB ASP A 21 129.147 -18.809 -2.083 1.00 0.00 C ATOM 319 CG ASP A 21 128.618 -20.016 -1.308 1.00 0.00 C ATOM 320 OD1 ASP A 21 127.984 -19.808 -0.286 1.00 0.00 O ATOM 321 OD2 ASP A 21 128.860 -21.130 -1.744 1.00 0.00 O ATOM 0 H ASP A 21 126.944 -18.270 -3.313 1.00 0.00 H new ATOM 0 HA ASP A 21 128.139 -17.479 -0.710 1.00 0.00 H new ATOM 0 HB2 ASP A 21 129.144 -19.020 -3.152 1.00 0.00 H new ATOM 0 HB3 ASP A 21 130.180 -18.606 -1.801 1.00 0.00 H new ATOM 326 N ASP A 22 128.212 -15.433 -2.916 1.00 0.00 N ATOM 327 CA ASP A 22 128.854 -14.199 -3.450 1.00 0.00 C ATOM 328 C ASP A 22 129.612 -13.505 -2.295 1.00 0.00 C ATOM 329 O ASP A 22 128.998 -13.144 -1.311 1.00 0.00 O ATOM 330 CB ASP A 22 127.771 -13.250 -3.978 1.00 0.00 C ATOM 331 CG ASP A 22 127.277 -13.735 -5.342 1.00 0.00 C ATOM 332 OD1 ASP A 22 127.044 -14.925 -5.477 1.00 0.00 O ATOM 333 OD2 ASP A 22 127.139 -12.908 -6.228 1.00 0.00 O ATOM 0 H ASP A 22 127.202 -15.495 -3.043 1.00 0.00 H new ATOM 0 HA ASP A 22 129.540 -14.453 -4.258 1.00 0.00 H new ATOM 0 HB2 ASP A 22 126.939 -13.205 -3.275 1.00 0.00 H new ATOM 0 HB3 ASP A 22 128.170 -12.239 -4.064 1.00 0.00 H new ATOM 338 N PRO A 23 130.920 -13.308 -2.373 1.00 0.00 N ATOM 339 CA PRO A 23 131.636 -12.640 -1.250 1.00 0.00 C ATOM 340 C PRO A 23 131.103 -11.223 -0.996 1.00 0.00 C ATOM 341 O PRO A 23 130.902 -10.816 0.132 1.00 0.00 O ATOM 342 CB PRO A 23 133.103 -12.617 -1.731 1.00 0.00 C ATOM 343 CG PRO A 23 133.177 -13.275 -3.125 1.00 0.00 C ATOM 344 CD PRO A 23 131.760 -13.717 -3.539 1.00 0.00 C ATOM 0 HA PRO A 23 131.507 -13.157 -0.299 1.00 0.00 H new ATOM 0 HB2 PRO A 23 133.469 -11.591 -1.777 1.00 0.00 H new ATOM 0 HB3 PRO A 23 133.740 -13.152 -1.026 1.00 0.00 H new ATOM 0 HG2 PRO A 23 133.581 -12.572 -3.853 1.00 0.00 H new ATOM 0 HG3 PRO A 23 133.849 -14.133 -3.103 1.00 0.00 H new ATOM 0 HD2 PRO A 23 131.438 -13.228 -4.458 1.00 0.00 H new ATOM 0 HD3 PRO A 23 131.709 -14.791 -3.715 1.00 0.00 H new ATOM 352 N LYS A 24 130.887 -10.469 -2.037 1.00 0.00 N ATOM 353 CA LYS A 24 130.381 -9.080 -1.859 1.00 0.00 C ATOM 354 C LYS A 24 129.015 -9.100 -1.172 1.00 0.00 C ATOM 355 O LYS A 24 128.749 -8.310 -0.290 1.00 0.00 O ATOM 356 CB LYS A 24 130.240 -8.412 -3.227 1.00 0.00 C ATOM 357 CG LYS A 24 131.625 -8.140 -3.833 1.00 0.00 C ATOM 358 CD LYS A 24 132.260 -6.888 -3.211 1.00 0.00 C ATOM 359 CE LYS A 24 133.442 -6.442 -4.075 1.00 0.00 C ATOM 360 NZ LYS A 24 132.955 -6.117 -5.446 1.00 0.00 N ATOM 0 H LYS A 24 131.039 -10.755 -3.004 1.00 0.00 H new ATOM 0 HA LYS A 24 131.086 -8.524 -1.242 1.00 0.00 H new ATOM 0 HB2 LYS A 24 129.663 -9.052 -3.894 1.00 0.00 H new ATOM 0 HB3 LYS A 24 129.689 -7.477 -3.128 1.00 0.00 H new ATOM 0 HG2 LYS A 24 132.273 -9.001 -3.669 1.00 0.00 H new ATOM 0 HG3 LYS A 24 131.535 -8.009 -4.911 1.00 0.00 H new ATOM 0 HD2 LYS A 24 131.523 -6.088 -3.141 1.00 0.00 H new ATOM 0 HD3 LYS A 24 132.596 -7.102 -2.196 1.00 0.00 H new ATOM 0 HE2 LYS A 24 133.923 -5.570 -3.631 1.00 0.00 H new ATOM 0 HE3 LYS A 24 134.192 -7.231 -4.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 133.408 -5.241 -5.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 133.194 -6.896 -6.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 131.923 -5.987 -5.426 1.00 0.00 H new ATOM 374 N ARG A 25 128.140 -9.984 -1.567 1.00 0.00 N ATOM 375 CA ARG A 25 126.798 -10.019 -0.922 1.00 0.00 C ATOM 376 C ARG A 25 126.965 -10.286 0.571 1.00 0.00 C ATOM 377 O ARG A 25 126.430 -9.578 1.401 1.00 0.00 O ATOM 378 CB ARG A 25 125.956 -11.126 -1.554 1.00 0.00 C ATOM 379 CG ARG A 25 124.538 -11.082 -0.983 1.00 0.00 C ATOM 380 CD ARG A 25 123.661 -12.091 -1.725 1.00 0.00 C ATOM 381 NE ARG A 25 123.603 -11.728 -3.169 1.00 0.00 N ATOM 382 CZ ARG A 25 123.271 -10.517 -3.525 1.00 0.00 C ATOM 383 NH1 ARG A 25 122.140 -10.004 -3.123 1.00 0.00 N ATOM 384 NH2 ARG A 25 124.073 -9.817 -4.282 1.00 0.00 N ATOM 0 H ARG A 25 128.294 -10.676 -2.300 1.00 0.00 H new ATOM 0 HA ARG A 25 126.296 -9.062 -1.066 1.00 0.00 H new ATOM 0 HB2 ARG A 25 125.927 -11.001 -2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 25 126.408 -12.098 -1.357 1.00 0.00 H new ATOM 0 HG2 ARG A 25 124.556 -11.313 0.082 1.00 0.00 H new ATOM 0 HG3 ARG A 25 124.124 -10.079 -1.085 1.00 0.00 H new ATOM 0 HD2 ARG A 25 124.065 -13.097 -1.607 1.00 0.00 H new ATOM 0 HD3 ARG A 25 122.657 -12.099 -1.300 1.00 0.00 H new ATOM 0 HE ARG A 25 123.823 -12.426 -3.879 1.00 0.00 H new ATOM 0 HH11 ARG A 25 121.515 -10.550 -2.530 1.00 0.00 H new ATOM 0 HH12 ARG A 25 121.882 -9.057 -3.402 1.00 0.00 H new ATOM 0 HH21 ARG A 25 124.958 -10.217 -4.594 1.00 0.00 H new ATOM 0 HH22 ARG A 25 123.814 -8.871 -4.561 1.00 0.00 H new ATOM 398 N LYS A 26 127.718 -11.291 0.922 1.00 0.00 N ATOM 399 CA LYS A 26 127.931 -11.581 2.364 1.00 0.00 C ATOM 400 C LYS A 26 128.617 -10.374 3.009 1.00 0.00 C ATOM 401 O LYS A 26 128.197 -9.878 4.036 1.00 0.00 O ATOM 402 CB LYS A 26 128.813 -12.827 2.509 1.00 0.00 C ATOM 403 CG LYS A 26 129.032 -13.138 3.993 1.00 0.00 C ATOM 404 CD LYS A 26 129.901 -14.389 4.132 1.00 0.00 C ATOM 405 CE LYS A 26 130.021 -14.761 5.610 1.00 0.00 C ATOM 406 NZ LYS A 26 130.899 -15.957 5.752 1.00 0.00 N ATOM 0 H LYS A 26 128.192 -11.921 0.275 1.00 0.00 H new ATOM 0 HA LYS A 26 126.977 -11.766 2.857 1.00 0.00 H new ATOM 0 HB2 LYS A 26 128.342 -13.677 2.016 1.00 0.00 H new ATOM 0 HB3 LYS A 26 129.772 -12.664 2.017 1.00 0.00 H new ATOM 0 HG2 LYS A 26 129.513 -12.292 4.485 1.00 0.00 H new ATOM 0 HG3 LYS A 26 128.073 -13.292 4.488 1.00 0.00 H new ATOM 0 HD2 LYS A 26 129.462 -15.215 3.572 1.00 0.00 H new ATOM 0 HD3 LYS A 26 130.889 -14.208 3.710 1.00 0.00 H new ATOM 0 HE2 LYS A 26 130.434 -13.925 6.174 1.00 0.00 H new ATOM 0 HE3 LYS A 26 129.035 -14.969 6.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 130.981 -16.210 6.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 130.487 -16.754 5.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 131.843 -15.742 5.371 1.00 0.00 H new ATOM 420 N GLU A 27 129.675 -9.906 2.406 1.00 0.00 N ATOM 421 CA GLU A 27 130.412 -8.736 2.964 1.00 0.00 C ATOM 422 C GLU A 27 129.500 -7.507 2.988 1.00 0.00 C ATOM 423 O GLU A 27 129.454 -6.781 3.961 1.00 0.00 O ATOM 424 CB GLU A 27 131.643 -8.449 2.099 1.00 0.00 C ATOM 425 CG GLU A 27 132.446 -7.298 2.711 1.00 0.00 C ATOM 426 CD GLU A 27 133.701 -7.048 1.872 1.00 0.00 C ATOM 427 OE1 GLU A 27 133.978 -7.854 1.000 1.00 0.00 O ATOM 428 OE2 GLU A 27 134.367 -6.056 2.121 1.00 0.00 O ATOM 0 H GLU A 27 130.064 -10.287 1.543 1.00 0.00 H new ATOM 0 HA GLU A 27 130.728 -8.963 3.982 1.00 0.00 H new ATOM 0 HB2 GLU A 27 132.265 -9.341 2.027 1.00 0.00 H new ATOM 0 HB3 GLU A 27 131.335 -8.192 1.085 1.00 0.00 H new ATOM 0 HG2 GLU A 27 131.836 -6.395 2.750 1.00 0.00 H new ATOM 0 HG3 GLU A 27 132.724 -7.540 3.737 1.00 0.00 H new ATOM 435 N PHE A 28 128.772 -7.262 1.930 1.00 0.00 N ATOM 436 CA PHE A 28 127.873 -6.076 1.918 1.00 0.00 C ATOM 437 C PHE A 28 126.856 -6.197 3.057 1.00 0.00 C ATOM 438 O PHE A 28 126.647 -5.273 3.817 1.00 0.00 O ATOM 439 CB PHE A 28 127.126 -6.006 0.580 1.00 0.00 C ATOM 440 CG PHE A 28 126.050 -4.949 0.664 1.00 0.00 C ATOM 441 CD1 PHE A 28 124.789 -5.291 1.161 1.00 0.00 C ATOM 442 CD2 PHE A 28 126.316 -3.632 0.272 1.00 0.00 C ATOM 443 CE1 PHE A 28 123.791 -4.320 1.267 1.00 0.00 C ATOM 444 CE2 PHE A 28 125.316 -2.656 0.382 1.00 0.00 C ATOM 445 CZ PHE A 28 124.053 -3.003 0.880 1.00 0.00 C ATOM 0 H PHE A 28 128.762 -7.828 1.081 1.00 0.00 H new ATOM 0 HA PHE A 28 128.468 -5.172 2.049 1.00 0.00 H new ATOM 0 HB2 PHE A 28 127.821 -5.770 -0.226 1.00 0.00 H new ATOM 0 HB3 PHE A 28 126.683 -6.974 0.346 1.00 0.00 H new ATOM 0 HD1 PHE A 28 124.586 -6.308 1.463 1.00 0.00 H new ATOM 0 HD2 PHE A 28 127.289 -3.368 -0.114 1.00 0.00 H new ATOM 0 HE1 PHE A 28 122.816 -4.587 1.648 1.00 0.00 H new ATOM 0 HE2 PHE A 28 125.519 -1.638 0.083 1.00 0.00 H new ATOM 0 HZ PHE A 28 123.281 -2.252 0.965 1.00 0.00 H new ATOM 455 N LEU A 29 126.209 -7.323 3.168 1.00 0.00 N ATOM 456 CA LEU A 29 125.192 -7.490 4.242 1.00 0.00 C ATOM 457 C LEU A 29 125.850 -7.309 5.612 1.00 0.00 C ATOM 458 O LEU A 29 125.288 -6.700 6.501 1.00 0.00 O ATOM 459 CB LEU A 29 124.588 -8.896 4.149 1.00 0.00 C ATOM 460 CG LEU A 29 123.807 -9.055 2.833 1.00 0.00 C ATOM 461 CD1 LEU A 29 123.596 -10.542 2.542 1.00 0.00 C ATOM 462 CD2 LEU A 29 122.434 -8.381 2.940 1.00 0.00 C ATOM 0 H LEU A 29 126.340 -8.133 2.563 1.00 0.00 H new ATOM 0 HA LEU A 29 124.409 -6.742 4.119 1.00 0.00 H new ATOM 0 HB2 LEU A 29 125.379 -9.644 4.203 1.00 0.00 H new ATOM 0 HB3 LEU A 29 123.926 -9.072 4.997 1.00 0.00 H new ATOM 0 HG LEU A 29 124.380 -8.587 2.032 1.00 0.00 H new ATOM 0 HD11 LEU A 29 123.043 -10.655 1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 29 124.563 -11.036 2.452 1.00 0.00 H new ATOM 0 HD13 LEU A 29 123.031 -10.996 3.357 1.00 0.00 H new ATOM 0 HD21 LEU A 29 121.895 -8.503 2.001 1.00 0.00 H new ATOM 0 HD22 LEU A 29 121.865 -8.841 3.748 1.00 0.00 H new ATOM 0 HD23 LEU A 29 122.565 -7.319 3.148 1.00 0.00 H new ATOM 474 N ASP A 30 127.032 -7.825 5.797 1.00 0.00 N ATOM 475 CA ASP A 30 127.706 -7.664 7.116 1.00 0.00 C ATOM 476 C ASP A 30 127.897 -6.176 7.423 1.00 0.00 C ATOM 477 O ASP A 30 127.750 -5.740 8.547 1.00 0.00 O ATOM 478 CB ASP A 30 129.076 -8.349 7.085 1.00 0.00 C ATOM 479 CG ASP A 30 128.895 -9.866 7.035 1.00 0.00 C ATOM 480 OD1 ASP A 30 127.812 -10.326 7.359 1.00 0.00 O ATOM 481 OD2 ASP A 30 129.846 -10.545 6.682 1.00 0.00 O ATOM 0 H ASP A 30 127.559 -8.348 5.097 1.00 0.00 H new ATOM 0 HA ASP A 30 127.086 -8.120 7.888 1.00 0.00 H new ATOM 0 HB2 ASP A 30 129.642 -8.012 6.216 1.00 0.00 H new ATOM 0 HB3 ASP A 30 129.652 -8.071 7.968 1.00 0.00 H new ATOM 486 N ASP A 31 128.252 -5.397 6.436 1.00 0.00 N ATOM 487 CA ASP A 31 128.484 -3.942 6.676 1.00 0.00 C ATOM 488 C ASP A 31 127.162 -3.198 6.907 1.00 0.00 C ATOM 489 O ASP A 31 127.002 -2.497 7.887 1.00 0.00 O ATOM 490 CB ASP A 31 129.187 -3.344 5.455 1.00 0.00 C ATOM 491 CG ASP A 31 130.615 -3.888 5.372 1.00 0.00 C ATOM 492 OD1 ASP A 31 131.115 -4.345 6.386 1.00 0.00 O ATOM 493 OD2 ASP A 31 131.183 -3.843 4.292 1.00 0.00 O ATOM 0 H ASP A 31 128.391 -5.705 5.474 1.00 0.00 H new ATOM 0 HA ASP A 31 129.100 -3.833 7.569 1.00 0.00 H new ATOM 0 HB2 ASP A 31 128.638 -3.594 4.547 1.00 0.00 H new ATOM 0 HB3 ASP A 31 129.204 -2.257 5.528 1.00 0.00 H new ATOM 498 N LEU A 32 126.219 -3.321 6.009 1.00 0.00 N ATOM 499 CA LEU A 32 124.925 -2.593 6.184 1.00 0.00 C ATOM 500 C LEU A 32 124.230 -3.016 7.479 1.00 0.00 C ATOM 501 O LEU A 32 123.881 -2.191 8.299 1.00 0.00 O ATOM 502 CB LEU A 32 124.014 -2.870 4.969 1.00 0.00 C ATOM 503 CG LEU A 32 122.560 -2.447 5.253 1.00 0.00 C ATOM 504 CD1 LEU A 32 122.499 -0.966 5.633 1.00 0.00 C ATOM 505 CD2 LEU A 32 121.719 -2.683 4.000 1.00 0.00 C ATOM 0 H LEU A 32 126.287 -3.891 5.166 1.00 0.00 H new ATOM 0 HA LEU A 32 125.128 -1.524 6.249 1.00 0.00 H new ATOM 0 HB2 LEU A 32 124.389 -2.330 4.100 1.00 0.00 H new ATOM 0 HB3 LEU A 32 124.045 -3.931 4.723 1.00 0.00 H new ATOM 0 HG LEU A 32 122.172 -3.038 6.083 1.00 0.00 H new ATOM 0 HD11 LEU A 32 121.465 -0.683 5.830 1.00 0.00 H new ATOM 0 HD12 LEU A 32 123.099 -0.795 6.527 1.00 0.00 H new ATOM 0 HD13 LEU A 32 122.890 -0.364 4.813 1.00 0.00 H new ATOM 0 HD21 LEU A 32 120.688 -2.386 4.193 1.00 0.00 H new ATOM 0 HD22 LEU A 32 122.119 -2.092 3.176 1.00 0.00 H new ATOM 0 HD23 LEU A 32 121.749 -3.740 3.736 1.00 0.00 H new ATOM 517 N PHE A 33 123.996 -4.282 7.664 1.00 0.00 N ATOM 518 CA PHE A 33 123.291 -4.714 8.900 1.00 0.00 C ATOM 519 C PHE A 33 124.100 -4.296 10.129 1.00 0.00 C ATOM 520 O PHE A 33 123.548 -3.846 11.108 1.00 0.00 O ATOM 521 CB PHE A 33 123.107 -6.237 8.879 1.00 0.00 C ATOM 522 CG PHE A 33 121.945 -6.585 7.972 1.00 0.00 C ATOM 523 CD1 PHE A 33 122.088 -6.459 6.586 1.00 0.00 C ATOM 524 CD2 PHE A 33 120.725 -7.025 8.512 1.00 0.00 C ATOM 525 CE1 PHE A 33 121.021 -6.771 5.738 1.00 0.00 C ATOM 526 CE2 PHE A 33 119.658 -7.336 7.657 1.00 0.00 C ATOM 527 CZ PHE A 33 119.808 -7.209 6.275 1.00 0.00 C ATOM 0 H PHE A 33 124.258 -5.030 7.022 1.00 0.00 H new ATOM 0 HA PHE A 33 122.311 -4.238 8.946 1.00 0.00 H new ATOM 0 HB2 PHE A 33 124.018 -6.721 8.525 1.00 0.00 H new ATOM 0 HB3 PHE A 33 122.921 -6.607 9.887 1.00 0.00 H new ATOM 0 HD1 PHE A 33 123.025 -6.120 6.170 1.00 0.00 H new ATOM 0 HD2 PHE A 33 120.609 -7.123 9.581 1.00 0.00 H new ATOM 0 HE1 PHE A 33 121.135 -6.673 4.668 1.00 0.00 H new ATOM 0 HE2 PHE A 33 118.719 -7.674 8.068 1.00 0.00 H new ATOM 0 HZ PHE A 33 118.984 -7.450 5.619 1.00 0.00 H new ATOM 537 N SER A 34 125.397 -4.432 10.087 1.00 0.00 N ATOM 538 CA SER A 34 126.217 -4.035 11.268 1.00 0.00 C ATOM 539 C SER A 34 126.065 -2.532 11.544 1.00 0.00 C ATOM 540 O SER A 34 125.952 -2.110 12.674 1.00 0.00 O ATOM 541 CB SER A 34 127.688 -4.362 11.006 1.00 0.00 C ATOM 542 OG SER A 34 128.122 -3.682 9.836 1.00 0.00 O ATOM 0 H SER A 34 125.922 -4.798 9.293 1.00 0.00 H new ATOM 0 HA SER A 34 125.869 -4.590 12.139 1.00 0.00 H new ATOM 0 HB2 SER A 34 128.296 -4.063 11.860 1.00 0.00 H new ATOM 0 HB3 SER A 34 127.817 -5.437 10.884 1.00 0.00 H new ATOM 0 HG SER A 34 127.670 -4.059 9.052 1.00 0.00 H new ATOM 548 N PHE A 35 126.073 -1.713 10.530 1.00 0.00 N ATOM 549 CA PHE A 35 125.929 -0.248 10.777 1.00 0.00 C ATOM 550 C PHE A 35 124.590 0.051 11.464 1.00 0.00 C ATOM 551 O PHE A 35 124.545 0.640 12.526 1.00 0.00 O ATOM 552 CB PHE A 35 125.992 0.503 9.447 1.00 0.00 C ATOM 553 CG PHE A 35 125.839 1.981 9.705 1.00 0.00 C ATOM 554 CD1 PHE A 35 124.560 2.544 9.780 1.00 0.00 C ATOM 555 CD2 PHE A 35 126.970 2.787 9.882 1.00 0.00 C ATOM 556 CE1 PHE A 35 124.411 3.913 10.028 1.00 0.00 C ATOM 557 CE2 PHE A 35 126.822 4.157 10.131 1.00 0.00 C ATOM 558 CZ PHE A 35 125.542 4.720 10.204 1.00 0.00 C ATOM 0 H PHE A 35 126.172 -1.988 9.553 1.00 0.00 H new ATOM 0 HA PHE A 35 126.741 0.078 11.427 1.00 0.00 H new ATOM 0 HB2 PHE A 35 126.941 0.305 8.948 1.00 0.00 H new ATOM 0 HB3 PHE A 35 125.203 0.154 8.781 1.00 0.00 H new ATOM 0 HD1 PHE A 35 123.688 1.922 9.646 1.00 0.00 H new ATOM 0 HD2 PHE A 35 127.957 2.352 9.826 1.00 0.00 H new ATOM 0 HE1 PHE A 35 123.424 4.347 10.084 1.00 0.00 H new ATOM 0 HE2 PHE A 35 127.694 4.779 10.267 1.00 0.00 H new ATOM 0 HZ PHE A 35 125.427 5.777 10.396 1.00 0.00 H new ATOM 568 N MET A 36 123.499 -0.337 10.858 1.00 0.00 N ATOM 569 CA MET A 36 122.158 -0.064 11.466 1.00 0.00 C ATOM 570 C MET A 36 121.951 -0.924 12.719 1.00 0.00 C ATOM 571 O MET A 36 121.050 -0.694 13.499 1.00 0.00 O ATOM 572 CB MET A 36 121.054 -0.353 10.435 1.00 0.00 C ATOM 573 CG MET A 36 120.862 -1.867 10.253 1.00 0.00 C ATOM 574 SD MET A 36 119.807 -2.527 11.573 1.00 0.00 S ATOM 575 CE MET A 36 118.264 -1.694 11.120 1.00 0.00 C ATOM 0 H MET A 36 123.476 -0.832 9.967 1.00 0.00 H new ATOM 0 HA MET A 36 122.110 0.985 11.758 1.00 0.00 H new ATOM 0 HB2 MET A 36 120.118 0.101 10.761 1.00 0.00 H new ATOM 0 HB3 MET A 36 121.314 0.103 9.480 1.00 0.00 H new ATOM 0 HG2 MET A 36 120.411 -2.070 9.281 1.00 0.00 H new ATOM 0 HG3 MET A 36 121.830 -2.368 10.266 1.00 0.00 H new ATOM 0 HE1 MET A 36 117.426 -2.375 11.268 1.00 0.00 H new ATOM 0 HE2 MET A 36 118.130 -0.811 11.745 1.00 0.00 H new ATOM 0 HE3 MET A 36 118.306 -1.394 10.073 1.00 0.00 H new ATOM 585 N GLN A 37 122.767 -1.923 12.904 1.00 0.00 N ATOM 586 CA GLN A 37 122.609 -2.821 14.093 1.00 0.00 C ATOM 587 C GLN A 37 122.603 -1.999 15.380 1.00 0.00 C ATOM 588 O GLN A 37 122.339 -2.515 16.447 1.00 0.00 O ATOM 589 CB GLN A 37 123.753 -3.846 14.146 1.00 0.00 C ATOM 590 CG GLN A 37 123.661 -4.669 15.436 1.00 0.00 C ATOM 591 CD GLN A 37 124.497 -5.943 15.293 1.00 0.00 C ATOM 592 OE1 GLN A 37 124.681 -6.444 14.202 1.00 0.00 O ATOM 593 NE2 GLN A 37 125.020 -6.489 16.358 1.00 0.00 N ATOM 0 H GLN A 37 123.541 -2.161 12.284 1.00 0.00 H new ATOM 0 HA GLN A 37 121.660 -3.349 13.999 1.00 0.00 H new ATOM 0 HB2 GLN A 37 123.702 -4.506 13.280 1.00 0.00 H new ATOM 0 HB3 GLN A 37 124.714 -3.333 14.100 1.00 0.00 H new ATOM 0 HG2 GLN A 37 124.018 -4.080 16.281 1.00 0.00 H new ATOM 0 HG3 GLN A 37 122.622 -4.925 15.643 1.00 0.00 H new ATOM 0 HE21 GLN A 37 124.866 -6.069 17.275 1.00 0.00 H new ATOM 0 HE22 GLN A 37 125.583 -7.336 16.273 1.00 0.00 H new ATOM 602 N LYS A 38 122.899 -0.728 15.308 1.00 0.00 N ATOM 603 CA LYS A 38 122.913 0.088 16.556 1.00 0.00 C ATOM 604 C LYS A 38 121.627 -0.180 17.348 1.00 0.00 C ATOM 605 O LYS A 38 121.666 -0.418 18.538 1.00 0.00 O ATOM 606 CB LYS A 38 122.997 1.577 16.206 1.00 0.00 C ATOM 607 CG LYS A 38 123.110 2.394 17.499 1.00 0.00 C ATOM 608 CD LYS A 38 123.195 3.885 17.169 1.00 0.00 C ATOM 609 CE LYS A 38 123.304 4.687 18.469 1.00 0.00 C ATOM 610 NZ LYS A 38 124.548 4.303 19.195 1.00 0.00 N ATOM 0 H LYS A 38 123.129 -0.225 14.451 1.00 0.00 H new ATOM 0 HA LYS A 38 123.780 -0.186 17.157 1.00 0.00 H new ATOM 0 HB2 LYS A 38 123.860 1.764 15.567 1.00 0.00 H new ATOM 0 HB3 LYS A 38 122.113 1.881 15.646 1.00 0.00 H new ATOM 0 HG2 LYS A 38 122.247 2.203 18.137 1.00 0.00 H new ATOM 0 HG3 LYS A 38 123.994 2.086 18.058 1.00 0.00 H new ATOM 0 HD2 LYS A 38 124.060 4.080 16.535 1.00 0.00 H new ATOM 0 HD3 LYS A 38 122.313 4.196 16.609 1.00 0.00 H new ATOM 0 HE2 LYS A 38 123.315 5.754 18.249 1.00 0.00 H new ATOM 0 HE3 LYS A 38 122.433 4.500 19.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 124.810 5.059 19.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 124.385 3.421 19.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 125.319 4.161 18.512 1.00 0.00 H new ATOM 624 N ARG A 39 120.490 -0.173 16.704 1.00 0.00 N ATOM 625 CA ARG A 39 119.231 -0.464 17.449 1.00 0.00 C ATOM 626 C ARG A 39 119.289 -1.909 17.941 1.00 0.00 C ATOM 627 O ARG A 39 118.903 -2.212 19.053 1.00 0.00 O ATOM 628 CB ARG A 39 118.019 -0.284 16.538 1.00 0.00 C ATOM 629 CG ARG A 39 117.829 1.199 16.228 1.00 0.00 C ATOM 630 CD ARG A 39 116.514 1.387 15.475 1.00 0.00 C ATOM 631 NE ARG A 39 115.374 1.150 16.402 1.00 0.00 N ATOM 632 CZ ARG A 39 114.156 1.412 16.017 1.00 0.00 C ATOM 633 NH1 ARG A 39 113.949 2.240 15.029 1.00 0.00 N ATOM 634 NH2 ARG A 39 113.145 0.845 16.615 1.00 0.00 N ATOM 0 H ARG A 39 120.379 0.019 15.708 1.00 0.00 H new ATOM 0 HA ARG A 39 119.135 0.223 18.290 1.00 0.00 H new ATOM 0 HB2 ARG A 39 118.159 -0.844 15.614 1.00 0.00 H new ATOM 0 HB3 ARG A 39 117.126 -0.683 17.020 1.00 0.00 H new ATOM 0 HG2 ARG A 39 117.820 1.778 17.151 1.00 0.00 H new ATOM 0 HG3 ARG A 39 118.662 1.568 15.629 1.00 0.00 H new ATOM 0 HD2 ARG A 39 116.459 2.395 15.064 1.00 0.00 H new ATOM 0 HD3 ARG A 39 116.462 0.696 14.634 1.00 0.00 H new ATOM 0 HE ARG A 39 115.545 0.783 17.338 1.00 0.00 H new ATOM 0 HH11 ARG A 39 114.740 2.681 14.559 1.00 0.00 H new ATOM 0 HH12 ARG A 39 112.997 2.446 14.727 1.00 0.00 H new ATOM 0 HH21 ARG A 39 113.307 0.196 17.385 1.00 0.00 H new ATOM 0 HH22 ARG A 39 112.193 1.051 16.313 1.00 0.00 H new ATOM 648 N GLY A 40 119.795 -2.801 17.118 1.00 0.00 N ATOM 649 CA GLY A 40 119.918 -4.240 17.520 1.00 0.00 C ATOM 650 C GLY A 40 119.093 -5.148 16.599 1.00 0.00 C ATOM 651 O GLY A 40 119.246 -6.353 16.636 1.00 0.00 O ATOM 0 H GLY A 40 120.130 -2.591 16.178 1.00 0.00 H new ATOM 0 HA2 GLY A 40 120.965 -4.541 17.488 1.00 0.00 H new ATOM 0 HA3 GLY A 40 119.583 -4.362 18.550 1.00 0.00 H new ATOM 655 N THR A 41 118.219 -4.601 15.777 1.00 0.00 N ATOM 656 CA THR A 41 117.390 -5.470 14.865 1.00 0.00 C ATOM 657 C THR A 41 117.863 -5.308 13.408 1.00 0.00 C ATOM 658 O THR A 41 118.368 -4.269 13.038 1.00 0.00 O ATOM 659 CB THR A 41 115.909 -5.066 14.983 1.00 0.00 C ATOM 660 OG1 THR A 41 115.818 -3.659 15.155 1.00 0.00 O ATOM 661 CG2 THR A 41 115.273 -5.770 16.186 1.00 0.00 C ATOM 0 H THR A 41 118.044 -3.599 15.698 1.00 0.00 H new ATOM 0 HA THR A 41 117.506 -6.514 15.157 1.00 0.00 H new ATOM 0 HB THR A 41 115.381 -5.360 14.076 1.00 0.00 H new ATOM 0 HG1 THR A 41 114.876 -3.399 15.229 1.00 0.00 H new ATOM 0 HG21 THR A 41 114.225 -5.481 16.265 1.00 0.00 H new ATOM 0 HG22 THR A 41 115.342 -6.850 16.054 1.00 0.00 H new ATOM 0 HG23 THR A 41 115.799 -5.481 17.096 1.00 0.00 H new ATOM 669 N PRO A 42 117.715 -6.333 12.583 1.00 0.00 N ATOM 670 CA PRO A 42 118.166 -6.249 11.165 1.00 0.00 C ATOM 671 C PRO A 42 117.547 -5.058 10.404 1.00 0.00 C ATOM 672 O PRO A 42 118.221 -4.102 10.082 1.00 0.00 O ATOM 673 CB PRO A 42 117.699 -7.599 10.575 1.00 0.00 C ATOM 674 CG PRO A 42 116.960 -8.391 11.671 1.00 0.00 C ATOM 675 CD PRO A 42 117.105 -7.635 12.999 1.00 0.00 C ATOM 0 HA PRO A 42 119.240 -6.080 11.083 1.00 0.00 H new ATOM 0 HB2 PRO A 42 117.041 -7.431 9.722 1.00 0.00 H new ATOM 0 HB3 PRO A 42 118.554 -8.168 10.210 1.00 0.00 H new ATOM 0 HG2 PRO A 42 115.907 -8.504 11.412 1.00 0.00 H new ATOM 0 HG3 PRO A 42 117.376 -9.395 11.759 1.00 0.00 H new ATOM 0 HD2 PRO A 42 116.142 -7.491 13.488 1.00 0.00 H new ATOM 0 HD3 PRO A 42 117.742 -8.172 13.701 1.00 0.00 H new ATOM 683 N ILE A 43 116.274 -5.116 10.107 1.00 0.00 N ATOM 684 CA ILE A 43 115.615 -3.994 9.365 1.00 0.00 C ATOM 685 C ILE A 43 114.132 -3.943 9.759 1.00 0.00 C ATOM 686 O ILE A 43 113.776 -4.235 10.883 1.00 0.00 O ATOM 687 CB ILE A 43 115.786 -4.205 7.839 1.00 0.00 C ATOM 688 CG1 ILE A 43 115.610 -2.846 7.098 1.00 0.00 C ATOM 689 CG2 ILE A 43 114.771 -5.250 7.304 1.00 0.00 C ATOM 690 CD1 ILE A 43 116.953 -2.119 6.982 1.00 0.00 C ATOM 0 H ILE A 43 115.659 -5.894 10.346 1.00 0.00 H new ATOM 0 HA ILE A 43 116.079 -3.043 9.625 1.00 0.00 H new ATOM 0 HB ILE A 43 116.789 -4.588 7.651 1.00 0.00 H new ATOM 0 HG12 ILE A 43 115.196 -3.018 6.104 1.00 0.00 H new ATOM 0 HG13 ILE A 43 114.897 -2.221 7.636 1.00 0.00 H new ATOM 0 HG21 ILE A 43 114.913 -5.379 6.231 1.00 0.00 H new ATOM 0 HG22 ILE A 43 114.930 -6.203 7.808 1.00 0.00 H new ATOM 0 HG23 ILE A 43 113.756 -4.903 7.497 1.00 0.00 H new ATOM 0 HD11 ILE A 43 116.810 -1.172 6.462 1.00 0.00 H new ATOM 0 HD12 ILE A 43 117.351 -1.929 7.979 1.00 0.00 H new ATOM 0 HD13 ILE A 43 117.655 -2.738 6.423 1.00 0.00 H new ATOM 702 N ASN A 44 113.264 -3.579 8.855 1.00 0.00 N ATOM 703 CA ASN A 44 111.811 -3.516 9.195 1.00 0.00 C ATOM 704 C ASN A 44 111.160 -4.871 8.906 1.00 0.00 C ATOM 705 O ASN A 44 110.940 -5.660 9.803 1.00 0.00 O ATOM 706 CB ASN A 44 111.135 -2.435 8.347 1.00 0.00 C ATOM 707 CG ASN A 44 111.521 -1.051 8.873 1.00 0.00 C ATOM 708 OD1 ASN A 44 112.647 -0.623 8.720 1.00 0.00 O ATOM 709 ND2 ASN A 44 110.625 -0.326 9.488 1.00 0.00 N ATOM 0 H ASN A 44 113.496 -3.322 7.896 1.00 0.00 H new ATOM 0 HA ASN A 44 111.695 -3.275 10.252 1.00 0.00 H new ATOM 0 HB2 ASN A 44 111.437 -2.536 7.304 1.00 0.00 H new ATOM 0 HB3 ASN A 44 110.052 -2.558 8.379 1.00 0.00 H new ATOM 0 HD21 ASN A 44 110.871 0.599 9.839 1.00 0.00 H new ATOM 0 HD22 ASN A 44 109.679 -0.685 9.617 1.00 0.00 H new ATOM 716 N ARG A 45 110.840 -5.148 7.664 1.00 0.00 N ATOM 717 CA ARG A 45 110.193 -6.456 7.326 1.00 0.00 C ATOM 718 C ARG A 45 110.761 -7.011 6.015 1.00 0.00 C ATOM 719 O ARG A 45 111.094 -6.275 5.107 1.00 0.00 O ATOM 720 CB ARG A 45 108.688 -6.237 7.170 1.00 0.00 C ATOM 721 CG ARG A 45 108.075 -5.939 8.539 1.00 0.00 C ATOM 722 CD ARG A 45 106.570 -5.715 8.384 1.00 0.00 C ATOM 723 NE ARG A 45 106.341 -4.531 7.508 1.00 0.00 N ATOM 724 CZ ARG A 45 105.143 -4.266 7.069 1.00 0.00 C ATOM 725 NH1 ARG A 45 104.123 -4.323 7.881 1.00 0.00 N ATOM 726 NH2 ARG A 45 104.964 -3.940 5.818 1.00 0.00 N ATOM 0 H ARG A 45 110.999 -4.526 6.871 1.00 0.00 H new ATOM 0 HA ARG A 45 110.392 -7.170 8.125 1.00 0.00 H new ATOM 0 HB2 ARG A 45 108.498 -5.410 6.486 1.00 0.00 H new ATOM 0 HB3 ARG A 45 108.223 -7.122 6.736 1.00 0.00 H new ATOM 0 HG2 ARG A 45 108.262 -6.768 9.222 1.00 0.00 H new ATOM 0 HG3 ARG A 45 108.542 -5.056 8.974 1.00 0.00 H new ATOM 0 HD2 ARG A 45 106.101 -6.599 7.952 1.00 0.00 H new ATOM 0 HD3 ARG A 45 106.111 -5.555 9.360 1.00 0.00 H new ATOM 0 HE ARG A 45 107.123 -3.928 7.252 1.00 0.00 H new ATOM 0 HH11 ARG A 45 104.263 -4.575 8.859 1.00 0.00 H new ATOM 0 HH12 ARG A 45 103.185 -4.116 7.537 1.00 0.00 H new ATOM 0 HH21 ARG A 45 105.762 -3.893 5.184 1.00 0.00 H new ATOM 0 HH22 ARG A 45 104.026 -3.733 5.474 1.00 0.00 H new ATOM 740 N LEU A 46 110.853 -8.314 5.913 1.00 0.00 N ATOM 741 CA LEU A 46 111.374 -8.963 4.668 1.00 0.00 C ATOM 742 C LEU A 46 110.388 -10.065 4.251 1.00 0.00 C ATOM 743 O LEU A 46 110.611 -11.227 4.527 1.00 0.00 O ATOM 744 CB LEU A 46 112.740 -9.600 4.956 1.00 0.00 C ATOM 745 CG LEU A 46 113.738 -8.528 5.429 1.00 0.00 C ATOM 746 CD1 LEU A 46 114.904 -9.202 6.157 1.00 0.00 C ATOM 747 CD2 LEU A 46 114.287 -7.745 4.228 1.00 0.00 C ATOM 0 H LEU A 46 110.585 -8.966 6.651 1.00 0.00 H new ATOM 0 HA LEU A 46 111.479 -8.222 3.876 1.00 0.00 H new ATOM 0 HB2 LEU A 46 112.636 -10.372 5.719 1.00 0.00 H new ATOM 0 HB3 LEU A 46 113.118 -10.088 4.058 1.00 0.00 H new ATOM 0 HG LEU A 46 113.223 -7.842 6.101 1.00 0.00 H new ATOM 0 HD11 LEU A 46 115.611 -8.443 6.492 1.00 0.00 H new ATOM 0 HD12 LEU A 46 114.526 -9.752 7.019 1.00 0.00 H new ATOM 0 HD13 LEU A 46 115.406 -9.892 5.479 1.00 0.00 H new ATOM 0 HD21 LEU A 46 114.992 -6.990 4.577 1.00 0.00 H new ATOM 0 HD22 LEU A 46 114.795 -8.430 3.549 1.00 0.00 H new ATOM 0 HD23 LEU A 46 113.464 -7.259 3.704 1.00 0.00 H new ATOM 759 N PRO A 47 109.293 -9.716 3.612 1.00 0.00 N ATOM 760 CA PRO A 47 108.286 -10.737 3.204 1.00 0.00 C ATOM 761 C PRO A 47 108.830 -11.728 2.160 1.00 0.00 C ATOM 762 O PRO A 47 109.923 -11.578 1.648 1.00 0.00 O ATOM 763 CB PRO A 47 107.133 -9.875 2.644 1.00 0.00 C ATOM 764 CG PRO A 47 107.528 -8.386 2.765 1.00 0.00 C ATOM 765 CD PRO A 47 108.986 -8.304 3.251 1.00 0.00 C ATOM 0 HA PRO A 47 107.982 -11.381 4.029 1.00 0.00 H new ATOM 0 HB2 PRO A 47 106.940 -10.132 1.602 1.00 0.00 H new ATOM 0 HB3 PRO A 47 106.213 -10.069 3.196 1.00 0.00 H new ATOM 0 HG2 PRO A 47 107.421 -7.887 1.802 1.00 0.00 H new ATOM 0 HG3 PRO A 47 106.867 -7.875 3.464 1.00 0.00 H new ATOM 0 HD2 PRO A 47 109.652 -7.932 2.472 1.00 0.00 H new ATOM 0 HD3 PRO A 47 109.090 -7.636 4.106 1.00 0.00 H new ATOM 773 N ILE A 48 108.058 -12.741 1.852 1.00 0.00 N ATOM 774 CA ILE A 48 108.484 -13.767 0.855 1.00 0.00 C ATOM 775 C ILE A 48 107.596 -13.634 -0.381 1.00 0.00 C ATOM 776 O ILE A 48 106.388 -13.565 -0.277 1.00 0.00 O ATOM 777 CB ILE A 48 108.291 -15.159 1.457 1.00 0.00 C ATOM 778 CG1 ILE A 48 108.946 -15.222 2.846 1.00 0.00 C ATOM 779 CG2 ILE A 48 108.922 -16.208 0.538 1.00 0.00 C ATOM 780 CD1 ILE A 48 110.413 -14.781 2.773 1.00 0.00 C ATOM 0 H ILE A 48 107.136 -12.901 2.257 1.00 0.00 H new ATOM 0 HA ILE A 48 109.531 -13.623 0.589 1.00 0.00 H new ATOM 0 HB ILE A 48 107.225 -15.363 1.557 1.00 0.00 H new ATOM 0 HG12 ILE A 48 108.402 -14.581 3.540 1.00 0.00 H new ATOM 0 HG13 ILE A 48 108.885 -16.238 3.237 1.00 0.00 H new ATOM 0 HG21 ILE A 48 108.783 -17.200 0.969 1.00 0.00 H new ATOM 0 HG22 ILE A 48 108.445 -16.168 -0.441 1.00 0.00 H new ATOM 0 HG23 ILE A 48 109.987 -16.004 0.431 1.00 0.00 H new ATOM 0 HD11 ILE A 48 110.858 -14.833 3.767 1.00 0.00 H new ATOM 0 HD12 ILE A 48 110.958 -15.440 2.096 1.00 0.00 H new ATOM 0 HD13 ILE A 48 110.467 -13.757 2.404 1.00 0.00 H new ATOM 792 N MET A 49 108.182 -13.583 -1.548 1.00 0.00 N ATOM 793 CA MET A 49 107.366 -13.436 -2.798 1.00 0.00 C ATOM 794 C MET A 49 107.889 -14.356 -3.911 1.00 0.00 C ATOM 795 O MET A 49 109.075 -14.467 -4.146 1.00 0.00 O ATOM 796 CB MET A 49 107.445 -11.982 -3.272 1.00 0.00 C ATOM 797 CG MET A 49 108.901 -11.622 -3.578 1.00 0.00 C ATOM 798 SD MET A 49 109.046 -9.834 -3.832 1.00 0.00 S ATOM 799 CE MET A 49 108.631 -9.808 -5.594 1.00 0.00 C ATOM 0 H MET A 49 109.190 -13.636 -1.694 1.00 0.00 H new ATOM 0 HA MET A 49 106.335 -13.714 -2.577 1.00 0.00 H new ATOM 0 HB2 MET A 49 106.831 -11.845 -4.162 1.00 0.00 H new ATOM 0 HB3 MET A 49 107.048 -11.317 -2.505 1.00 0.00 H new ATOM 0 HG2 MET A 49 109.544 -11.936 -2.756 1.00 0.00 H new ATOM 0 HG3 MET A 49 109.238 -12.154 -4.467 1.00 0.00 H new ATOM 0 HE1 MET A 49 108.662 -8.782 -5.960 1.00 0.00 H new ATOM 0 HE2 MET A 49 109.351 -10.412 -6.146 1.00 0.00 H new ATOM 0 HE3 MET A 49 107.630 -10.214 -5.738 1.00 0.00 H new ATOM 809 N ALA A 50 106.984 -14.995 -4.606 1.00 0.00 N ATOM 810 CA ALA A 50 107.361 -15.899 -5.737 1.00 0.00 C ATOM 811 C ALA A 50 108.392 -16.929 -5.295 1.00 0.00 C ATOM 812 O ALA A 50 109.397 -17.108 -5.952 1.00 0.00 O ATOM 813 CB ALA A 50 107.965 -15.082 -6.875 1.00 0.00 C ATOM 0 H ALA A 50 105.981 -14.928 -4.435 1.00 0.00 H new ATOM 0 HA ALA A 50 106.457 -16.410 -6.068 1.00 0.00 H new ATOM 0 HB1 ALA A 50 108.237 -15.746 -7.695 1.00 0.00 H new ATOM 0 HB2 ALA A 50 107.235 -14.352 -7.226 1.00 0.00 H new ATOM 0 HB3 ALA A 50 108.854 -14.563 -6.518 1.00 0.00 H new ATOM 819 N LYS A 51 108.176 -17.600 -4.202 1.00 0.00 N ATOM 820 CA LYS A 51 109.174 -18.612 -3.752 1.00 0.00 C ATOM 821 C LYS A 51 110.531 -17.930 -3.540 1.00 0.00 C ATOM 822 O LYS A 51 111.468 -18.527 -3.050 1.00 0.00 O ATOM 823 CB LYS A 51 109.308 -19.694 -4.828 1.00 0.00 C ATOM 824 CG LYS A 51 110.011 -20.923 -4.238 1.00 0.00 C ATOM 825 CD LYS A 51 110.063 -22.052 -5.281 1.00 0.00 C ATOM 826 CE LYS A 51 111.232 -21.825 -6.248 1.00 0.00 C ATOM 827 NZ LYS A 51 111.334 -22.982 -7.182 1.00 0.00 N ATOM 0 H LYS A 51 107.358 -17.495 -3.602 1.00 0.00 H new ATOM 0 HA LYS A 51 108.846 -19.063 -2.815 1.00 0.00 H new ATOM 0 HB2 LYS A 51 108.323 -19.971 -5.204 1.00 0.00 H new ATOM 0 HB3 LYS A 51 109.876 -19.310 -5.675 1.00 0.00 H new ATOM 0 HG2 LYS A 51 111.021 -20.659 -3.926 1.00 0.00 H new ATOM 0 HG3 LYS A 51 109.481 -21.263 -3.348 1.00 0.00 H new ATOM 0 HD2 LYS A 51 110.176 -23.014 -4.781 1.00 0.00 H new ATOM 0 HD3 LYS A 51 109.125 -22.089 -5.835 1.00 0.00 H new ATOM 0 HE2 LYS A 51 111.080 -20.903 -6.809 1.00 0.00 H new ATOM 0 HE3 LYS A 51 112.162 -21.710 -5.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 112.126 -22.830 -7.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 111.497 -23.854 -6.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 110.450 -23.071 -7.722 1.00 0.00 H new ATOM 841 N SER A 52 110.636 -16.675 -3.898 1.00 0.00 N ATOM 842 CA SER A 52 111.909 -15.930 -3.718 1.00 0.00 C ATOM 843 C SER A 52 111.763 -15.052 -2.483 1.00 0.00 C ATOM 844 O SER A 52 110.698 -14.965 -1.905 1.00 0.00 O ATOM 845 CB SER A 52 112.167 -15.051 -4.943 1.00 0.00 C ATOM 846 OG SER A 52 111.337 -13.899 -4.878 1.00 0.00 O ATOM 0 H SER A 52 109.879 -16.131 -4.313 1.00 0.00 H new ATOM 0 HA SER A 52 112.743 -16.622 -3.600 1.00 0.00 H new ATOM 0 HB2 SER A 52 113.216 -14.756 -4.979 1.00 0.00 H new ATOM 0 HB3 SER A 52 111.962 -15.610 -5.856 1.00 0.00 H new ATOM 0 HG SER A 52 110.396 -14.172 -4.901 1.00 0.00 H new ATOM 852 N VAL A 53 112.819 -14.407 -2.069 1.00 0.00 N ATOM 853 CA VAL A 53 112.751 -13.530 -0.860 1.00 0.00 C ATOM 854 C VAL A 53 113.150 -12.112 -1.248 1.00 0.00 C ATOM 855 O VAL A 53 114.087 -11.901 -1.991 1.00 0.00 O ATOM 856 CB VAL A 53 113.695 -14.091 0.203 1.00 0.00 C ATOM 857 CG1 VAL A 53 113.536 -13.286 1.499 1.00 0.00 C ATOM 858 CG2 VAL A 53 113.353 -15.584 0.441 1.00 0.00 C ATOM 0 H VAL A 53 113.734 -14.449 -2.518 1.00 0.00 H new ATOM 0 HA VAL A 53 111.738 -13.505 -0.457 1.00 0.00 H new ATOM 0 HB VAL A 53 114.730 -14.013 -0.130 1.00 0.00 H new ATOM 0 HG11 VAL A 53 114.208 -13.684 2.259 1.00 0.00 H new ATOM 0 HG12 VAL A 53 113.780 -12.241 1.310 1.00 0.00 H new ATOM 0 HG13 VAL A 53 112.507 -13.361 1.850 1.00 0.00 H new ATOM 0 HG21 VAL A 53 114.021 -15.994 1.198 1.00 0.00 H new ATOM 0 HG22 VAL A 53 112.321 -15.671 0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 53 113.476 -16.138 -0.490 1.00 0.00 H new ATOM 868 N LEU A 54 112.426 -11.133 -0.778 1.00 0.00 N ATOM 869 CA LEU A 54 112.749 -9.733 -1.156 1.00 0.00 C ATOM 870 C LEU A 54 114.159 -9.383 -0.676 1.00 0.00 C ATOM 871 O LEU A 54 114.359 -8.940 0.438 1.00 0.00 O ATOM 872 CB LEU A 54 111.736 -8.787 -0.502 1.00 0.00 C ATOM 873 CG LEU A 54 111.948 -7.350 -1.006 1.00 0.00 C ATOM 874 CD1 LEU A 54 111.582 -7.244 -2.499 1.00 0.00 C ATOM 875 CD2 LEU A 54 111.062 -6.400 -0.190 1.00 0.00 C ATOM 0 H LEU A 54 111.629 -11.244 -0.151 1.00 0.00 H new ATOM 0 HA LEU A 54 112.702 -9.628 -2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 54 110.722 -9.114 -0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 54 111.845 -8.820 0.582 1.00 0.00 H new ATOM 0 HG LEU A 54 112.997 -7.079 -0.886 1.00 0.00 H new ATOM 0 HD11 LEU A 54 111.738 -6.220 -2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 54 112.213 -7.919 -3.077 1.00 0.00 H new ATOM 0 HD13 LEU A 54 110.536 -7.517 -2.637 1.00 0.00 H new ATOM 0 HD21 LEU A 54 111.205 -5.378 -0.540 1.00 0.00 H new ATOM 0 HD22 LEU A 54 110.016 -6.682 -0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 54 111.334 -6.464 0.864 1.00 0.00 H new ATOM 887 N ASP A 55 115.133 -9.563 -1.524 1.00 0.00 N ATOM 888 CA ASP A 55 116.532 -9.227 -1.144 1.00 0.00 C ATOM 889 C ASP A 55 116.685 -7.704 -1.092 1.00 0.00 C ATOM 890 O ASP A 55 116.476 -7.024 -2.077 1.00 0.00 O ATOM 891 CB ASP A 55 117.492 -9.796 -2.192 1.00 0.00 C ATOM 892 CG ASP A 55 118.935 -9.597 -1.723 1.00 0.00 C ATOM 893 OD1 ASP A 55 119.136 -8.830 -0.796 1.00 0.00 O ATOM 894 OD2 ASP A 55 119.814 -10.217 -2.298 1.00 0.00 O ATOM 0 H ASP A 55 115.019 -9.930 -2.469 1.00 0.00 H new ATOM 0 HA ASP A 55 116.762 -9.655 -0.168 1.00 0.00 H new ATOM 0 HB2 ASP A 55 117.292 -10.856 -2.347 1.00 0.00 H new ATOM 0 HB3 ASP A 55 117.338 -9.299 -3.150 1.00 0.00 H new ATOM 899 N LEU A 56 117.062 -7.156 0.029 1.00 0.00 N ATOM 900 CA LEU A 56 117.236 -5.675 0.097 1.00 0.00 C ATOM 901 C LEU A 56 118.232 -5.249 -0.978 1.00 0.00 C ATOM 902 O LEU A 56 118.090 -4.216 -1.601 1.00 0.00 O ATOM 903 CB LEU A 56 117.775 -5.265 1.472 1.00 0.00 C ATOM 904 CG LEU A 56 116.674 -5.355 2.538 1.00 0.00 C ATOM 905 CD1 LEU A 56 117.314 -5.183 3.918 1.00 0.00 C ATOM 906 CD2 LEU A 56 115.617 -4.250 2.321 1.00 0.00 C ATOM 0 H LEU A 56 117.256 -7.661 0.894 1.00 0.00 H new ATOM 0 HA LEU A 56 116.272 -5.191 -0.063 1.00 0.00 H new ATOM 0 HB2 LEU A 56 118.609 -5.911 1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 56 118.162 -4.247 1.427 1.00 0.00 H new ATOM 0 HG LEU A 56 116.181 -6.324 2.465 1.00 0.00 H new ATOM 0 HD11 LEU A 56 116.544 -5.245 4.687 1.00 0.00 H new ATOM 0 HD12 LEU A 56 118.050 -5.971 4.078 1.00 0.00 H new ATOM 0 HD13 LEU A 56 117.804 -4.211 3.973 1.00 0.00 H new ATOM 0 HD21 LEU A 56 114.845 -4.330 3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 56 116.094 -3.272 2.388 1.00 0.00 H new ATOM 0 HD23 LEU A 56 115.165 -4.367 1.336 1.00 0.00 H new ATOM 918 N TYR A 57 119.248 -6.036 -1.189 1.00 0.00 N ATOM 919 CA TYR A 57 120.269 -5.683 -2.211 1.00 0.00 C ATOM 920 C TYR A 57 119.558 -5.308 -3.523 1.00 0.00 C ATOM 921 O TYR A 57 119.934 -4.372 -4.199 1.00 0.00 O ATOM 922 CB TYR A 57 121.190 -6.908 -2.426 1.00 0.00 C ATOM 923 CG TYR A 57 122.593 -6.465 -2.803 1.00 0.00 C ATOM 924 CD1 TYR A 57 122.797 -5.637 -3.914 1.00 0.00 C ATOM 925 CD2 TYR A 57 123.691 -6.881 -2.036 1.00 0.00 C ATOM 926 CE1 TYR A 57 124.085 -5.225 -4.255 1.00 0.00 C ATOM 927 CE2 TYR A 57 124.985 -6.468 -2.378 1.00 0.00 C ATOM 928 CZ TYR A 57 125.181 -5.637 -3.488 1.00 0.00 C ATOM 929 OH TYR A 57 126.454 -5.226 -3.827 1.00 0.00 O ATOM 0 H TYR A 57 119.416 -6.913 -0.695 1.00 0.00 H new ATOM 0 HA TYR A 57 120.868 -4.834 -1.882 1.00 0.00 H new ATOM 0 HB2 TYR A 57 121.225 -7.507 -1.516 1.00 0.00 H new ATOM 0 HB3 TYR A 57 120.781 -7.544 -3.211 1.00 0.00 H new ATOM 0 HD1 TYR A 57 121.954 -5.317 -4.509 1.00 0.00 H new ATOM 0 HD2 TYR A 57 123.538 -7.521 -1.180 1.00 0.00 H new ATOM 0 HE1 TYR A 57 124.237 -4.587 -5.113 1.00 0.00 H new ATOM 0 HE2 TYR A 57 125.830 -6.790 -1.787 1.00 0.00 H new ATOM 0 HH TYR A 57 127.099 -5.601 -3.191 1.00 0.00 H new ATOM 939 N GLU A 58 118.528 -6.023 -3.886 1.00 0.00 N ATOM 940 CA GLU A 58 117.821 -5.693 -5.156 1.00 0.00 C ATOM 941 C GLU A 58 117.280 -4.262 -5.085 1.00 0.00 C ATOM 942 O GLU A 58 117.409 -3.500 -6.021 1.00 0.00 O ATOM 943 CB GLU A 58 116.666 -6.675 -5.369 1.00 0.00 C ATOM 944 CG GLU A 58 116.019 -6.412 -6.731 1.00 0.00 C ATOM 945 CD GLU A 58 114.909 -7.436 -6.979 1.00 0.00 C ATOM 946 OE1 GLU A 58 114.809 -8.371 -6.204 1.00 0.00 O ATOM 947 OE2 GLU A 58 114.182 -7.268 -7.945 1.00 0.00 O ATOM 0 H GLU A 58 118.149 -6.813 -3.364 1.00 0.00 H new ATOM 0 HA GLU A 58 118.517 -5.772 -5.991 1.00 0.00 H new ATOM 0 HB2 GLU A 58 117.032 -7.700 -5.320 1.00 0.00 H new ATOM 0 HB3 GLU A 58 115.927 -6.562 -4.575 1.00 0.00 H new ATOM 0 HG2 GLU A 58 115.609 -5.402 -6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 58 116.769 -6.476 -7.519 1.00 0.00 H new ATOM 954 N LEU A 59 116.692 -3.877 -3.984 1.00 0.00 N ATOM 955 CA LEU A 59 116.171 -2.483 -3.877 1.00 0.00 C ATOM 956 C LEU A 59 117.332 -1.502 -4.055 1.00 0.00 C ATOM 957 O LEU A 59 117.231 -0.528 -4.774 1.00 0.00 O ATOM 958 CB LEU A 59 115.519 -2.267 -2.496 1.00 0.00 C ATOM 959 CG LEU A 59 114.989 -0.823 -2.357 1.00 0.00 C ATOM 960 CD1 LEU A 59 113.846 -0.576 -3.352 1.00 0.00 C ATOM 961 CD2 LEU A 59 114.475 -0.602 -0.927 1.00 0.00 C ATOM 0 H LEU A 59 116.551 -4.462 -3.160 1.00 0.00 H new ATOM 0 HA LEU A 59 115.422 -2.315 -4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 59 114.700 -2.974 -2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 59 116.247 -2.469 -1.710 1.00 0.00 H new ATOM 0 HG LEU A 59 115.801 -0.128 -2.570 1.00 0.00 H new ATOM 0 HD11 LEU A 59 113.483 0.446 -3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 59 114.210 -0.725 -4.369 1.00 0.00 H new ATOM 0 HD13 LEU A 59 113.033 -1.274 -3.152 1.00 0.00 H new ATOM 0 HD21 LEU A 59 114.101 0.417 -0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 59 113.670 -1.306 -0.717 1.00 0.00 H new ATOM 0 HD23 LEU A 59 115.289 -0.760 -0.219 1.00 0.00 H new ATOM 973 N TYR A 60 118.428 -1.736 -3.383 1.00 0.00 N ATOM 974 CA TYR A 60 119.581 -0.799 -3.490 1.00 0.00 C ATOM 975 C TYR A 60 120.084 -0.698 -4.940 1.00 0.00 C ATOM 976 O TYR A 60 120.271 0.387 -5.454 1.00 0.00 O ATOM 977 CB TYR A 60 120.723 -1.266 -2.585 1.00 0.00 C ATOM 978 CG TYR A 60 121.762 -0.174 -2.542 1.00 0.00 C ATOM 979 CD1 TYR A 60 121.442 1.057 -1.957 1.00 0.00 C ATOM 980 CD2 TYR A 60 123.022 -0.368 -3.118 1.00 0.00 C ATOM 981 CE1 TYR A 60 122.373 2.087 -1.951 1.00 0.00 C ATOM 982 CE2 TYR A 60 123.962 0.668 -3.100 1.00 0.00 C ATOM 983 CZ TYR A 60 123.634 1.895 -2.518 1.00 0.00 C ATOM 984 OH TYR A 60 124.541 2.927 -2.512 1.00 0.00 O ATOM 0 H TYR A 60 118.573 -2.535 -2.766 1.00 0.00 H new ATOM 0 HA TYR A 60 119.241 0.187 -3.173 1.00 0.00 H new ATOM 0 HB2 TYR A 60 120.352 -1.478 -1.582 1.00 0.00 H new ATOM 0 HB3 TYR A 60 121.157 -2.190 -2.966 1.00 0.00 H new ATOM 0 HD1 TYR A 60 120.470 1.206 -1.510 1.00 0.00 H new ATOM 0 HD2 TYR A 60 123.268 -1.315 -3.575 1.00 0.00 H new ATOM 0 HE1 TYR A 60 122.121 3.039 -1.507 1.00 0.00 H new ATOM 0 HE2 TYR A 60 124.939 0.520 -3.535 1.00 0.00 H new ATOM 0 HH TYR A 60 125.371 2.635 -2.943 1.00 0.00 H new ATOM 994 N ASN A 61 120.327 -1.800 -5.604 1.00 0.00 N ATOM 995 CA ASN A 61 120.838 -1.712 -7.006 1.00 0.00 C ATOM 996 C ASN A 61 119.839 -0.965 -7.892 1.00 0.00 C ATOM 997 O ASN A 61 120.220 -0.145 -8.703 1.00 0.00 O ATOM 998 CB ASN A 61 121.059 -3.119 -7.566 1.00 0.00 C ATOM 999 CG ASN A 61 122.299 -3.730 -6.918 1.00 0.00 C ATOM 1000 OD1 ASN A 61 123.160 -3.016 -6.443 1.00 0.00 O ATOM 1001 ND2 ASN A 61 122.432 -5.028 -6.883 1.00 0.00 N ATOM 0 H ASN A 61 120.196 -2.745 -5.242 1.00 0.00 H new ATOM 0 HA ASN A 61 121.782 -1.168 -6.998 1.00 0.00 H new ATOM 0 HB2 ASN A 61 120.187 -3.743 -7.369 1.00 0.00 H new ATOM 0 HB3 ASN A 61 121.183 -3.077 -8.648 1.00 0.00 H new ATOM 0 HD21 ASN A 61 123.260 -5.445 -6.456 1.00 0.00 H new ATOM 0 HD22 ASN A 61 121.708 -5.626 -7.282 1.00 0.00 H new ATOM 1008 N LEU A 62 118.568 -1.220 -7.750 1.00 0.00 N ATOM 1009 CA LEU A 62 117.584 -0.489 -8.596 1.00 0.00 C ATOM 1010 C LEU A 62 117.669 0.999 -8.259 1.00 0.00 C ATOM 1011 O LEU A 62 117.588 1.851 -9.120 1.00 0.00 O ATOM 1012 CB LEU A 62 116.162 -0.982 -8.304 1.00 0.00 C ATOM 1013 CG LEU A 62 116.006 -2.457 -8.705 1.00 0.00 C ATOM 1014 CD1 LEU A 62 114.645 -2.964 -8.217 1.00 0.00 C ATOM 1015 CD2 LEU A 62 116.092 -2.612 -10.235 1.00 0.00 C ATOM 0 H LEU A 62 118.172 -1.893 -7.094 1.00 0.00 H new ATOM 0 HA LEU A 62 117.811 -0.662 -9.648 1.00 0.00 H new ATOM 0 HB2 LEU A 62 115.941 -0.863 -7.243 1.00 0.00 H new ATOM 0 HB3 LEU A 62 115.441 -0.373 -8.850 1.00 0.00 H new ATOM 0 HG LEU A 62 116.809 -3.037 -8.250 1.00 0.00 H new ATOM 0 HD11 LEU A 62 114.525 -4.011 -8.497 1.00 0.00 H new ATOM 0 HD12 LEU A 62 114.589 -2.870 -7.133 1.00 0.00 H new ATOM 0 HD13 LEU A 62 113.851 -2.373 -8.674 1.00 0.00 H new ATOM 0 HD21 LEU A 62 115.980 -3.663 -10.501 1.00 0.00 H new ATOM 0 HD22 LEU A 62 115.298 -2.032 -10.705 1.00 0.00 H new ATOM 0 HD23 LEU A 62 117.060 -2.251 -10.583 1.00 0.00 H new ATOM 1027 N VAL A 63 117.818 1.309 -7.003 1.00 0.00 N ATOM 1028 CA VAL A 63 117.893 2.734 -6.576 1.00 0.00 C ATOM 1029 C VAL A 63 119.105 3.433 -7.209 1.00 0.00 C ATOM 1030 O VAL A 63 118.970 4.463 -7.839 1.00 0.00 O ATOM 1031 CB VAL A 63 117.997 2.760 -5.044 1.00 0.00 C ATOM 1032 CG1 VAL A 63 118.400 4.160 -4.558 1.00 0.00 C ATOM 1033 CG2 VAL A 63 116.634 2.371 -4.444 1.00 0.00 C ATOM 0 H VAL A 63 117.892 0.630 -6.246 1.00 0.00 H new ATOM 0 HA VAL A 63 117.002 3.269 -6.906 1.00 0.00 H new ATOM 0 HB VAL A 63 118.760 2.051 -4.722 1.00 0.00 H new ATOM 0 HG11 VAL A 63 118.469 4.162 -3.470 1.00 0.00 H new ATOM 0 HG12 VAL A 63 119.367 4.429 -4.984 1.00 0.00 H new ATOM 0 HG13 VAL A 63 117.650 4.885 -4.875 1.00 0.00 H new ATOM 0 HG21 VAL A 63 116.698 2.387 -3.356 1.00 0.00 H new ATOM 0 HG22 VAL A 63 115.875 3.081 -4.773 1.00 0.00 H new ATOM 0 HG23 VAL A 63 116.362 1.369 -4.777 1.00 0.00 H new ATOM 1043 N ILE A 64 120.285 2.898 -7.050 1.00 0.00 N ATOM 1044 CA ILE A 64 121.479 3.560 -7.651 1.00 0.00 C ATOM 1045 C ILE A 64 121.335 3.574 -9.174 1.00 0.00 C ATOM 1046 O ILE A 64 121.656 4.547 -9.829 1.00 0.00 O ATOM 1047 CB ILE A 64 122.738 2.774 -7.273 1.00 0.00 C ATOM 1048 CG1 ILE A 64 122.887 2.707 -5.745 1.00 0.00 C ATOM 1049 CG2 ILE A 64 123.969 3.456 -7.875 1.00 0.00 C ATOM 1050 CD1 ILE A 64 122.844 4.110 -5.126 1.00 0.00 C ATOM 0 H ILE A 64 120.474 2.038 -6.534 1.00 0.00 H new ATOM 0 HA ILE A 64 121.557 4.581 -7.278 1.00 0.00 H new ATOM 0 HB ILE A 64 122.650 1.761 -7.665 1.00 0.00 H new ATOM 0 HG12 ILE A 64 122.088 2.096 -5.325 1.00 0.00 H new ATOM 0 HG13 ILE A 64 123.829 2.221 -5.489 1.00 0.00 H new ATOM 0 HG21 ILE A 64 124.864 2.895 -7.605 1.00 0.00 H new ATOM 0 HG22 ILE A 64 123.874 3.487 -8.960 1.00 0.00 H new ATOM 0 HG23 ILE A 64 124.047 4.472 -7.489 1.00 0.00 H new ATOM 0 HD11 ILE A 64 122.952 4.034 -4.044 1.00 0.00 H new ATOM 0 HD12 ILE A 64 123.658 4.711 -5.530 1.00 0.00 H new ATOM 0 HD13 ILE A 64 121.891 4.583 -5.363 1.00 0.00 H new ATOM 1062 N ALA A 65 120.861 2.502 -9.744 1.00 0.00 N ATOM 1063 CA ALA A 65 120.701 2.449 -11.225 1.00 0.00 C ATOM 1064 C ALA A 65 119.798 3.594 -11.691 1.00 0.00 C ATOM 1065 O ALA A 65 119.755 3.923 -12.860 1.00 0.00 O ATOM 1066 CB ALA A 65 120.070 1.114 -11.624 1.00 0.00 C ATOM 0 H ALA A 65 120.577 1.658 -9.247 1.00 0.00 H new ATOM 0 HA ALA A 65 121.680 2.547 -11.694 1.00 0.00 H new ATOM 0 HB1 ALA A 65 119.953 1.076 -12.707 1.00 0.00 H new ATOM 0 HB2 ALA A 65 120.713 0.296 -11.299 1.00 0.00 H new ATOM 0 HB3 ALA A 65 119.093 1.017 -11.150 1.00 0.00 H new ATOM 1072 N ARG A 66 119.067 4.195 -10.787 1.00 0.00 N ATOM 1073 CA ARG A 66 118.149 5.313 -11.171 1.00 0.00 C ATOM 1074 C ARG A 66 118.807 6.658 -10.852 1.00 0.00 C ATOM 1075 O ARG A 66 118.152 7.679 -10.780 1.00 0.00 O ATOM 1076 CB ARG A 66 116.836 5.173 -10.387 1.00 0.00 C ATOM 1077 CG ARG A 66 116.111 3.873 -10.788 1.00 0.00 C ATOM 1078 CD ARG A 66 115.298 4.077 -12.075 1.00 0.00 C ATOM 1079 NE ARG A 66 114.812 2.752 -12.565 1.00 0.00 N ATOM 1080 CZ ARG A 66 114.573 2.570 -13.837 1.00 0.00 C ATOM 1081 NH1 ARG A 66 113.445 2.975 -14.353 1.00 0.00 N ATOM 1082 NH2 ARG A 66 115.464 1.988 -14.592 1.00 0.00 N ATOM 0 H ARG A 66 119.066 3.959 -9.795 1.00 0.00 H new ATOM 0 HA ARG A 66 117.943 5.269 -12.240 1.00 0.00 H new ATOM 0 HB2 ARG A 66 117.042 5.167 -9.317 1.00 0.00 H new ATOM 0 HB3 ARG A 66 116.194 6.031 -10.583 1.00 0.00 H new ATOM 0 HG2 ARG A 66 116.839 3.076 -10.935 1.00 0.00 H new ATOM 0 HG3 ARG A 66 115.450 3.556 -9.981 1.00 0.00 H new ATOM 0 HD2 ARG A 66 114.454 4.740 -11.885 1.00 0.00 H new ATOM 0 HD3 ARG A 66 115.914 4.556 -12.836 1.00 0.00 H new ATOM 0 HE ARG A 66 114.666 1.988 -11.905 1.00 0.00 H new ATOM 0 HH11 ARG A 66 112.750 3.433 -13.764 1.00 0.00 H new ATOM 0 HH12 ARG A 66 113.258 2.833 -15.346 1.00 0.00 H new ATOM 0 HH21 ARG A 66 116.347 1.675 -14.190 1.00 0.00 H new ATOM 0 HH22 ARG A 66 115.277 1.846 -15.585 1.00 0.00 H new ATOM 1096 N GLY A 67 120.102 6.669 -10.681 1.00 0.00 N ATOM 1097 CA GLY A 67 120.817 7.950 -10.391 1.00 0.00 C ATOM 1098 C GLY A 67 120.913 8.192 -8.883 1.00 0.00 C ATOM 1099 O GLY A 67 121.622 9.075 -8.443 1.00 0.00 O ATOM 0 H GLY A 67 120.699 5.844 -10.730 1.00 0.00 H new ATOM 0 HA2 GLY A 67 121.817 7.919 -10.823 1.00 0.00 H new ATOM 0 HA3 GLY A 67 120.292 8.780 -10.864 1.00 0.00 H new ATOM 1103 N GLY A 68 120.221 7.414 -8.083 1.00 0.00 N ATOM 1104 CA GLY A 68 120.292 7.600 -6.594 1.00 0.00 C ATOM 1105 C GLY A 68 118.889 7.688 -6.001 1.00 0.00 C ATOM 1106 O GLY A 68 117.925 7.962 -6.688 1.00 0.00 O ATOM 0 H GLY A 68 119.610 6.659 -8.395 1.00 0.00 H new ATOM 0 HA2 GLY A 68 120.833 6.768 -6.143 1.00 0.00 H new ATOM 0 HA3 GLY A 68 120.850 8.507 -6.361 1.00 0.00 H new ATOM 1110 N LEU A 69 118.771 7.460 -4.719 1.00 0.00 N ATOM 1111 CA LEU A 69 117.434 7.535 -4.070 1.00 0.00 C ATOM 1112 C LEU A 69 116.870 8.938 -4.263 1.00 0.00 C ATOM 1113 O LEU A 69 115.708 9.115 -4.574 1.00 0.00 O ATOM 1114 CB LEU A 69 117.574 7.260 -2.572 1.00 0.00 C ATOM 1115 CG LEU A 69 116.180 7.206 -1.916 1.00 0.00 C ATOM 1116 CD1 LEU A 69 115.379 6.008 -2.470 1.00 0.00 C ATOM 1117 CD2 LEU A 69 116.333 7.077 -0.388 1.00 0.00 C ATOM 0 H LEU A 69 119.544 7.225 -4.096 1.00 0.00 H new ATOM 0 HA LEU A 69 116.770 6.795 -4.517 1.00 0.00 H new ATOM 0 HB2 LEU A 69 118.097 6.317 -2.414 1.00 0.00 H new ATOM 0 HB3 LEU A 69 118.175 8.040 -2.105 1.00 0.00 H new ATOM 0 HG LEU A 69 115.640 8.124 -2.147 1.00 0.00 H new ATOM 0 HD11 LEU A 69 114.396 5.979 -2.000 1.00 0.00 H new ATOM 0 HD12 LEU A 69 115.263 6.116 -3.548 1.00 0.00 H new ATOM 0 HD13 LEU A 69 115.912 5.082 -2.253 1.00 0.00 H new ATOM 0 HD21 LEU A 69 115.347 7.039 0.074 1.00 0.00 H new ATOM 0 HD22 LEU A 69 116.880 6.164 -0.153 1.00 0.00 H new ATOM 0 HD23 LEU A 69 116.881 7.937 -0.003 1.00 0.00 H new ATOM 1129 N VAL A 70 117.682 9.941 -4.074 1.00 0.00 N ATOM 1130 CA VAL A 70 117.183 11.328 -4.241 1.00 0.00 C ATOM 1131 C VAL A 70 116.684 11.500 -5.671 1.00 0.00 C ATOM 1132 O VAL A 70 115.671 12.126 -5.915 1.00 0.00 O ATOM 1133 CB VAL A 70 118.314 12.328 -3.966 1.00 0.00 C ATOM 1134 CG1 VAL A 70 117.770 13.747 -4.149 1.00 0.00 C ATOM 1135 CG2 VAL A 70 118.849 12.147 -2.525 1.00 0.00 C ATOM 0 H VAL A 70 118.664 9.858 -3.812 1.00 0.00 H new ATOM 0 HA VAL A 70 116.371 11.513 -3.538 1.00 0.00 H new ATOM 0 HB VAL A 70 119.135 12.154 -4.661 1.00 0.00 H new ATOM 0 HG11 VAL A 70 118.564 14.469 -3.956 1.00 0.00 H new ATOM 0 HG12 VAL A 70 117.408 13.869 -5.170 1.00 0.00 H new ATOM 0 HG13 VAL A 70 116.950 13.915 -3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 70 119.651 12.862 -2.342 1.00 0.00 H new ATOM 0 HG22 VAL A 70 118.041 12.317 -1.813 1.00 0.00 H new ATOM 0 HG23 VAL A 70 119.232 11.134 -2.404 1.00 0.00 H new ATOM 1145 N ASP A 71 117.383 10.945 -6.622 1.00 0.00 N ATOM 1146 CA ASP A 71 116.937 11.077 -8.036 1.00 0.00 C ATOM 1147 C ASP A 71 115.548 10.443 -8.182 1.00 0.00 C ATOM 1148 O ASP A 71 114.686 10.954 -8.869 1.00 0.00 O ATOM 1149 CB ASP A 71 117.935 10.350 -8.941 1.00 0.00 C ATOM 1150 CG ASP A 71 117.517 10.502 -10.403 1.00 0.00 C ATOM 1151 OD1 ASP A 71 116.340 10.686 -10.647 1.00 0.00 O ATOM 1152 OD2 ASP A 71 118.387 10.428 -11.256 1.00 0.00 O ATOM 0 H ASP A 71 118.239 10.409 -6.482 1.00 0.00 H new ATOM 0 HA ASP A 71 116.888 12.128 -8.320 1.00 0.00 H new ATOM 0 HB2 ASP A 71 118.935 10.758 -8.795 1.00 0.00 H new ATOM 0 HB3 ASP A 71 117.979 9.294 -8.674 1.00 0.00 H new ATOM 1157 N VAL A 72 115.333 9.329 -7.538 1.00 0.00 N ATOM 1158 CA VAL A 72 114.010 8.641 -7.627 1.00 0.00 C ATOM 1159 C VAL A 72 112.900 9.518 -7.032 1.00 0.00 C ATOM 1160 O VAL A 72 111.859 9.710 -7.630 1.00 0.00 O ATOM 1161 CB VAL A 72 114.102 7.320 -6.844 1.00 0.00 C ATOM 1162 CG1 VAL A 72 112.700 6.722 -6.613 1.00 0.00 C ATOM 1163 CG2 VAL A 72 114.961 6.331 -7.641 1.00 0.00 C ATOM 0 H VAL A 72 116.022 8.861 -6.949 1.00 0.00 H new ATOM 0 HA VAL A 72 113.767 8.452 -8.673 1.00 0.00 H new ATOM 0 HB VAL A 72 114.555 7.513 -5.871 1.00 0.00 H new ATOM 0 HG11 VAL A 72 112.790 5.788 -6.058 1.00 0.00 H new ATOM 0 HG12 VAL A 72 112.093 7.426 -6.044 1.00 0.00 H new ATOM 0 HG13 VAL A 72 112.224 6.528 -7.574 1.00 0.00 H new ATOM 0 HG21 VAL A 72 115.033 5.390 -7.095 1.00 0.00 H new ATOM 0 HG22 VAL A 72 114.502 6.152 -8.613 1.00 0.00 H new ATOM 0 HG23 VAL A 72 115.959 6.747 -7.781 1.00 0.00 H new ATOM 1173 N ILE A 73 113.103 10.023 -5.850 1.00 0.00 N ATOM 1174 CA ILE A 73 112.055 10.856 -5.192 1.00 0.00 C ATOM 1175 C ILE A 73 111.718 12.100 -6.023 1.00 0.00 C ATOM 1176 O ILE A 73 110.565 12.427 -6.220 1.00 0.00 O ATOM 1177 CB ILE A 73 112.559 11.301 -3.820 1.00 0.00 C ATOM 1178 CG1 ILE A 73 112.853 10.068 -2.963 1.00 0.00 C ATOM 1179 CG2 ILE A 73 111.487 12.152 -3.139 1.00 0.00 C ATOM 1180 CD1 ILE A 73 113.589 10.484 -1.686 1.00 0.00 C ATOM 0 H ILE A 73 113.956 9.895 -5.305 1.00 0.00 H new ATOM 0 HA ILE A 73 111.153 10.252 -5.098 1.00 0.00 H new ATOM 0 HB ILE A 73 113.470 11.888 -3.937 1.00 0.00 H new ATOM 0 HG12 ILE A 73 111.922 9.561 -2.708 1.00 0.00 H new ATOM 0 HG13 ILE A 73 113.458 9.358 -3.527 1.00 0.00 H new ATOM 0 HG21 ILE A 73 111.844 12.471 -2.160 1.00 0.00 H new ATOM 0 HG22 ILE A 73 111.275 13.028 -3.751 1.00 0.00 H new ATOM 0 HG23 ILE A 73 110.577 11.564 -3.020 1.00 0.00 H new ATOM 0 HD11 ILE A 73 113.795 9.601 -1.081 1.00 0.00 H new ATOM 0 HD12 ILE A 73 114.528 10.971 -1.949 1.00 0.00 H new ATOM 0 HD13 ILE A 73 112.968 11.177 -1.118 1.00 0.00 H new ATOM 1192 N ASN A 74 112.707 12.820 -6.471 1.00 0.00 N ATOM 1193 CA ASN A 74 112.430 14.067 -7.242 1.00 0.00 C ATOM 1194 C ASN A 74 111.619 13.765 -8.510 1.00 0.00 C ATOM 1195 O ASN A 74 110.707 14.493 -8.847 1.00 0.00 O ATOM 1196 CB ASN A 74 113.754 14.732 -7.618 1.00 0.00 C ATOM 1197 CG ASN A 74 113.477 16.043 -8.354 1.00 0.00 C ATOM 1198 OD1 ASN A 74 113.362 16.066 -9.563 1.00 0.00 O ATOM 1199 ND2 ASN A 74 113.366 17.147 -7.666 1.00 0.00 N ATOM 0 H ASN A 74 113.694 12.601 -6.338 1.00 0.00 H new ATOM 0 HA ASN A 74 111.841 14.739 -6.618 1.00 0.00 H new ATOM 0 HB2 ASN A 74 114.344 14.924 -6.722 1.00 0.00 H new ATOM 0 HB3 ASN A 74 114.341 14.065 -8.250 1.00 0.00 H new ATOM 0 HD21 ASN A 74 113.183 18.029 -8.144 1.00 0.00 H new ATOM 0 HD22 ASN A 74 113.463 17.127 -6.651 1.00 0.00 H new ATOM 1206 N LYS A 75 111.936 12.710 -9.223 1.00 0.00 N ATOM 1207 CA LYS A 75 111.167 12.391 -10.474 1.00 0.00 C ATOM 1208 C LYS A 75 110.087 11.345 -10.168 1.00 0.00 C ATOM 1209 O LYS A 75 109.410 10.859 -11.053 1.00 0.00 O ATOM 1210 CB LYS A 75 112.126 11.871 -11.553 1.00 0.00 C ATOM 1211 CG LYS A 75 113.179 12.949 -11.859 1.00 0.00 C ATOM 1212 CD LYS A 75 113.818 12.694 -13.231 1.00 0.00 C ATOM 1213 CE LYS A 75 114.446 11.292 -13.286 1.00 0.00 C ATOM 1214 NZ LYS A 75 113.456 10.330 -13.843 1.00 0.00 N ATOM 0 H LYS A 75 112.688 12.059 -8.997 1.00 0.00 H new ATOM 0 HA LYS A 75 110.683 13.296 -10.842 1.00 0.00 H new ATOM 0 HB2 LYS A 75 112.613 10.957 -11.213 1.00 0.00 H new ATOM 0 HB3 LYS A 75 111.572 11.620 -12.458 1.00 0.00 H new ATOM 0 HG2 LYS A 75 112.715 13.935 -11.844 1.00 0.00 H new ATOM 0 HG3 LYS A 75 113.947 12.946 -11.086 1.00 0.00 H new ATOM 0 HD2 LYS A 75 113.064 12.791 -14.012 1.00 0.00 H new ATOM 0 HD3 LYS A 75 114.581 13.447 -13.428 1.00 0.00 H new ATOM 0 HE2 LYS A 75 115.343 11.307 -13.905 1.00 0.00 H new ATOM 0 HE3 LYS A 75 114.752 10.979 -12.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 113.956 9.510 -14.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 112.817 10.012 -13.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 112.902 10.795 -14.590 1.00 0.00 H new ATOM 1228 N LYS A 76 109.911 11.015 -8.917 1.00 0.00 N ATOM 1229 CA LYS A 76 108.862 10.023 -8.527 1.00 0.00 C ATOM 1230 C LYS A 76 108.961 8.748 -9.373 1.00 0.00 C ATOM 1231 O LYS A 76 108.024 8.374 -10.051 1.00 0.00 O ATOM 1232 CB LYS A 76 107.473 10.644 -8.707 1.00 0.00 C ATOM 1233 CG LYS A 76 107.296 11.793 -7.712 1.00 0.00 C ATOM 1234 CD LYS A 76 105.910 12.418 -7.886 1.00 0.00 C ATOM 1235 CE LYS A 76 105.742 13.567 -6.888 1.00 0.00 C ATOM 1236 NZ LYS A 76 104.365 14.126 -7.001 1.00 0.00 N ATOM 0 H LYS A 76 110.453 11.393 -8.140 1.00 0.00 H new ATOM 0 HA LYS A 76 109.020 9.757 -7.482 1.00 0.00 H new ATOM 0 HB2 LYS A 76 107.356 11.010 -9.727 1.00 0.00 H new ATOM 0 HB3 LYS A 76 106.702 9.890 -8.549 1.00 0.00 H new ATOM 0 HG2 LYS A 76 107.414 11.425 -6.693 1.00 0.00 H new ATOM 0 HG3 LYS A 76 108.068 12.546 -7.871 1.00 0.00 H new ATOM 0 HD2 LYS A 76 105.790 12.786 -8.905 1.00 0.00 H new ATOM 0 HD3 LYS A 76 105.137 11.666 -7.726 1.00 0.00 H new ATOM 0 HE2 LYS A 76 105.919 13.210 -5.873 1.00 0.00 H new ATOM 0 HE3 LYS A 76 106.479 14.345 -7.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 104.417 15.117 -7.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 103.822 13.573 -7.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 103.894 14.078 -6.075 1.00 0.00 H new ATOM 1250 N LEU A 77 110.074 8.065 -9.327 1.00 0.00 N ATOM 1251 CA LEU A 77 110.211 6.801 -10.115 1.00 0.00 C ATOM 1252 C LEU A 77 109.801 5.627 -9.218 1.00 0.00 C ATOM 1253 O LEU A 77 110.142 4.488 -9.468 1.00 0.00 O ATOM 1254 CB LEU A 77 111.666 6.616 -10.569 1.00 0.00 C ATOM 1255 CG LEU A 77 112.113 7.814 -11.414 1.00 0.00 C ATOM 1256 CD1 LEU A 77 113.602 7.667 -11.745 1.00 0.00 C ATOM 1257 CD2 LEU A 77 111.301 7.875 -12.719 1.00 0.00 C ATOM 0 H LEU A 77 110.894 8.326 -8.779 1.00 0.00 H new ATOM 0 HA LEU A 77 109.574 6.846 -10.998 1.00 0.00 H new ATOM 0 HB2 LEU A 77 112.315 6.512 -9.700 1.00 0.00 H new ATOM 0 HB3 LEU A 77 111.760 5.698 -11.149 1.00 0.00 H new ATOM 0 HG LEU A 77 111.946 8.733 -10.852 1.00 0.00 H new ATOM 0 HD11 LEU A 77 113.927 8.516 -12.346 1.00 0.00 H new ATOM 0 HD12 LEU A 77 114.179 7.635 -10.821 1.00 0.00 H new ATOM 0 HD13 LEU A 77 113.761 6.745 -12.304 1.00 0.00 H new ATOM 0 HD21 LEU A 77 111.627 8.730 -13.311 1.00 0.00 H new ATOM 0 HD22 LEU A 77 111.458 6.959 -13.288 1.00 0.00 H new ATOM 0 HD23 LEU A 77 110.242 7.980 -12.484 1.00 0.00 H new ATOM 1269 N TRP A 78 109.068 5.906 -8.169 1.00 0.00 N ATOM 1270 CA TRP A 78 108.627 4.824 -7.239 1.00 0.00 C ATOM 1271 C TRP A 78 107.783 3.800 -8.000 1.00 0.00 C ATOM 1272 O TRP A 78 107.715 2.645 -7.633 1.00 0.00 O ATOM 1273 CB TRP A 78 107.773 5.420 -6.110 1.00 0.00 C ATOM 1274 CG TRP A 78 108.643 6.104 -5.105 1.00 0.00 C ATOM 1275 CD1 TRP A 78 108.596 7.423 -4.811 1.00 0.00 C ATOM 1276 CD2 TRP A 78 109.673 5.531 -4.249 1.00 0.00 C ATOM 1277 NE1 TRP A 78 109.534 7.698 -3.834 1.00 0.00 N ATOM 1278 CE2 TRP A 78 110.224 6.564 -3.455 1.00 0.00 C ATOM 1279 CE3 TRP A 78 110.180 4.229 -4.088 1.00 0.00 C ATOM 1280 CZ2 TRP A 78 111.240 6.316 -2.534 1.00 0.00 C ATOM 1281 CZ3 TRP A 78 111.204 3.975 -3.159 1.00 0.00 C ATOM 1282 CH2 TRP A 78 111.732 5.018 -2.385 1.00 0.00 C ATOM 0 H TRP A 78 108.755 6.843 -7.916 1.00 0.00 H new ATOM 0 HA TRP A 78 109.510 4.342 -6.820 1.00 0.00 H new ATOM 0 HB2 TRP A 78 107.056 6.130 -6.523 1.00 0.00 H new ATOM 0 HB3 TRP A 78 107.197 4.631 -5.626 1.00 0.00 H new ATOM 0 HD1 TRP A 78 107.933 8.144 -5.266 1.00 0.00 H new ATOM 0 HE1 TRP A 78 109.697 8.625 -3.441 1.00 0.00 H new ATOM 0 HE3 TRP A 78 109.780 3.420 -4.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 111.644 7.122 -1.940 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 111.586 2.972 -3.041 1.00 0.00 H new ATOM 0 HH2 TRP A 78 112.519 4.817 -1.674 1.00 0.00 H new ATOM 1293 N GLN A 79 107.122 4.214 -9.044 1.00 0.00 N ATOM 1294 CA GLN A 79 106.271 3.258 -9.801 1.00 0.00 C ATOM 1295 C GLN A 79 107.141 2.117 -10.332 1.00 0.00 C ATOM 1296 O GLN A 79 106.764 0.964 -10.273 1.00 0.00 O ATOM 1297 CB GLN A 79 105.608 3.993 -10.973 1.00 0.00 C ATOM 1298 CG GLN A 79 104.593 3.075 -11.667 1.00 0.00 C ATOM 1299 CD GLN A 79 103.324 2.974 -10.818 1.00 0.00 C ATOM 1300 OE1 GLN A 79 102.370 2.328 -11.206 1.00 0.00 O ATOM 1301 NE2 GLN A 79 103.270 3.590 -9.669 1.00 0.00 N ATOM 0 H GLN A 79 107.134 5.168 -9.404 1.00 0.00 H new ATOM 0 HA GLN A 79 105.501 2.849 -9.147 1.00 0.00 H new ATOM 0 HB2 GLN A 79 105.109 4.892 -10.612 1.00 0.00 H new ATOM 0 HB3 GLN A 79 106.367 4.314 -11.687 1.00 0.00 H new ATOM 0 HG2 GLN A 79 104.351 3.466 -12.655 1.00 0.00 H new ATOM 0 HG3 GLN A 79 105.024 2.085 -11.813 1.00 0.00 H new ATOM 0 HE21 GLN A 79 104.070 4.132 -9.343 1.00 0.00 H new ATOM 0 HE22 GLN A 79 102.428 3.529 -9.097 1.00 0.00 H new ATOM 1310 N GLU A 80 108.302 2.418 -10.844 1.00 0.00 N ATOM 1311 CA GLU A 80 109.178 1.331 -11.366 1.00 0.00 C ATOM 1312 C GLU A 80 109.517 0.354 -10.232 1.00 0.00 C ATOM 1313 O GLU A 80 109.366 -0.843 -10.367 1.00 0.00 O ATOM 1314 CB GLU A 80 110.465 1.940 -11.931 1.00 0.00 C ATOM 1315 CG GLU A 80 111.291 0.856 -12.637 1.00 0.00 C ATOM 1316 CD GLU A 80 112.041 0.012 -11.601 1.00 0.00 C ATOM 1317 OE1 GLU A 80 112.416 0.558 -10.577 1.00 0.00 O ATOM 1318 OE2 GLU A 80 112.227 -1.167 -11.852 1.00 0.00 O ATOM 0 H GLU A 80 108.680 3.362 -10.924 1.00 0.00 H new ATOM 0 HA GLU A 80 108.658 0.792 -12.158 1.00 0.00 H new ATOM 0 HB2 GLU A 80 110.222 2.739 -12.632 1.00 0.00 H new ATOM 0 HB3 GLU A 80 111.049 2.388 -11.127 1.00 0.00 H new ATOM 0 HG2 GLU A 80 110.637 0.219 -13.233 1.00 0.00 H new ATOM 0 HG3 GLU A 80 112.000 1.317 -13.325 1.00 0.00 H new ATOM 1325 N ILE A 81 109.963 0.859 -9.110 1.00 0.00 N ATOM 1326 CA ILE A 81 110.298 -0.039 -7.963 1.00 0.00 C ATOM 1327 C ILE A 81 109.022 -0.737 -7.487 1.00 0.00 C ATOM 1328 O ILE A 81 108.988 -1.938 -7.307 1.00 0.00 O ATOM 1329 CB ILE A 81 110.902 0.799 -6.825 1.00 0.00 C ATOM 1330 CG1 ILE A 81 112.300 1.292 -7.235 1.00 0.00 C ATOM 1331 CG2 ILE A 81 111.017 -0.045 -5.551 1.00 0.00 C ATOM 1332 CD1 ILE A 81 112.721 2.458 -6.339 1.00 0.00 C ATOM 0 H ILE A 81 110.110 1.854 -8.938 1.00 0.00 H new ATOM 0 HA ILE A 81 111.023 -0.791 -8.273 1.00 0.00 H new ATOM 0 HB ILE A 81 110.252 1.652 -6.632 1.00 0.00 H new ATOM 0 HG12 ILE A 81 113.021 0.479 -7.152 1.00 0.00 H new ATOM 0 HG13 ILE A 81 112.293 1.607 -8.278 1.00 0.00 H new ATOM 0 HG21 ILE A 81 111.446 0.559 -4.752 1.00 0.00 H new ATOM 0 HG22 ILE A 81 110.027 -0.391 -5.253 1.00 0.00 H new ATOM 0 HG23 ILE A 81 111.660 -0.905 -5.741 1.00 0.00 H new ATOM 0 HD11 ILE A 81 113.712 2.804 -6.633 1.00 0.00 H new ATOM 0 HD12 ILE A 81 112.006 3.274 -6.444 1.00 0.00 H new ATOM 0 HD13 ILE A 81 112.745 2.128 -5.300 1.00 0.00 H new ATOM 1344 N ILE A 82 107.969 0.009 -7.290 1.00 0.00 N ATOM 1345 CA ILE A 82 106.691 -0.603 -6.836 1.00 0.00 C ATOM 1346 C ILE A 82 106.214 -1.608 -7.886 1.00 0.00 C ATOM 1347 O ILE A 82 105.692 -2.657 -7.562 1.00 0.00 O ATOM 1348 CB ILE A 82 105.645 0.494 -6.622 1.00 0.00 C ATOM 1349 CG1 ILE A 82 106.046 1.316 -5.394 1.00 0.00 C ATOM 1350 CG2 ILE A 82 104.270 -0.139 -6.385 1.00 0.00 C ATOM 1351 CD1 ILE A 82 105.173 2.566 -5.291 1.00 0.00 C ATOM 0 H ILE A 82 107.940 1.020 -7.425 1.00 0.00 H new ATOM 0 HA ILE A 82 106.842 -1.125 -5.891 1.00 0.00 H new ATOM 0 HB ILE A 82 105.593 1.134 -7.503 1.00 0.00 H new ATOM 0 HG12 ILE A 82 105.939 0.713 -4.492 1.00 0.00 H new ATOM 0 HG13 ILE A 82 107.096 1.601 -5.464 1.00 0.00 H new ATOM 0 HG21 ILE A 82 103.529 0.646 -6.233 1.00 0.00 H new ATOM 0 HG22 ILE A 82 103.991 -0.738 -7.252 1.00 0.00 H new ATOM 0 HG23 ILE A 82 104.310 -0.776 -5.501 1.00 0.00 H new ATOM 0 HD11 ILE A 82 105.466 3.143 -4.414 1.00 0.00 H new ATOM 0 HD12 ILE A 82 105.302 3.174 -6.186 1.00 0.00 H new ATOM 0 HD13 ILE A 82 104.127 2.273 -5.199 1.00 0.00 H new ATOM 1363 N LYS A 83 106.391 -1.303 -9.144 1.00 0.00 N ATOM 1364 CA LYS A 83 105.947 -2.251 -10.204 1.00 0.00 C ATOM 1365 C LYS A 83 106.638 -3.594 -9.971 1.00 0.00 C ATOM 1366 O LYS A 83 106.008 -4.633 -9.960 1.00 0.00 O ATOM 1367 CB LYS A 83 106.343 -1.700 -11.577 1.00 0.00 C ATOM 1368 CG LYS A 83 105.811 -2.621 -12.681 1.00 0.00 C ATOM 1369 CD LYS A 83 106.220 -2.082 -14.062 1.00 0.00 C ATOM 1370 CE LYS A 83 105.285 -0.943 -14.490 1.00 0.00 C ATOM 1371 NZ LYS A 83 105.570 -0.577 -15.907 1.00 0.00 N ATOM 0 H LYS A 83 106.822 -0.442 -9.481 1.00 0.00 H new ATOM 0 HA LYS A 83 104.865 -2.377 -10.169 1.00 0.00 H new ATOM 0 HB2 LYS A 83 105.941 -0.695 -11.705 1.00 0.00 H new ATOM 0 HB3 LYS A 83 107.428 -1.621 -11.648 1.00 0.00 H new ATOM 0 HG2 LYS A 83 106.203 -3.629 -12.545 1.00 0.00 H new ATOM 0 HG3 LYS A 83 104.725 -2.690 -12.616 1.00 0.00 H new ATOM 0 HD2 LYS A 83 107.249 -1.724 -14.029 1.00 0.00 H new ATOM 0 HD3 LYS A 83 106.185 -2.885 -14.798 1.00 0.00 H new ATOM 0 HE2 LYS A 83 104.245 -1.252 -14.384 1.00 0.00 H new ATOM 0 HE3 LYS A 83 105.428 -0.077 -13.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 104.938 0.195 -16.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 106.559 -0.266 -15.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 105.413 -1.404 -16.518 1.00 0.00 H new ATOM 1385 N GLY A 84 107.925 -3.579 -9.754 1.00 0.00 N ATOM 1386 CA GLY A 84 108.647 -4.854 -9.487 1.00 0.00 C ATOM 1387 C GLY A 84 108.082 -5.466 -8.205 1.00 0.00 C ATOM 1388 O GLY A 84 107.889 -6.661 -8.095 1.00 0.00 O ATOM 0 H GLY A 84 108.506 -2.741 -9.750 1.00 0.00 H new ATOM 0 HA2 GLY A 84 108.524 -5.543 -10.323 1.00 0.00 H new ATOM 0 HA3 GLY A 84 109.716 -4.670 -9.381 1.00 0.00 H new ATOM 1392 N LEU A 85 107.813 -4.634 -7.236 1.00 0.00 N ATOM 1393 CA LEU A 85 107.252 -5.108 -5.938 1.00 0.00 C ATOM 1394 C LEU A 85 105.721 -5.106 -6.029 1.00 0.00 C ATOM 1395 O LEU A 85 105.052 -4.435 -5.268 1.00 0.00 O ATOM 1396 CB LEU A 85 107.715 -4.160 -4.817 1.00 0.00 C ATOM 1397 CG LEU A 85 109.087 -4.594 -4.290 1.00 0.00 C ATOM 1398 CD1 LEU A 85 110.116 -4.549 -5.421 1.00 0.00 C ATOM 1399 CD2 LEU A 85 109.520 -3.638 -3.176 1.00 0.00 C ATOM 0 H LEU A 85 107.961 -3.626 -7.290 1.00 0.00 H new ATOM 0 HA LEU A 85 107.599 -6.118 -5.720 1.00 0.00 H new ATOM 0 HB2 LEU A 85 107.768 -3.139 -5.194 1.00 0.00 H new ATOM 0 HB3 LEU A 85 106.988 -4.163 -4.005 1.00 0.00 H new ATOM 0 HG LEU A 85 109.022 -5.611 -3.904 1.00 0.00 H new ATOM 0 HD11 LEU A 85 111.089 -4.859 -5.040 1.00 0.00 H new ATOM 0 HD12 LEU A 85 109.808 -5.223 -6.220 1.00 0.00 H new ATOM 0 HD13 LEU A 85 110.185 -3.533 -5.810 1.00 0.00 H new ATOM 0 HD21 LEU A 85 110.496 -3.940 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 85 109.583 -2.624 -3.571 1.00 0.00 H new ATOM 0 HD23 LEU A 85 108.790 -3.668 -2.367 1.00 0.00 H new ATOM 1411 N HIS A 86 105.166 -5.829 -6.973 1.00 0.00 N ATOM 1412 CA HIS A 86 103.676 -5.857 -7.139 1.00 0.00 C ATOM 1413 C HIS A 86 102.989 -5.883 -5.770 1.00 0.00 C ATOM 1414 O HIS A 86 103.519 -6.395 -4.805 1.00 0.00 O ATOM 1415 CB HIS A 86 103.276 -7.110 -7.919 1.00 0.00 C ATOM 1416 CG HIS A 86 103.770 -7.006 -9.336 1.00 0.00 C ATOM 1417 ND1 HIS A 86 103.094 -6.281 -10.304 1.00 0.00 N ATOM 1418 CD2 HIS A 86 104.870 -7.535 -9.964 1.00 0.00 C ATOM 1419 CE1 HIS A 86 103.787 -6.392 -11.452 1.00 0.00 C ATOM 1420 NE2 HIS A 86 104.879 -7.146 -11.301 1.00 0.00 N ATOM 0 H HIS A 86 105.683 -6.404 -7.639 1.00 0.00 H new ATOM 0 HA HIS A 86 103.366 -4.963 -7.680 1.00 0.00 H new ATOM 0 HB2 HIS A 86 103.695 -7.996 -7.442 1.00 0.00 H new ATOM 0 HB3 HIS A 86 102.192 -7.225 -7.909 1.00 0.00 H new ATOM 0 HD2 HIS A 86 105.615 -8.158 -9.493 1.00 0.00 H new ATOM 0 HE1 HIS A 86 103.496 -5.928 -12.383 1.00 0.00 H new ATOM 0 HE2 HIS A 86 105.570 -7.385 -12.012 1.00 0.00 H new ATOM 1428 N LEU A 87 101.816 -5.315 -5.679 1.00 0.00 N ATOM 1429 CA LEU A 87 101.092 -5.281 -4.377 1.00 0.00 C ATOM 1430 C LEU A 87 100.221 -6.547 -4.235 1.00 0.00 C ATOM 1431 O LEU A 87 99.314 -6.740 -5.020 1.00 0.00 O ATOM 1432 CB LEU A 87 100.168 -4.059 -4.354 1.00 0.00 C ATOM 1433 CG LEU A 87 101.000 -2.764 -4.350 1.00 0.00 C ATOM 1434 CD1 LEU A 87 101.621 -2.510 -5.737 1.00 0.00 C ATOM 1435 CD2 LEU A 87 100.091 -1.590 -3.969 1.00 0.00 C ATOM 0 H LEU A 87 101.326 -4.871 -6.456 1.00 0.00 H new ATOM 0 HA LEU A 87 101.815 -5.233 -3.563 1.00 0.00 H new ATOM 0 HB2 LEU A 87 99.510 -4.075 -5.223 1.00 0.00 H new ATOM 0 HB3 LEU A 87 99.530 -4.093 -3.471 1.00 0.00 H new ATOM 0 HG LEU A 87 101.809 -2.863 -3.626 1.00 0.00 H new ATOM 0 HD11 LEU A 87 102.205 -1.590 -5.711 1.00 0.00 H new ATOM 0 HD12 LEU A 87 102.270 -3.344 -6.003 1.00 0.00 H new ATOM 0 HD13 LEU A 87 100.828 -2.416 -6.479 1.00 0.00 H new ATOM 0 HD21 LEU A 87 100.671 -0.667 -3.963 1.00 0.00 H new ATOM 0 HD22 LEU A 87 99.282 -1.506 -4.695 1.00 0.00 H new ATOM 0 HD23 LEU A 87 99.672 -1.761 -2.977 1.00 0.00 H new ATOM 1447 N PRO A 88 100.444 -7.403 -3.249 1.00 0.00 N ATOM 1448 CA PRO A 88 99.580 -8.611 -3.102 1.00 0.00 C ATOM 1449 C PRO A 88 98.111 -8.241 -2.817 1.00 0.00 C ATOM 1450 O PRO A 88 97.385 -8.993 -2.200 1.00 0.00 O ATOM 1451 CB PRO A 88 100.218 -9.351 -1.904 1.00 0.00 C ATOM 1452 CG PRO A 88 101.430 -8.537 -1.406 1.00 0.00 C ATOM 1453 CD PRO A 88 101.542 -7.252 -2.247 1.00 0.00 C ATOM 0 HA PRO A 88 99.539 -9.213 -4.010 1.00 0.00 H new ATOM 0 HB2 PRO A 88 99.489 -9.471 -1.103 1.00 0.00 H new ATOM 0 HB3 PRO A 88 100.532 -10.351 -2.202 1.00 0.00 H new ATOM 0 HG2 PRO A 88 101.311 -8.289 -0.351 1.00 0.00 H new ATOM 0 HG3 PRO A 88 102.343 -9.126 -1.494 1.00 0.00 H new ATOM 0 HD2 PRO A 88 101.410 -6.359 -1.637 1.00 0.00 H new ATOM 0 HD3 PRO A 88 102.517 -7.169 -2.727 1.00 0.00 H new ATOM 1461 N SER A 89 97.680 -7.083 -3.255 1.00 0.00 N ATOM 1462 CA SER A 89 96.270 -6.646 -3.013 1.00 0.00 C ATOM 1463 C SER A 89 96.004 -6.495 -1.510 1.00 0.00 C ATOM 1464 O SER A 89 95.045 -5.867 -1.107 1.00 0.00 O ATOM 1465 CB SER A 89 95.296 -7.669 -3.604 1.00 0.00 C ATOM 1466 OG SER A 89 94.013 -7.071 -3.731 1.00 0.00 O ATOM 0 H SER A 89 98.251 -6.416 -3.775 1.00 0.00 H new ATOM 0 HA SER A 89 96.121 -5.681 -3.497 1.00 0.00 H new ATOM 0 HB2 SER A 89 95.651 -8.007 -4.577 1.00 0.00 H new ATOM 0 HB3 SER A 89 95.239 -8.548 -2.962 1.00 0.00 H new ATOM 0 HG SER A 89 93.385 -7.721 -4.110 1.00 0.00 H new ATOM 1472 N SER A 90 96.840 -7.054 -0.675 1.00 0.00 N ATOM 1473 CA SER A 90 96.628 -6.926 0.799 1.00 0.00 C ATOM 1474 C SER A 90 97.454 -5.750 1.322 1.00 0.00 C ATOM 1475 O SER A 90 97.362 -5.384 2.477 1.00 0.00 O ATOM 1476 CB SER A 90 97.078 -8.213 1.493 1.00 0.00 C ATOM 1477 OG SER A 90 96.157 -9.255 1.193 1.00 0.00 O ATOM 0 H SER A 90 97.661 -7.594 -0.949 1.00 0.00 H new ATOM 0 HA SER A 90 95.571 -6.755 1.005 1.00 0.00 H new ATOM 0 HB2 SER A 90 98.078 -8.489 1.160 1.00 0.00 H new ATOM 0 HB3 SER A 90 97.132 -8.059 2.571 1.00 0.00 H new ATOM 0 HG SER A 90 96.443 -10.082 1.635 1.00 0.00 H new ATOM 1483 N ILE A 91 98.256 -5.156 0.472 1.00 0.00 N ATOM 1484 CA ILE A 91 99.108 -4.001 0.889 1.00 0.00 C ATOM 1485 C ILE A 91 98.733 -2.782 0.043 1.00 0.00 C ATOM 1486 O ILE A 91 98.807 -2.818 -1.170 1.00 0.00 O ATOM 1487 CB ILE A 91 100.579 -4.337 0.622 1.00 0.00 C ATOM 1488 CG1 ILE A 91 100.949 -5.672 1.286 1.00 0.00 C ATOM 1489 CG2 ILE A 91 101.467 -3.220 1.176 1.00 0.00 C ATOM 1490 CD1 ILE A 91 100.629 -5.648 2.785 1.00 0.00 C ATOM 0 H ILE A 91 98.357 -5.427 -0.506 1.00 0.00 H new ATOM 0 HA ILE A 91 98.955 -3.795 1.948 1.00 0.00 H new ATOM 0 HB ILE A 91 100.733 -4.426 -0.453 1.00 0.00 H new ATOM 0 HG12 ILE A 91 100.402 -6.484 0.807 1.00 0.00 H new ATOM 0 HG13 ILE A 91 102.010 -5.873 1.140 1.00 0.00 H new ATOM 0 HG21 ILE A 91 102.513 -3.459 0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 91 101.215 -2.279 0.687 1.00 0.00 H new ATOM 0 HG23 ILE A 91 101.306 -3.126 2.250 1.00 0.00 H new ATOM 0 HD11 ILE A 91 100.901 -6.605 3.230 1.00 0.00 H new ATOM 0 HD12 ILE A 91 101.196 -4.850 3.265 1.00 0.00 H new ATOM 0 HD13 ILE A 91 99.563 -5.471 2.927 1.00 0.00 H new ATOM 1502 N THR A 92 98.334 -1.703 0.670 1.00 0.00 N ATOM 1503 CA THR A 92 97.954 -0.466 -0.091 1.00 0.00 C ATOM 1504 C THR A 92 98.857 0.692 0.340 1.00 0.00 C ATOM 1505 O THR A 92 98.466 1.841 0.299 1.00 0.00 O ATOM 1506 CB THR A 92 96.493 -0.100 0.217 1.00 0.00 C ATOM 1507 OG1 THR A 92 96.451 0.763 1.345 1.00 0.00 O ATOM 1508 CG2 THR A 92 95.696 -1.369 0.524 1.00 0.00 C ATOM 0 H THR A 92 98.254 -1.623 1.684 1.00 0.00 H new ATOM 0 HA THR A 92 98.070 -0.650 -1.159 1.00 0.00 H new ATOM 0 HB THR A 92 96.058 0.401 -0.648 1.00 0.00 H new ATOM 0 HG1 THR A 92 96.896 1.608 1.127 1.00 0.00 H new ATOM 0 HG21 THR A 92 94.661 -1.105 0.742 1.00 0.00 H new ATOM 0 HG22 THR A 92 95.727 -2.035 -0.338 1.00 0.00 H new ATOM 0 HG23 THR A 92 96.131 -1.872 1.387 1.00 0.00 H new ATOM 1516 N SER A 93 100.060 0.403 0.760 1.00 0.00 N ATOM 1517 CA SER A 93 100.979 1.496 1.201 1.00 0.00 C ATOM 1518 C SER A 93 102.433 1.081 0.955 1.00 0.00 C ATOM 1519 O SER A 93 103.328 1.473 1.677 1.00 0.00 O ATOM 1520 CB SER A 93 100.759 1.759 2.693 1.00 0.00 C ATOM 1521 OG SER A 93 101.651 0.952 3.451 1.00 0.00 O ATOM 0 H SER A 93 100.446 -0.539 0.817 1.00 0.00 H new ATOM 0 HA SER A 93 100.771 2.403 0.634 1.00 0.00 H new ATOM 0 HB2 SER A 93 100.925 2.813 2.916 1.00 0.00 H new ATOM 0 HB3 SER A 93 99.728 1.535 2.965 1.00 0.00 H new ATOM 0 HG SER A 93 102.573 1.240 3.286 1.00 0.00 H new ATOM 1527 N ALA A 94 102.676 0.291 -0.055 1.00 0.00 N ATOM 1528 CA ALA A 94 104.073 -0.146 -0.342 1.00 0.00 C ATOM 1529 C ALA A 94 104.952 1.077 -0.618 1.00 0.00 C ATOM 1530 O ALA A 94 106.089 1.143 -0.195 1.00 0.00 O ATOM 1531 CB ALA A 94 104.080 -1.068 -1.564 1.00 0.00 C ATOM 0 H ALA A 94 101.968 -0.071 -0.694 1.00 0.00 H new ATOM 0 HA ALA A 94 104.466 -0.683 0.521 1.00 0.00 H new ATOM 0 HB1 ALA A 94 105.101 -1.387 -1.773 1.00 0.00 H new ATOM 0 HB2 ALA A 94 103.461 -1.942 -1.364 1.00 0.00 H new ATOM 0 HB3 ALA A 94 103.683 -0.532 -2.426 1.00 0.00 H new ATOM 1537 N ALA A 95 104.438 2.046 -1.327 1.00 0.00 N ATOM 1538 CA ALA A 95 105.252 3.259 -1.631 1.00 0.00 C ATOM 1539 C ALA A 95 105.673 3.929 -0.321 1.00 0.00 C ATOM 1540 O ALA A 95 106.821 4.273 -0.121 1.00 0.00 O ATOM 1541 CB ALA A 95 104.413 4.242 -2.461 1.00 0.00 C ATOM 0 H ALA A 95 103.492 2.051 -1.708 1.00 0.00 H new ATOM 0 HA ALA A 95 106.139 2.971 -2.195 1.00 0.00 H new ATOM 0 HB1 ALA A 95 105.006 5.129 -2.684 1.00 0.00 H new ATOM 0 HB2 ALA A 95 104.110 3.765 -3.393 1.00 0.00 H new ATOM 0 HB3 ALA A 95 103.527 4.531 -1.896 1.00 0.00 H new ATOM 1547 N PHE A 96 104.739 4.127 0.562 1.00 0.00 N ATOM 1548 CA PHE A 96 105.055 4.790 1.862 1.00 0.00 C ATOM 1549 C PHE A 96 106.101 3.983 2.640 1.00 0.00 C ATOM 1550 O PHE A 96 107.000 4.536 3.241 1.00 0.00 O ATOM 1551 CB PHE A 96 103.779 4.902 2.698 1.00 0.00 C ATOM 1552 CG PHE A 96 104.095 5.573 4.013 1.00 0.00 C ATOM 1553 CD1 PHE A 96 104.011 6.965 4.124 1.00 0.00 C ATOM 1554 CD2 PHE A 96 104.475 4.804 5.120 1.00 0.00 C ATOM 1555 CE1 PHE A 96 104.306 7.591 5.342 1.00 0.00 C ATOM 1556 CE2 PHE A 96 104.769 5.429 6.339 1.00 0.00 C ATOM 1557 CZ PHE A 96 104.683 6.822 6.449 1.00 0.00 C ATOM 0 H PHE A 96 103.763 3.858 0.442 1.00 0.00 H new ATOM 0 HA PHE A 96 105.457 5.783 1.659 1.00 0.00 H new ATOM 0 HB2 PHE A 96 103.026 5.475 2.157 1.00 0.00 H new ATOM 0 HB3 PHE A 96 103.359 3.912 2.875 1.00 0.00 H new ATOM 0 HD1 PHE A 96 103.718 7.558 3.270 1.00 0.00 H new ATOM 0 HD2 PHE A 96 104.541 3.729 5.034 1.00 0.00 H new ATOM 0 HE1 PHE A 96 104.243 8.666 5.427 1.00 0.00 H new ATOM 0 HE2 PHE A 96 105.062 4.837 7.193 1.00 0.00 H new ATOM 0 HZ PHE A 96 104.908 7.304 7.389 1.00 0.00 H new ATOM 1567 N THR A 97 105.987 2.684 2.662 1.00 0.00 N ATOM 1568 CA THR A 97 106.982 1.877 3.425 1.00 0.00 C ATOM 1569 C THR A 97 108.367 1.995 2.781 1.00 0.00 C ATOM 1570 O THR A 97 109.361 2.172 3.452 1.00 0.00 O ATOM 1571 CB THR A 97 106.562 0.406 3.441 1.00 0.00 C ATOM 1572 OG1 THR A 97 105.288 0.285 4.061 1.00 0.00 O ATOM 1573 CG2 THR A 97 107.597 -0.411 4.225 1.00 0.00 C ATOM 0 H THR A 97 105.257 2.150 2.191 1.00 0.00 H new ATOM 0 HA THR A 97 107.024 2.257 4.446 1.00 0.00 H new ATOM 0 HB THR A 97 106.504 0.031 2.419 1.00 0.00 H new ATOM 0 HG1 THR A 97 104.596 0.626 3.456 1.00 0.00 H new ATOM 0 HG21 THR A 97 107.299 -1.459 4.237 1.00 0.00 H new ATOM 0 HG22 THR A 97 108.572 -0.316 3.748 1.00 0.00 H new ATOM 0 HG23 THR A 97 107.656 -0.038 5.248 1.00 0.00 H new ATOM 1581 N LEU A 98 108.444 1.872 1.485 1.00 0.00 N ATOM 1582 CA LEU A 98 109.772 1.943 0.806 1.00 0.00 C ATOM 1583 C LEU A 98 110.452 3.295 1.058 1.00 0.00 C ATOM 1584 O LEU A 98 111.600 3.353 1.447 1.00 0.00 O ATOM 1585 CB LEU A 98 109.566 1.770 -0.703 1.00 0.00 C ATOM 1586 CG LEU A 98 109.106 0.341 -1.027 1.00 0.00 C ATOM 1587 CD1 LEU A 98 108.590 0.300 -2.469 1.00 0.00 C ATOM 1588 CD2 LEU A 98 110.273 -0.654 -0.885 1.00 0.00 C ATOM 0 H LEU A 98 107.647 1.726 0.866 1.00 0.00 H new ATOM 0 HA LEU A 98 110.408 1.153 1.206 1.00 0.00 H new ATOM 0 HB2 LEU A 98 108.825 2.486 -1.058 1.00 0.00 H new ATOM 0 HB3 LEU A 98 110.496 1.986 -1.229 1.00 0.00 H new ATOM 0 HG LEU A 98 108.318 0.059 -0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 98 108.261 -0.711 -2.709 1.00 0.00 H new ATOM 0 HD12 LEU A 98 107.752 0.989 -2.575 1.00 0.00 H new ATOM 0 HD13 LEU A 98 109.389 0.593 -3.150 1.00 0.00 H new ATOM 0 HD21 LEU A 98 109.924 -1.660 -1.119 1.00 0.00 H new ATOM 0 HD22 LEU A 98 111.072 -0.378 -1.573 1.00 0.00 H new ATOM 0 HD23 LEU A 98 110.650 -0.630 0.138 1.00 0.00 H new ATOM 1600 N ARG A 99 109.768 4.380 0.817 1.00 0.00 N ATOM 1601 CA ARG A 99 110.404 5.715 1.022 1.00 0.00 C ATOM 1602 C ARG A 99 110.844 5.903 2.480 1.00 0.00 C ATOM 1603 O ARG A 99 111.896 6.443 2.747 1.00 0.00 O ATOM 1604 CB ARG A 99 109.427 6.825 0.619 1.00 0.00 C ATOM 1605 CG ARG A 99 108.171 6.757 1.483 1.00 0.00 C ATOM 1606 CD ARG A 99 107.123 7.739 0.945 1.00 0.00 C ATOM 1607 NE ARG A 99 106.472 7.153 -0.262 1.00 0.00 N ATOM 1608 CZ ARG A 99 105.585 7.843 -0.926 1.00 0.00 C ATOM 1609 NH1 ARG A 99 104.676 8.526 -0.286 1.00 0.00 N ATOM 1610 NH2 ARG A 99 105.607 7.848 -2.231 1.00 0.00 N ATOM 0 H ARG A 99 108.802 4.402 0.489 1.00 0.00 H new ATOM 0 HA ARG A 99 111.293 5.769 0.393 1.00 0.00 H new ATOM 0 HB2 ARG A 99 109.904 7.799 0.733 1.00 0.00 H new ATOM 0 HB3 ARG A 99 109.160 6.721 -0.433 1.00 0.00 H new ATOM 0 HG2 ARG A 99 107.770 5.744 1.480 1.00 0.00 H new ATOM 0 HG3 ARG A 99 108.415 7.000 2.517 1.00 0.00 H new ATOM 0 HD2 ARG A 99 106.376 7.947 1.711 1.00 0.00 H new ATOM 0 HD3 ARG A 99 107.594 8.689 0.693 1.00 0.00 H new ATOM 0 HE ARG A 99 106.720 6.212 -0.569 1.00 0.00 H new ATOM 0 HH11 ARG A 99 104.658 8.521 0.734 1.00 0.00 H new ATOM 0 HH12 ARG A 99 103.983 9.065 -0.806 1.00 0.00 H new ATOM 0 HH21 ARG A 99 106.317 7.313 -2.731 1.00 0.00 H new ATOM 0 HH22 ARG A 99 104.914 8.387 -2.751 1.00 0.00 H new ATOM 1624 N THR A 100 110.050 5.483 3.429 1.00 0.00 N ATOM 1625 CA THR A 100 110.441 5.672 4.862 1.00 0.00 C ATOM 1626 C THR A 100 111.320 4.509 5.348 1.00 0.00 C ATOM 1627 O THR A 100 112.238 4.703 6.120 1.00 0.00 O ATOM 1628 CB THR A 100 109.178 5.764 5.726 1.00 0.00 C ATOM 1629 OG1 THR A 100 109.526 6.242 7.017 1.00 0.00 O ATOM 1630 CG2 THR A 100 108.523 4.385 5.852 1.00 0.00 C ATOM 0 H THR A 100 109.154 5.020 3.279 1.00 0.00 H new ATOM 0 HA THR A 100 111.016 6.594 4.948 1.00 0.00 H new ATOM 0 HB THR A 100 108.473 6.449 5.256 1.00 0.00 H new ATOM 0 HG1 THR A 100 108.720 6.303 7.571 1.00 0.00 H new ATOM 0 HG21 THR A 100 107.627 4.463 6.468 1.00 0.00 H new ATOM 0 HG22 THR A 100 108.252 4.019 4.862 1.00 0.00 H new ATOM 0 HG23 THR A 100 109.223 3.691 6.316 1.00 0.00 H new ATOM 1638 N GLN A 101 111.049 3.305 4.918 1.00 0.00 N ATOM 1639 CA GLN A 101 111.876 2.154 5.380 1.00 0.00 C ATOM 1640 C GLN A 101 113.327 2.397 4.964 1.00 0.00 C ATOM 1641 O GLN A 101 114.247 2.280 5.752 1.00 0.00 O ATOM 1642 CB GLN A 101 111.358 0.864 4.728 1.00 0.00 C ATOM 1643 CG GLN A 101 112.160 -0.341 5.225 1.00 0.00 C ATOM 1644 CD GLN A 101 111.754 -1.584 4.432 1.00 0.00 C ATOM 1645 OE1 GLN A 101 112.264 -1.825 3.355 1.00 0.00 O ATOM 1646 NE2 GLN A 101 110.853 -2.391 4.920 1.00 0.00 N ATOM 0 H GLN A 101 110.296 3.070 4.271 1.00 0.00 H new ATOM 0 HA GLN A 101 111.815 2.056 6.464 1.00 0.00 H new ATOM 0 HB2 GLN A 101 110.302 0.729 4.962 1.00 0.00 H new ATOM 0 HB3 GLN A 101 111.437 0.940 3.643 1.00 0.00 H new ATOM 0 HG2 GLN A 101 113.228 -0.154 5.108 1.00 0.00 H new ATOM 0 HG3 GLN A 101 111.978 -0.499 6.288 1.00 0.00 H new ATOM 0 HE21 GLN A 101 110.424 -2.190 5.823 1.00 0.00 H new ATOM 0 HE22 GLN A 101 110.577 -3.223 4.398 1.00 0.00 H new ATOM 1655 N TYR A 102 113.528 2.737 3.725 1.00 0.00 N ATOM 1656 CA TYR A 102 114.901 2.992 3.226 1.00 0.00 C ATOM 1657 C TYR A 102 115.514 4.137 4.038 1.00 0.00 C ATOM 1658 O TYR A 102 116.611 4.042 4.549 1.00 0.00 O ATOM 1659 CB TYR A 102 114.818 3.391 1.752 1.00 0.00 C ATOM 1660 CG TYR A 102 116.193 3.380 1.119 1.00 0.00 C ATOM 1661 CD1 TYR A 102 117.096 4.416 1.374 1.00 0.00 C ATOM 1662 CD2 TYR A 102 116.556 2.333 0.261 1.00 0.00 C ATOM 1663 CE1 TYR A 102 118.362 4.402 0.771 1.00 0.00 C ATOM 1664 CE2 TYR A 102 117.818 2.323 -0.340 1.00 0.00 C ATOM 1665 CZ TYR A 102 118.720 3.359 -0.086 1.00 0.00 C ATOM 1666 OH TYR A 102 119.964 3.352 -0.678 1.00 0.00 O ATOM 0 H TYR A 102 112.790 2.850 3.030 1.00 0.00 H new ATOM 0 HA TYR A 102 115.519 2.100 3.330 1.00 0.00 H new ATOM 0 HB2 TYR A 102 114.161 2.703 1.220 1.00 0.00 H new ATOM 0 HB3 TYR A 102 114.379 4.384 1.663 1.00 0.00 H new ATOM 0 HD1 TYR A 102 116.819 5.225 2.034 1.00 0.00 H new ATOM 0 HD2 TYR A 102 115.859 1.532 0.064 1.00 0.00 H new ATOM 0 HE1 TYR A 102 119.062 5.200 0.970 1.00 0.00 H new ATOM 0 HE2 TYR A 102 118.096 1.515 -1.000 1.00 0.00 H new ATOM 0 HH TYR A 102 120.271 2.427 -0.784 1.00 0.00 H new ATOM 1676 N MET A 103 114.806 5.221 4.166 1.00 0.00 N ATOM 1677 CA MET A 103 115.345 6.369 4.945 1.00 0.00 C ATOM 1678 C MET A 103 115.583 5.966 6.398 1.00 0.00 C ATOM 1679 O MET A 103 116.454 6.494 7.059 1.00 0.00 O ATOM 1680 CB MET A 103 114.356 7.536 4.896 1.00 0.00 C ATOM 1681 CG MET A 103 114.332 8.125 3.486 1.00 0.00 C ATOM 1682 SD MET A 103 113.164 9.506 3.428 1.00 0.00 S ATOM 1683 CE MET A 103 113.406 9.928 1.686 1.00 0.00 C ATOM 0 H MET A 103 113.879 5.363 3.766 1.00 0.00 H new ATOM 0 HA MET A 103 116.294 6.673 4.504 1.00 0.00 H new ATOM 0 HB2 MET A 103 113.360 7.194 5.176 1.00 0.00 H new ATOM 0 HB3 MET A 103 114.644 8.301 5.616 1.00 0.00 H new ATOM 0 HG2 MET A 103 115.329 8.466 3.206 1.00 0.00 H new ATOM 0 HG3 MET A 103 114.043 7.360 2.766 1.00 0.00 H new ATOM 0 HE1 MET A 103 112.911 10.874 1.469 1.00 0.00 H new ATOM 0 HE2 MET A 103 114.472 10.020 1.479 1.00 0.00 H new ATOM 0 HE3 MET A 103 112.981 9.144 1.059 1.00 0.00 H new ATOM 1693 N LYS A 104 114.802 5.063 6.918 1.00 0.00 N ATOM 1694 CA LYS A 104 114.980 4.675 8.343 1.00 0.00 C ATOM 1695 C LYS A 104 116.390 4.106 8.589 1.00 0.00 C ATOM 1696 O LYS A 104 116.984 4.379 9.613 1.00 0.00 O ATOM 1697 CB LYS A 104 113.918 3.638 8.733 1.00 0.00 C ATOM 1698 CG LYS A 104 113.763 3.603 10.263 1.00 0.00 C ATOM 1699 CD LYS A 104 112.595 2.679 10.661 1.00 0.00 C ATOM 1700 CE LYS A 104 111.269 3.452 10.623 1.00 0.00 C ATOM 1701 NZ LYS A 104 111.344 4.614 11.554 1.00 0.00 N ATOM 0 H LYS A 104 114.053 4.580 6.422 1.00 0.00 H new ATOM 0 HA LYS A 104 114.862 5.565 8.961 1.00 0.00 H new ATOM 0 HB2 LYS A 104 112.965 3.887 8.267 1.00 0.00 H new ATOM 0 HB3 LYS A 104 114.205 2.653 8.365 1.00 0.00 H new ATOM 0 HG2 LYS A 104 114.687 3.250 10.721 1.00 0.00 H new ATOM 0 HG3 LYS A 104 113.584 4.610 10.640 1.00 0.00 H new ATOM 0 HD2 LYS A 104 112.548 1.828 9.982 1.00 0.00 H new ATOM 0 HD3 LYS A 104 112.763 2.279 11.661 1.00 0.00 H new ATOM 0 HE2 LYS A 104 111.066 3.797 9.609 1.00 0.00 H new ATOM 0 HE3 LYS A 104 110.446 2.797 10.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 110.408 4.782 11.976 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 112.032 4.412 12.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 111.644 5.460 11.029 1.00 0.00 H new ATOM 1715 N TYR A 105 116.937 3.306 7.688 1.00 0.00 N ATOM 1716 CA TYR A 105 118.313 2.729 7.942 1.00 0.00 C ATOM 1717 C TYR A 105 119.193 2.716 6.685 1.00 0.00 C ATOM 1718 O TYR A 105 120.347 2.343 6.764 1.00 0.00 O ATOM 1719 CB TYR A 105 118.180 1.283 8.420 1.00 0.00 C ATOM 1720 CG TYR A 105 117.302 1.226 9.640 1.00 0.00 C ATOM 1721 CD1 TYR A 105 117.796 1.656 10.875 1.00 0.00 C ATOM 1722 CD2 TYR A 105 115.991 0.746 9.535 1.00 0.00 C ATOM 1723 CE1 TYR A 105 116.977 1.607 12.008 1.00 0.00 C ATOM 1724 CE2 TYR A 105 115.173 0.695 10.665 1.00 0.00 C ATOM 1725 CZ TYR A 105 115.663 1.127 11.903 1.00 0.00 C ATOM 1726 OH TYR A 105 114.852 1.077 13.018 1.00 0.00 O ATOM 0 H TYR A 105 116.503 3.032 6.807 1.00 0.00 H new ATOM 0 HA TYR A 105 118.783 3.366 8.691 1.00 0.00 H new ATOM 0 HB2 TYR A 105 117.756 0.666 7.627 1.00 0.00 H new ATOM 0 HB3 TYR A 105 119.164 0.875 8.650 1.00 0.00 H new ATOM 0 HD1 TYR A 105 118.808 2.025 10.954 1.00 0.00 H new ATOM 0 HD2 TYR A 105 115.612 0.415 8.579 1.00 0.00 H new ATOM 0 HE1 TYR A 105 117.356 1.939 12.963 1.00 0.00 H new ATOM 0 HE2 TYR A 105 114.163 0.322 10.584 1.00 0.00 H new ATOM 0 HH TYR A 105 113.974 0.720 12.768 1.00 0.00 H new ATOM 1736 N LEU A 106 118.680 3.064 5.527 1.00 0.00 N ATOM 1737 CA LEU A 106 119.531 2.997 4.283 1.00 0.00 C ATOM 1738 C LEU A 106 119.932 4.391 3.771 1.00 0.00 C ATOM 1739 O LEU A 106 120.891 4.515 3.036 1.00 0.00 O ATOM 1740 CB LEU A 106 118.753 2.241 3.197 1.00 0.00 C ATOM 1741 CG LEU A 106 118.743 0.719 3.519 1.00 0.00 C ATOM 1742 CD1 LEU A 106 117.454 0.060 2.984 1.00 0.00 C ATOM 1743 CD2 LEU A 106 119.970 0.034 2.883 1.00 0.00 C ATOM 0 H LEU A 106 117.723 3.388 5.385 1.00 0.00 H new ATOM 0 HA LEU A 106 120.455 2.474 4.529 1.00 0.00 H new ATOM 0 HB2 LEU A 106 117.731 2.617 3.140 1.00 0.00 H new ATOM 0 HB3 LEU A 106 119.210 2.413 2.223 1.00 0.00 H new ATOM 0 HG LEU A 106 118.780 0.599 4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 106 117.465 -1.004 3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 106 116.586 0.526 3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 106 117.399 0.193 1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 106 119.953 -1.031 3.115 1.00 0.00 H new ATOM 0 HD22 LEU A 106 119.943 0.171 1.802 1.00 0.00 H new ATOM 0 HD23 LEU A 106 120.882 0.478 3.282 1.00 0.00 H new ATOM 1755 N TYR A 107 119.247 5.445 4.135 1.00 0.00 N ATOM 1756 CA TYR A 107 119.681 6.782 3.620 1.00 0.00 C ATOM 1757 C TYR A 107 121.070 7.143 4.184 1.00 0.00 C ATOM 1758 O TYR A 107 121.879 7.707 3.475 1.00 0.00 O ATOM 1759 CB TYR A 107 118.639 7.881 3.927 1.00 0.00 C ATOM 1760 CG TYR A 107 119.252 9.248 3.731 1.00 0.00 C ATOM 1761 CD1 TYR A 107 119.321 9.804 2.448 1.00 0.00 C ATOM 1762 CD2 TYR A 107 119.751 9.959 4.828 1.00 0.00 C ATOM 1763 CE1 TYR A 107 119.885 11.070 2.260 1.00 0.00 C ATOM 1764 CE2 TYR A 107 120.317 11.226 4.643 1.00 0.00 C ATOM 1765 CZ TYR A 107 120.384 11.782 3.359 1.00 0.00 C ATOM 1766 OH TYR A 107 120.942 13.031 3.178 1.00 0.00 O ATOM 0 H TYR A 107 118.431 5.443 4.747 1.00 0.00 H new ATOM 0 HA TYR A 107 119.757 6.720 2.534 1.00 0.00 H new ATOM 0 HB2 TYR A 107 117.774 7.765 3.274 1.00 0.00 H new ATOM 0 HB3 TYR A 107 118.281 7.778 4.952 1.00 0.00 H new ATOM 0 HD1 TYR A 107 118.938 9.254 1.601 1.00 0.00 H new ATOM 0 HD2 TYR A 107 119.699 9.530 5.818 1.00 0.00 H new ATOM 0 HE1 TYR A 107 119.936 11.498 1.270 1.00 0.00 H new ATOM 0 HE2 TYR A 107 120.702 11.775 5.490 1.00 0.00 H new ATOM 0 HH TYR A 107 120.801 13.572 3.983 1.00 0.00 H new ATOM 1776 N PRO A 108 121.382 6.817 5.426 1.00 0.00 N ATOM 1777 CA PRO A 108 122.729 7.141 5.968 1.00 0.00 C ATOM 1778 C PRO A 108 123.788 6.198 5.377 1.00 0.00 C ATOM 1779 O PRO A 108 124.887 6.598 5.048 1.00 0.00 O ATOM 1780 CB PRO A 108 122.546 6.910 7.485 1.00 0.00 C ATOM 1781 CG PRO A 108 121.093 6.452 7.732 1.00 0.00 C ATOM 1782 CD PRO A 108 120.458 6.127 6.370 1.00 0.00 C ATOM 0 HA PRO A 108 123.072 8.148 5.729 1.00 0.00 H new ATOM 0 HB2 PRO A 108 123.248 6.156 7.842 1.00 0.00 H new ATOM 0 HB3 PRO A 108 122.755 7.827 8.037 1.00 0.00 H new ATOM 0 HG2 PRO A 108 121.075 5.575 8.380 1.00 0.00 H new ATOM 0 HG3 PRO A 108 120.528 7.234 8.239 1.00 0.00 H new ATOM 0 HD2 PRO A 108 120.413 5.054 6.186 1.00 0.00 H new ATOM 0 HD3 PRO A 108 119.439 6.506 6.294 1.00 0.00 H new ATOM 1790 N TYR A 109 123.444 4.946 5.244 1.00 0.00 N ATOM 1791 CA TYR A 109 124.398 3.952 4.678 1.00 0.00 C ATOM 1792 C TYR A 109 124.718 4.332 3.230 1.00 0.00 C ATOM 1793 O TYR A 109 125.862 4.408 2.831 1.00 0.00 O ATOM 1794 CB TYR A 109 123.744 2.568 4.715 1.00 0.00 C ATOM 1795 CG TYR A 109 124.789 1.503 4.499 1.00 0.00 C ATOM 1796 CD1 TYR A 109 125.755 1.278 5.486 1.00 0.00 C ATOM 1797 CD2 TYR A 109 124.791 0.734 3.328 1.00 0.00 C ATOM 1798 CE1 TYR A 109 126.724 0.289 5.307 1.00 0.00 C ATOM 1799 CE2 TYR A 109 125.763 -0.257 3.148 1.00 0.00 C ATOM 1800 CZ TYR A 109 126.730 -0.479 4.137 1.00 0.00 C ATOM 1801 OH TYR A 109 127.687 -1.459 3.960 1.00 0.00 O ATOM 0 H TYR A 109 122.534 4.567 5.506 1.00 0.00 H new ATOM 0 HA TYR A 109 125.320 3.939 5.260 1.00 0.00 H new ATOM 0 HB2 TYR A 109 123.249 2.415 5.674 1.00 0.00 H new ATOM 0 HB3 TYR A 109 122.976 2.498 3.945 1.00 0.00 H new ATOM 0 HD1 TYR A 109 125.751 1.871 6.389 1.00 0.00 H new ATOM 0 HD2 TYR A 109 124.045 0.905 2.566 1.00 0.00 H new ATOM 0 HE1 TYR A 109 127.468 0.117 6.071 1.00 0.00 H new ATOM 0 HE2 TYR A 109 125.767 -0.851 2.246 1.00 0.00 H new ATOM 0 HH TYR A 109 127.319 -2.180 3.407 1.00 0.00 H new ATOM 1811 N GLU A 110 123.704 4.580 2.447 1.00 0.00 N ATOM 1812 CA GLU A 110 123.915 4.965 1.028 1.00 0.00 C ATOM 1813 C GLU A 110 124.826 6.192 0.959 1.00 0.00 C ATOM 1814 O GLU A 110 125.759 6.243 0.182 1.00 0.00 O ATOM 1815 CB GLU A 110 122.552 5.302 0.419 1.00 0.00 C ATOM 1816 CG GLU A 110 122.713 5.707 -1.046 1.00 0.00 C ATOM 1817 CD GLU A 110 121.338 5.706 -1.719 1.00 0.00 C ATOM 1818 OE1 GLU A 110 120.354 5.826 -1.008 1.00 0.00 O ATOM 1819 OE2 GLU A 110 121.291 5.586 -2.931 1.00 0.00 O ATOM 0 H GLU A 110 122.727 4.531 2.736 1.00 0.00 H new ATOM 0 HA GLU A 110 124.383 4.148 0.479 1.00 0.00 H new ATOM 0 HB2 GLU A 110 121.889 4.440 0.495 1.00 0.00 H new ATOM 0 HB3 GLU A 110 122.086 6.113 0.979 1.00 0.00 H new ATOM 0 HG2 GLU A 110 123.165 6.696 -1.115 1.00 0.00 H new ATOM 0 HG3 GLU A 110 123.382 5.014 -1.556 1.00 0.00 H new ATOM 1826 N CYS A 111 124.558 7.182 1.763 1.00 0.00 N ATOM 1827 CA CYS A 111 125.398 8.411 1.743 1.00 0.00 C ATOM 1828 C CYS A 111 126.840 8.083 2.152 1.00 0.00 C ATOM 1829 O CYS A 111 127.786 8.614 1.609 1.00 0.00 O ATOM 1830 CB CYS A 111 124.818 9.440 2.716 1.00 0.00 C ATOM 1831 SG CYS A 111 123.272 10.099 2.045 1.00 0.00 S ATOM 0 H CYS A 111 123.791 7.193 2.435 1.00 0.00 H new ATOM 0 HA CYS A 111 125.402 8.816 0.731 1.00 0.00 H new ATOM 0 HB2 CYS A 111 124.638 8.978 3.687 1.00 0.00 H new ATOM 0 HB3 CYS A 111 125.532 10.248 2.875 1.00 0.00 H new ATOM 0 HG CYS A 111 122.281 9.343 2.415 1.00 0.00 H new ATOM 1837 N GLU A 112 127.018 7.233 3.122 1.00 0.00 N ATOM 1838 CA GLU A 112 128.401 6.906 3.576 1.00 0.00 C ATOM 1839 C GLU A 112 129.189 6.213 2.458 1.00 0.00 C ATOM 1840 O GLU A 112 130.312 6.574 2.167 1.00 0.00 O ATOM 1841 CB GLU A 112 128.323 5.980 4.795 1.00 0.00 C ATOM 1842 CG GLU A 112 129.734 5.629 5.280 1.00 0.00 C ATOM 1843 CD GLU A 112 129.639 4.763 6.537 1.00 0.00 C ATOM 1844 OE1 GLU A 112 129.594 3.552 6.398 1.00 0.00 O ATOM 1845 OE2 GLU A 112 129.616 5.327 7.620 1.00 0.00 O ATOM 0 H GLU A 112 126.270 6.751 3.620 1.00 0.00 H new ATOM 0 HA GLU A 112 128.914 7.831 3.839 1.00 0.00 H new ATOM 0 HB2 GLU A 112 127.765 6.466 5.596 1.00 0.00 H new ATOM 0 HB3 GLU A 112 127.782 5.070 4.536 1.00 0.00 H new ATOM 0 HG2 GLU A 112 130.277 5.097 4.499 1.00 0.00 H new ATOM 0 HG3 GLU A 112 130.294 6.539 5.494 1.00 0.00 H new ATOM 1852 N LYS A 113 128.631 5.203 1.850 1.00 0.00 N ATOM 1853 CA LYS A 113 129.377 4.477 0.781 1.00 0.00 C ATOM 1854 C LYS A 113 129.539 5.332 -0.486 1.00 0.00 C ATOM 1855 O LYS A 113 130.573 5.284 -1.123 1.00 0.00 O ATOM 1856 CB LYS A 113 128.629 3.186 0.426 1.00 0.00 C ATOM 1857 CG LYS A 113 128.656 2.200 1.609 1.00 0.00 C ATOM 1858 CD LYS A 113 130.074 1.638 1.821 1.00 0.00 C ATOM 1859 CE LYS A 113 129.999 0.337 2.628 1.00 0.00 C ATOM 1860 NZ LYS A 113 129.527 -0.770 1.748 1.00 0.00 N ATOM 0 H LYS A 113 127.694 4.849 2.045 1.00 0.00 H new ATOM 0 HA LYS A 113 130.372 4.250 1.164 1.00 0.00 H new ATOM 0 HB2 LYS A 113 127.597 3.418 0.163 1.00 0.00 H new ATOM 0 HB3 LYS A 113 129.085 2.724 -0.450 1.00 0.00 H new ATOM 0 HG2 LYS A 113 128.320 2.704 2.516 1.00 0.00 H new ATOM 0 HG3 LYS A 113 127.960 1.382 1.422 1.00 0.00 H new ATOM 0 HD2 LYS A 113 130.550 1.453 0.858 1.00 0.00 H new ATOM 0 HD3 LYS A 113 130.690 2.368 2.346 1.00 0.00 H new ATOM 0 HE2 LYS A 113 130.979 0.095 3.040 1.00 0.00 H new ATOM 0 HE3 LYS A 113 129.320 0.459 3.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 128.791 -1.315 2.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 129.135 -0.373 0.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 130.326 -1.396 1.518 1.00 0.00 H new ATOM 1874 N LYS A 114 128.529 6.079 -0.889 1.00 0.00 N ATOM 1875 CA LYS A 114 128.647 6.890 -2.156 1.00 0.00 C ATOM 1876 C LYS A 114 128.395 8.388 -1.920 1.00 0.00 C ATOM 1877 O LYS A 114 128.694 9.200 -2.773 1.00 0.00 O ATOM 1878 CB LYS A 114 127.633 6.358 -3.172 1.00 0.00 C ATOM 1879 CG LYS A 114 128.080 4.970 -3.635 1.00 0.00 C ATOM 1880 CD LYS A 114 127.090 4.407 -4.652 1.00 0.00 C ATOM 1881 CE LYS A 114 127.569 3.021 -5.092 1.00 0.00 C ATOM 1882 NZ LYS A 114 126.516 2.361 -5.909 1.00 0.00 N ATOM 0 H LYS A 114 127.637 6.163 -0.402 1.00 0.00 H new ATOM 0 HA LYS A 114 129.667 6.789 -2.527 1.00 0.00 H new ATOM 0 HB2 LYS A 114 126.641 6.305 -2.723 1.00 0.00 H new ATOM 0 HB3 LYS A 114 127.561 7.035 -4.023 1.00 0.00 H new ATOM 0 HG2 LYS A 114 129.074 5.030 -4.079 1.00 0.00 H new ATOM 0 HG3 LYS A 114 128.153 4.299 -2.779 1.00 0.00 H new ATOM 0 HD2 LYS A 114 126.095 4.340 -4.213 1.00 0.00 H new ATOM 0 HD3 LYS A 114 127.015 5.071 -5.513 1.00 0.00 H new ATOM 0 HE2 LYS A 114 128.489 3.110 -5.670 1.00 0.00 H new ATOM 0 HE3 LYS A 114 127.800 2.411 -4.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 126.200 1.492 -5.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 125.709 3.007 -6.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 126.902 2.122 -6.845 1.00 0.00 H new ATOM 1896 N ASN A 115 127.856 8.779 -0.799 1.00 0.00 N ATOM 1897 CA ASN A 115 127.611 10.240 -0.583 1.00 0.00 C ATOM 1898 C ASN A 115 126.867 10.811 -1.794 1.00 0.00 C ATOM 1899 O ASN A 115 127.255 11.812 -2.363 1.00 0.00 O ATOM 1900 CB ASN A 115 128.953 10.959 -0.429 1.00 0.00 C ATOM 1901 CG ASN A 115 128.720 12.370 0.113 1.00 0.00 C ATOM 1902 OD1 ASN A 115 127.758 12.613 0.813 1.00 0.00 O ATOM 1903 ND2 ASN A 115 129.566 13.318 -0.185 1.00 0.00 N ATOM 0 H ASN A 115 127.577 8.166 -0.033 1.00 0.00 H new ATOM 0 HA ASN A 115 127.013 10.384 0.317 1.00 0.00 H new ATOM 0 HB2 ASN A 115 129.600 10.401 0.247 1.00 0.00 H new ATOM 0 HB3 ASN A 115 129.463 11.008 -1.391 1.00 0.00 H new ATOM 0 HD21 ASN A 115 129.419 14.263 0.170 1.00 0.00 H new ATOM 0 HD22 ASN A 115 130.374 13.114 -0.773 1.00 0.00 H new ATOM 1910 N LEU A 116 125.806 10.167 -2.201 1.00 0.00 N ATOM 1911 CA LEU A 116 125.035 10.647 -3.386 1.00 0.00 C ATOM 1912 C LEU A 116 124.508 12.060 -3.149 1.00 0.00 C ATOM 1913 O LEU A 116 124.484 12.881 -4.042 1.00 0.00 O ATOM 1914 CB LEU A 116 123.827 9.740 -3.598 1.00 0.00 C ATOM 1915 CG LEU A 116 124.274 8.297 -3.844 1.00 0.00 C ATOM 1916 CD1 LEU A 116 123.036 7.394 -3.891 1.00 0.00 C ATOM 1917 CD2 LEU A 116 125.037 8.195 -5.178 1.00 0.00 C ATOM 0 H LEU A 116 125.438 9.324 -1.761 1.00 0.00 H new ATOM 0 HA LEU A 116 125.698 10.637 -4.251 1.00 0.00 H new ATOM 0 HB2 LEU A 116 123.177 9.781 -2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 116 123.243 10.095 -4.447 1.00 0.00 H new ATOM 0 HG LEU A 116 124.936 7.982 -3.037 1.00 0.00 H new ATOM 0 HD11 LEU A 116 123.344 6.363 -4.066 1.00 0.00 H new ATOM 0 HD12 LEU A 116 122.503 7.457 -2.942 1.00 0.00 H new ATOM 0 HD13 LEU A 116 122.379 7.718 -4.698 1.00 0.00 H new ATOM 0 HD21 LEU A 116 125.349 7.163 -5.341 1.00 0.00 H new ATOM 0 HD22 LEU A 116 124.387 8.510 -5.994 1.00 0.00 H new ATOM 0 HD23 LEU A 116 125.916 8.839 -5.145 1.00 0.00 H new ATOM 1929 N SER A 117 124.044 12.339 -1.962 1.00 0.00 N ATOM 1930 CA SER A 117 123.474 13.688 -1.690 1.00 0.00 C ATOM 1931 C SER A 117 123.576 14.009 -0.198 1.00 0.00 C ATOM 1932 O SER A 117 123.753 13.132 0.623 1.00 0.00 O ATOM 1933 CB SER A 117 122.004 13.678 -2.111 1.00 0.00 C ATOM 1934 OG SER A 117 121.288 12.773 -1.282 1.00 0.00 O ATOM 0 H SER A 117 124.035 11.694 -1.172 1.00 0.00 H new ATOM 0 HA SER A 117 124.026 14.445 -2.248 1.00 0.00 H new ATOM 0 HB2 SER A 117 121.582 14.679 -2.026 1.00 0.00 H new ATOM 0 HB3 SER A 117 121.914 13.382 -3.156 1.00 0.00 H new ATOM 0 HG SER A 117 120.694 13.275 -0.686 1.00 0.00 H new ATOM 1940 N THR A 118 123.445 15.267 0.157 1.00 0.00 N ATOM 1941 CA THR A 118 123.510 15.668 1.596 1.00 0.00 C ATOM 1942 C THR A 118 122.084 16.021 2.045 1.00 0.00 C ATOM 1943 O THR A 118 121.266 16.400 1.232 1.00 0.00 O ATOM 1944 CB THR A 118 124.434 16.894 1.735 1.00 0.00 C ATOM 1945 OG1 THR A 118 124.331 17.695 0.569 1.00 0.00 O ATOM 1946 CG2 THR A 118 125.888 16.439 1.905 1.00 0.00 C ATOM 0 H THR A 118 123.295 16.037 -0.495 1.00 0.00 H new ATOM 0 HA THR A 118 123.906 14.862 2.213 1.00 0.00 H new ATOM 0 HB THR A 118 124.132 17.470 2.610 1.00 0.00 H new ATOM 0 HG1 THR A 118 124.917 18.476 0.656 1.00 0.00 H new ATOM 0 HG21 THR A 118 126.533 17.312 2.002 1.00 0.00 H new ATOM 0 HG22 THR A 118 125.974 15.822 2.800 1.00 0.00 H new ATOM 0 HG23 THR A 118 126.192 15.859 1.034 1.00 0.00 H new ATOM 1954 N PRO A 119 121.768 15.906 3.311 1.00 0.00 N ATOM 1955 CA PRO A 119 120.395 16.236 3.774 1.00 0.00 C ATOM 1956 C PRO A 119 119.952 17.625 3.285 1.00 0.00 C ATOM 1957 O PRO A 119 118.779 17.935 3.243 1.00 0.00 O ATOM 1958 CB PRO A 119 120.531 16.175 5.312 1.00 0.00 C ATOM 1959 CG PRO A 119 121.989 15.801 5.661 1.00 0.00 C ATOM 1960 CD PRO A 119 122.728 15.453 4.357 1.00 0.00 C ATOM 0 HA PRO A 119 119.632 15.560 3.388 1.00 0.00 H new ATOM 0 HB2 PRO A 119 120.271 17.137 5.754 1.00 0.00 H new ATOM 0 HB3 PRO A 119 119.842 15.438 5.724 1.00 0.00 H new ATOM 0 HG2 PRO A 119 122.483 16.631 6.166 1.00 0.00 H new ATOM 0 HG3 PRO A 119 122.009 14.953 6.346 1.00 0.00 H new ATOM 0 HD2 PRO A 119 123.684 15.971 4.282 1.00 0.00 H new ATOM 0 HD3 PRO A 119 122.937 14.386 4.281 1.00 0.00 H new ATOM 1968 N ALA A 120 120.888 18.456 2.914 1.00 0.00 N ATOM 1969 CA ALA A 120 120.529 19.819 2.425 1.00 0.00 C ATOM 1970 C ALA A 120 119.845 19.727 1.059 1.00 0.00 C ATOM 1971 O ALA A 120 118.738 20.196 0.867 1.00 0.00 O ATOM 1972 CB ALA A 120 121.793 20.666 2.297 1.00 0.00 C ATOM 0 H ALA A 120 121.887 18.250 2.928 1.00 0.00 H new ATOM 0 HA ALA A 120 119.846 20.280 3.138 1.00 0.00 H new ATOM 0 HB1 ALA A 120 121.529 21.661 1.940 1.00 0.00 H new ATOM 0 HB2 ALA A 120 122.277 20.746 3.270 1.00 0.00 H new ATOM 0 HB3 ALA A 120 122.476 20.196 1.590 1.00 0.00 H new ATOM 1978 N GLU A 121 120.505 19.129 0.104 1.00 0.00 N ATOM 1979 CA GLU A 121 119.910 19.013 -1.255 1.00 0.00 C ATOM 1980 C GLU A 121 118.741 18.032 -1.212 1.00 0.00 C ATOM 1981 O GLU A 121 117.841 18.090 -2.027 1.00 0.00 O ATOM 1982 CB GLU A 121 120.978 18.535 -2.249 1.00 0.00 C ATOM 1983 CG GLU A 121 121.894 17.515 -1.583 1.00 0.00 C ATOM 1984 CD GLU A 121 122.776 16.860 -2.647 1.00 0.00 C ATOM 1985 OE1 GLU A 121 122.239 16.452 -3.664 1.00 0.00 O ATOM 1986 OE2 GLU A 121 123.973 16.780 -2.428 1.00 0.00 O ATOM 0 H GLU A 121 121.432 18.716 0.208 1.00 0.00 H new ATOM 0 HA GLU A 121 119.544 19.986 -1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 121 120.500 18.091 -3.122 1.00 0.00 H new ATOM 0 HB3 GLU A 121 121.563 19.384 -2.603 1.00 0.00 H new ATOM 0 HG2 GLU A 121 122.513 18.002 -0.830 1.00 0.00 H new ATOM 0 HG3 GLU A 121 121.302 16.758 -1.068 1.00 0.00 H new ATOM 1993 N LEU A 122 118.734 17.140 -0.264 1.00 0.00 N ATOM 1994 CA LEU A 122 117.603 16.179 -0.177 1.00 0.00 C ATOM 1995 C LEU A 122 116.319 16.976 0.013 1.00 0.00 C ATOM 1996 O LEU A 122 115.321 16.733 -0.636 1.00 0.00 O ATOM 1997 CB LEU A 122 117.810 15.228 1.007 1.00 0.00 C ATOM 1998 CG LEU A 122 116.589 14.308 1.170 1.00 0.00 C ATOM 1999 CD1 LEU A 122 116.295 13.577 -0.150 1.00 0.00 C ATOM 2000 CD2 LEU A 122 116.883 13.280 2.265 1.00 0.00 C ATOM 0 H LEU A 122 119.456 17.035 0.449 1.00 0.00 H new ATOM 0 HA LEU A 122 117.546 15.583 -1.088 1.00 0.00 H new ATOM 0 HB2 LEU A 122 118.707 14.629 0.849 1.00 0.00 H new ATOM 0 HB3 LEU A 122 117.966 15.802 1.920 1.00 0.00 H new ATOM 0 HG LEU A 122 115.720 14.908 1.442 1.00 0.00 H new ATOM 0 HD11 LEU A 122 115.428 12.929 -0.022 1.00 0.00 H new ATOM 0 HD12 LEU A 122 116.089 14.307 -0.932 1.00 0.00 H new ATOM 0 HD13 LEU A 122 117.159 12.976 -0.433 1.00 0.00 H new ATOM 0 HD21 LEU A 122 116.022 12.623 2.388 1.00 0.00 H new ATOM 0 HD22 LEU A 122 117.754 12.688 1.984 1.00 0.00 H new ATOM 0 HD23 LEU A 122 117.082 13.796 3.204 1.00 0.00 H new ATOM 2012 N GLN A 123 116.345 17.951 0.879 1.00 0.00 N ATOM 2013 CA GLN A 123 115.135 18.785 1.083 1.00 0.00 C ATOM 2014 C GLN A 123 114.786 19.446 -0.244 1.00 0.00 C ATOM 2015 O GLN A 123 113.633 19.551 -0.614 1.00 0.00 O ATOM 2016 CB GLN A 123 115.403 19.850 2.147 1.00 0.00 C ATOM 2017 CG GLN A 123 115.466 19.189 3.525 1.00 0.00 C ATOM 2018 CD GLN A 123 115.722 20.256 4.589 1.00 0.00 C ATOM 2019 OE1 GLN A 123 116.837 20.705 4.762 1.00 0.00 O ATOM 2020 NE2 GLN A 123 114.721 20.692 5.300 1.00 0.00 N ATOM 0 H GLN A 123 117.151 18.203 1.451 1.00 0.00 H new ATOM 0 HA GLN A 123 114.305 18.166 1.424 1.00 0.00 H new ATOM 0 HB2 GLN A 123 116.341 20.363 1.935 1.00 0.00 H new ATOM 0 HB3 GLN A 123 114.616 20.604 2.129 1.00 0.00 H new ATOM 0 HG2 GLN A 123 114.531 18.668 3.734 1.00 0.00 H new ATOM 0 HG3 GLN A 123 116.259 18.441 3.546 1.00 0.00 H new ATOM 0 HE21 GLN A 123 113.786 20.312 5.151 1.00 0.00 H new ATOM 0 HE22 GLN A 123 114.872 21.413 6.005 1.00 0.00 H new ATOM 2029 N ALA A 124 115.776 19.876 -0.977 1.00 0.00 N ATOM 2030 CA ALA A 124 115.494 20.507 -2.293 1.00 0.00 C ATOM 2031 C ALA A 124 114.715 19.501 -3.143 1.00 0.00 C ATOM 2032 O ALA A 124 113.798 19.853 -3.860 1.00 0.00 O ATOM 2033 CB ALA A 124 116.812 20.863 -2.987 1.00 0.00 C ATOM 0 H ALA A 124 116.762 19.817 -0.722 1.00 0.00 H new ATOM 0 HA ALA A 124 114.913 21.419 -2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 124 116.602 21.325 -3.951 1.00 0.00 H new ATOM 0 HB2 ALA A 124 117.374 21.560 -2.365 1.00 0.00 H new ATOM 0 HB3 ALA A 124 117.399 19.957 -3.139 1.00 0.00 H new ATOM 2039 N ALA A 125 115.070 18.246 -3.054 1.00 0.00 N ATOM 2040 CA ALA A 125 114.348 17.206 -3.839 1.00 0.00 C ATOM 2041 C ALA A 125 112.908 17.118 -3.332 1.00 0.00 C ATOM 2042 O ALA A 125 111.967 17.090 -4.100 1.00 0.00 O ATOM 2043 CB ALA A 125 115.050 15.855 -3.649 1.00 0.00 C ATOM 0 H ALA A 125 115.830 17.897 -2.470 1.00 0.00 H new ATOM 0 HA ALA A 125 114.347 17.465 -4.898 1.00 0.00 H new ATOM 0 HB1 ALA A 125 114.526 15.089 -4.221 1.00 0.00 H new ATOM 0 HB2 ALA A 125 116.080 15.928 -3.998 1.00 0.00 H new ATOM 0 HB3 ALA A 125 115.043 15.587 -2.593 1.00 0.00 H new ATOM 2049 N ILE A 126 112.729 17.090 -2.039 1.00 0.00 N ATOM 2050 CA ILE A 126 111.348 17.021 -1.484 1.00 0.00 C ATOM 2051 C ILE A 126 110.645 18.355 -1.738 1.00 0.00 C ATOM 2052 O ILE A 126 109.488 18.400 -2.104 1.00 0.00 O ATOM 2053 CB ILE A 126 111.409 16.749 0.022 1.00 0.00 C ATOM 2054 CG1 ILE A 126 112.055 15.382 0.262 1.00 0.00 C ATOM 2055 CG2 ILE A 126 109.990 16.748 0.595 1.00 0.00 C ATOM 2056 CD1 ILE A 126 112.348 15.206 1.754 1.00 0.00 C ATOM 0 H ILE A 126 113.477 17.112 -1.346 1.00 0.00 H new ATOM 0 HA ILE A 126 110.797 16.215 -1.968 1.00 0.00 H new ATOM 0 HB ILE A 126 111.999 17.524 0.511 1.00 0.00 H new ATOM 0 HG12 ILE A 126 111.392 14.589 -0.084 1.00 0.00 H new ATOM 0 HG13 ILE A 126 112.978 15.299 -0.312 1.00 0.00 H new ATOM 0 HG21 ILE A 126 110.031 16.555 1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 126 109.526 17.718 0.419 1.00 0.00 H new ATOM 0 HG23 ILE A 126 109.402 15.970 0.108 1.00 0.00 H new ATOM 0 HD11 ILE A 126 112.808 14.232 1.922 1.00 0.00 H new ATOM 0 HD12 ILE A 126 113.028 15.990 2.086 1.00 0.00 H new ATOM 0 HD13 ILE A 126 111.417 15.270 2.318 1.00 0.00 H new ATOM 2068 N ASP A 127 111.343 19.443 -1.557 1.00 0.00 N ATOM 2069 CA ASP A 127 110.724 20.775 -1.802 1.00 0.00 C ATOM 2070 C ASP A 127 110.279 20.843 -3.262 1.00 0.00 C ATOM 2071 O ASP A 127 109.225 21.360 -3.579 1.00 0.00 O ATOM 2072 CB ASP A 127 111.746 21.879 -1.519 1.00 0.00 C ATOM 2073 CG ASP A 127 111.107 23.247 -1.771 1.00 0.00 C ATOM 2074 OD1 ASP A 127 110.034 23.283 -2.350 1.00 0.00 O ATOM 2075 OD2 ASP A 127 111.702 24.237 -1.376 1.00 0.00 O ATOM 0 H ASP A 127 112.315 19.466 -1.250 1.00 0.00 H new ATOM 0 HA ASP A 127 109.866 20.915 -1.145 1.00 0.00 H new ATOM 0 HB2 ASP A 127 112.092 21.812 -0.488 1.00 0.00 H new ATOM 0 HB3 ASP A 127 112.620 21.752 -2.157 1.00 0.00 H new ATOM 2080 N GLY A 128 111.076 20.319 -4.154 1.00 0.00 N ATOM 2081 CA GLY A 128 110.702 20.344 -5.594 1.00 0.00 C ATOM 2082 C GLY A 128 109.367 19.627 -5.765 1.00 0.00 C ATOM 2083 O GLY A 128 108.553 19.992 -6.589 1.00 0.00 O ATOM 0 H GLY A 128 111.970 19.875 -3.946 1.00 0.00 H new ATOM 0 HA2 GLY A 128 110.626 21.373 -5.947 1.00 0.00 H new ATOM 0 HA3 GLY A 128 111.472 19.857 -6.193 1.00 0.00 H new ATOM 2087 N ASN A 129 109.128 18.614 -4.979 1.00 0.00 N ATOM 2088 CA ASN A 129 107.836 17.887 -5.084 1.00 0.00 C ATOM 2089 C ASN A 129 106.704 18.877 -4.804 1.00 0.00 C ATOM 2090 O ASN A 129 105.654 18.827 -5.413 1.00 0.00 O ATOM 2091 CB ASN A 129 107.801 16.752 -4.057 1.00 0.00 C ATOM 2092 CG ASN A 129 106.662 15.790 -4.400 1.00 0.00 C ATOM 2093 OD1 ASN A 129 106.512 14.760 -3.775 1.00 0.00 O ATOM 2094 ND2 ASN A 129 105.847 16.088 -5.375 1.00 0.00 N ATOM 0 H ASN A 129 109.771 18.260 -4.271 1.00 0.00 H new ATOM 0 HA ASN A 129 107.721 17.461 -6.081 1.00 0.00 H new ATOM 0 HB2 ASN A 129 108.752 16.220 -4.054 1.00 0.00 H new ATOM 0 HB3 ASN A 129 107.660 17.158 -3.055 1.00 0.00 H new ATOM 0 HD21 ASN A 129 105.083 15.455 -5.613 1.00 0.00 H new ATOM 0 HD22 ASN A 129 105.974 16.954 -5.899 1.00 0.00 H new ATOM 2101 N ARG A 130 106.922 19.787 -3.891 1.00 0.00 N ATOM 2102 CA ARG A 130 105.876 20.799 -3.571 1.00 0.00 C ATOM 2103 C ARG A 130 104.564 20.095 -3.219 1.00 0.00 C ATOM 2104 O ARG A 130 103.850 20.504 -2.325 1.00 0.00 O ATOM 2105 CB ARG A 130 105.664 21.705 -4.787 1.00 0.00 C ATOM 2106 CG ARG A 130 104.721 22.852 -4.424 1.00 0.00 C ATOM 2107 CD ARG A 130 104.530 23.752 -5.647 1.00 0.00 C ATOM 2108 NE ARG A 130 103.735 23.020 -6.679 1.00 0.00 N ATOM 2109 CZ ARG A 130 104.007 23.164 -7.951 1.00 0.00 C ATOM 2110 NH1 ARG A 130 104.942 22.438 -8.504 1.00 0.00 N ATOM 2111 NH2 ARG A 130 103.346 24.031 -8.667 1.00 0.00 N ATOM 0 H ARG A 130 107.784 19.872 -3.352 1.00 0.00 H new ATOM 0 HA ARG A 130 106.198 21.398 -2.719 1.00 0.00 H new ATOM 0 HB2 ARG A 130 106.621 22.103 -5.126 1.00 0.00 H new ATOM 0 HB3 ARG A 130 105.248 21.128 -5.613 1.00 0.00 H new ATOM 0 HG2 ARG A 130 103.760 22.458 -4.094 1.00 0.00 H new ATOM 0 HG3 ARG A 130 105.132 23.428 -3.594 1.00 0.00 H new ATOM 0 HD2 ARG A 130 104.018 24.670 -5.361 1.00 0.00 H new ATOM 0 HD3 ARG A 130 105.499 24.041 -6.055 1.00 0.00 H new ATOM 0 HE ARG A 130 102.975 22.404 -6.390 1.00 0.00 H new ATOM 0 HH11 ARG A 130 105.459 21.760 -7.944 1.00 0.00 H new ATOM 0 HH12 ARG A 130 105.155 22.549 -9.495 1.00 0.00 H new ATOM 0 HH21 ARG A 130 102.616 24.598 -8.236 1.00 0.00 H new ATOM 0 HH22 ARG A 130 103.559 24.142 -9.658 1.00 0.00 H new TER 2125 ARG A 130