USER MOD reduce.3.24.130724 H: found=0, std=0, add=1077, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1073 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 65 SER OG : rot 104:sc= -0.145 USER MOD Set 1.2: A 74 HIS : no HD1:sc= -0.277 K(o=-0.42,f=-3.8) USER MOD Set 2.1: A 26 HIS : no HE2:sc= -10.1! C(o=-11!,f=-14!) USER MOD Set 2.2: A 96 THR OG1 : rot -52:sc= -0.792 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0326) USER MOD Single : A 13 GLN : amide:sc= -0.0831 X(o=-0.083,f=-0.0065) USER MOD Single : A 14 ASN : amide:sc= -2.39 K(o=-2.4,f=-3.7!) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -9:sc= 0.276 USER MOD Single : A 33 MET CE :methyl -169:sc= -2.09 (180deg=-3.02) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.287 X(o=-0.29,f=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 85:sc= 0.858 USER MOD Single : A 54 GLN : amide:sc= -11.3! C(o=-11!,f=-19!) USER MOD Single : A 57 LYS NZ :NH3+ 160:sc= -0.0411 (180deg=-0.243) USER MOD Single : A 67 LYS NZ :NH3+ -175:sc= 0.841 (180deg=0.78) USER MOD Single : A 68 TYR OH : rot 80:sc= 0.295 USER MOD Single : A 69 ASN : amide:sc= -0.065 K(o=-0.065,f=-1.3) USER MOD Single : A 73 LYS NZ :NH3+ 168:sc= 0.0878 (180deg=-0.485!) USER MOD Single : A 76 LYS NZ :NH3+ 171:sc= -0.0751 (180deg=-0.201) USER MOD Single : A 78 MET CE :methyl 142:sc= -0.427 (180deg=-3.47!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= -0.346 USER MOD Single : A 89 LYS NZ :NH3+ 149:sc= -1.51! (180deg=-3.2!) USER MOD Single : A 90 LYS NZ :NH3+ 135:sc= 0.362 (180deg=-0.168) USER MOD Single : A 102 TYR OH : rot 153:sc= -2.88 USER MOD Single : A 103 GLN : amide:sc= -5.48! C(o=-5.5!,f=-13!) USER MOD Single : A 104 GLN : amide:sc= 0.172 X(o=0.17,f=0) USER MOD Single : A 105 ASN : amide:sc= -2.08! K(o=-2.1!,f=-1) USER MOD Single : A 106 SER OG : rot 10:sc= -0.164 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 CYS SG : rot -105:sc= 0.425 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= -0.0096 USER MOD Single : A 116 THR OG1 : rot 78:sc= 0.491! USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -2.73! C(o=-2.7!,f=-4.5!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.577 -42.678 18.031 1.00 0.00 N ATOM 2 CA GLY A 1 -4.372 -43.683 17.349 1.00 0.00 C ATOM 3 C GLY A 1 -5.776 -43.790 17.909 1.00 0.00 C ATOM 4 O GLY A 1 -6.076 -44.701 18.681 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.626 -42.644 17.611 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.033 -41.749 17.932 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.502 -42.921 19.040 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -4.425 -43.441 16.288 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.877 -44.651 17.431 1.00 0.00 H new ATOM 8 N SER A 2 -6.639 -42.857 17.521 1.00 0.00 N ATOM 9 CA SER A 2 -8.019 -42.847 17.994 1.00 0.00 C ATOM 10 C SER A 2 -8.983 -43.198 16.865 1.00 0.00 C ATOM 11 O SER A 2 -8.686 -42.980 15.690 1.00 0.00 O ATOM 12 CB SER A 2 -8.372 -41.476 18.574 1.00 0.00 C ATOM 13 OG SER A 2 -9.433 -41.575 19.508 1.00 0.00 O ATOM 0 H SER A 2 -6.407 -42.098 16.880 1.00 0.00 H new ATOM 0 HA SER A 2 -8.114 -43.600 18.777 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.495 -41.046 19.059 1.00 0.00 H new ATOM 0 HB3 SER A 2 -8.655 -40.799 17.768 1.00 0.00 H new ATOM 0 HG SER A 2 -9.638 -40.686 19.865 1.00 0.00 H new ATOM 19 N SER A 3 -10.138 -43.744 17.230 1.00 0.00 N ATOM 20 CA SER A 3 -11.146 -44.130 16.249 1.00 0.00 C ATOM 21 C SER A 3 -12.068 -42.958 15.928 1.00 0.00 C ATOM 22 O SER A 3 -13.283 -43.120 15.819 1.00 0.00 O ATOM 23 CB SER A 3 -11.967 -45.312 16.767 1.00 0.00 C ATOM 24 OG SER A 3 -12.498 -46.072 15.696 1.00 0.00 O ATOM 0 H SER A 3 -10.400 -43.929 18.198 1.00 0.00 H new ATOM 0 HA SER A 3 -10.632 -44.427 15.335 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.340 -45.948 17.393 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.779 -44.947 17.396 1.00 0.00 H new ATOM 0 HG SER A 3 -13.017 -46.822 16.053 1.00 0.00 H new ATOM 30 N GLY A 4 -11.481 -41.774 15.778 1.00 0.00 N ATOM 31 CA GLY A 4 -12.263 -40.591 15.471 1.00 0.00 C ATOM 32 C GLY A 4 -12.119 -40.159 14.025 1.00 0.00 C ATOM 33 O GLY A 4 -11.216 -39.394 13.686 1.00 0.00 O ATOM 0 H GLY A 4 -10.477 -41.613 15.864 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.313 -40.788 15.685 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.953 -39.775 16.123 1.00 0.00 H new ATOM 37 N SER A 5 -13.009 -40.651 13.170 1.00 0.00 N ATOM 38 CA SER A 5 -12.974 -40.316 11.752 1.00 0.00 C ATOM 39 C SER A 5 -13.534 -38.918 11.510 1.00 0.00 C ATOM 40 O SER A 5 -12.941 -38.116 10.788 1.00 0.00 O ATOM 41 CB SER A 5 -13.769 -41.343 10.943 1.00 0.00 C ATOM 42 OG SER A 5 -12.960 -42.452 10.591 1.00 0.00 O ATOM 0 H SER A 5 -13.764 -41.284 13.435 1.00 0.00 H new ATOM 0 HA SER A 5 -11.934 -40.334 11.426 1.00 0.00 H new ATOM 0 HB2 SER A 5 -14.626 -41.684 11.524 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.162 -40.875 10.041 1.00 0.00 H new ATOM 0 HG SER A 5 -13.492 -43.094 10.076 1.00 0.00 H new ATOM 48 N SER A 6 -14.680 -38.633 12.119 1.00 0.00 N ATOM 49 CA SER A 6 -15.324 -37.333 11.968 1.00 0.00 C ATOM 50 C SER A 6 -14.479 -36.232 12.601 1.00 0.00 C ATOM 51 O SER A 6 -14.275 -36.210 13.814 1.00 0.00 O ATOM 52 CB SER A 6 -16.716 -37.352 12.603 1.00 0.00 C ATOM 53 OG SER A 6 -17.478 -36.229 12.195 1.00 0.00 O ATOM 0 H SER A 6 -15.182 -39.285 12.722 1.00 0.00 H new ATOM 0 HA SER A 6 -15.422 -37.125 10.902 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.235 -38.269 12.322 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.624 -37.358 13.689 1.00 0.00 H new ATOM 0 HG SER A 6 -18.364 -36.265 12.613 1.00 0.00 H new ATOM 59 N GLY A 7 -13.990 -35.317 11.768 1.00 0.00 N ATOM 60 CA GLY A 7 -13.173 -34.225 12.264 1.00 0.00 C ATOM 61 C GLY A 7 -12.850 -33.208 11.187 1.00 0.00 C ATOM 62 O GLY A 7 -13.261 -32.051 11.271 1.00 0.00 O ATOM 0 H GLY A 7 -14.145 -35.313 10.760 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -13.693 -33.729 13.084 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.245 -34.626 12.672 1.00 0.00 H new ATOM 66 N LYS A 8 -12.109 -33.639 10.172 1.00 0.00 N ATOM 67 CA LYS A 8 -11.729 -32.759 9.073 1.00 0.00 C ATOM 68 C LYS A 8 -12.108 -33.373 7.729 1.00 0.00 C ATOM 69 O LYS A 8 -11.423 -34.265 7.229 1.00 0.00 O ATOM 70 CB LYS A 8 -10.225 -32.479 9.113 1.00 0.00 C ATOM 71 CG LYS A 8 -9.848 -31.309 10.005 1.00 0.00 C ATOM 72 CD LYS A 8 -8.391 -30.918 9.824 1.00 0.00 C ATOM 73 CE LYS A 8 -8.106 -29.543 10.410 1.00 0.00 C ATOM 74 NZ LYS A 8 -8.620 -28.451 9.538 1.00 0.00 N ATOM 0 H LYS A 8 -11.759 -34.593 10.088 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.270 -31.820 9.189 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -9.707 -33.372 9.461 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -9.874 -32.281 8.100 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -10.486 -30.455 9.776 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -10.029 -31.572 11.047 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.752 -31.659 10.304 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.141 -30.921 8.763 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.564 -29.466 11.396 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -7.031 -29.423 10.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.318 -27.531 9.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.242 -28.568 8.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.659 -28.490 9.509 1.00 0.00 H new ATOM 88 N ALA A 9 -13.200 -32.887 7.148 1.00 0.00 N ATOM 89 CA ALA A 9 -13.667 -33.386 5.860 1.00 0.00 C ATOM 90 C ALA A 9 -13.262 -32.447 4.729 1.00 0.00 C ATOM 91 O ALA A 9 -13.943 -32.362 3.708 1.00 0.00 O ATOM 92 CB ALA A 9 -15.177 -33.571 5.881 1.00 0.00 C ATOM 0 H ALA A 9 -13.778 -32.148 7.549 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.197 -34.353 5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -15.511 -33.944 4.913 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -15.445 -34.287 6.658 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -15.658 -32.615 6.087 1.00 0.00 H new ATOM 98 N GLU A 10 -12.150 -31.744 4.919 1.00 0.00 N ATOM 99 CA GLU A 10 -11.657 -30.809 3.914 1.00 0.00 C ATOM 100 C GLU A 10 -10.134 -30.725 3.950 1.00 0.00 C ATOM 101 O GLU A 10 -9.529 -30.700 5.021 1.00 0.00 O ATOM 102 CB GLU A 10 -12.261 -29.421 4.135 1.00 0.00 C ATOM 103 CG GLU A 10 -11.763 -28.735 5.396 1.00 0.00 C ATOM 104 CD GLU A 10 -12.043 -27.244 5.397 1.00 0.00 C ATOM 105 OE1 GLU A 10 -11.682 -26.572 4.409 1.00 0.00 O ATOM 106 OE2 GLU A 10 -12.623 -26.750 6.387 1.00 0.00 O ATOM 0 H GLU A 10 -11.574 -31.804 5.759 1.00 0.00 H new ATOM 0 HA GLU A 10 -11.960 -31.176 2.934 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.031 -28.793 3.275 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -13.346 -29.510 4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -12.238 -29.191 6.265 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -10.690 -28.900 5.496 1.00 0.00 H new ATOM 113 N ALA A 11 -9.521 -30.681 2.772 1.00 0.00 N ATOM 114 CA ALA A 11 -8.069 -30.598 2.668 1.00 0.00 C ATOM 115 C ALA A 11 -7.652 -29.646 1.552 1.00 0.00 C ATOM 116 O ALA A 11 -8.419 -29.390 0.625 1.00 0.00 O ATOM 117 CB ALA A 11 -7.477 -31.980 2.436 1.00 0.00 C ATOM 0 H ALA A 11 -10.007 -30.701 1.876 1.00 0.00 H new ATOM 0 HA ALA A 11 -7.684 -30.203 3.608 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -6.392 -31.903 2.360 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -7.737 -32.632 3.270 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -7.877 -32.396 1.511 1.00 0.00 H new ATOM 123 N GLU A 12 -6.433 -29.126 1.649 1.00 0.00 N ATOM 124 CA GLU A 12 -5.916 -28.201 0.647 1.00 0.00 C ATOM 125 C GLU A 12 -4.737 -28.815 -0.103 1.00 0.00 C ATOM 126 O GLU A 12 -3.772 -28.126 -0.431 1.00 0.00 O ATOM 127 CB GLU A 12 -5.487 -26.888 1.306 1.00 0.00 C ATOM 128 CG GLU A 12 -6.577 -26.244 2.146 1.00 0.00 C ATOM 129 CD GLU A 12 -7.440 -25.286 1.347 1.00 0.00 C ATOM 130 OE1 GLU A 12 -8.236 -25.762 0.511 1.00 0.00 O ATOM 131 OE2 GLU A 12 -7.319 -24.061 1.558 1.00 0.00 O ATOM 0 H GLU A 12 -5.785 -29.329 2.410 1.00 0.00 H new ATOM 0 HA GLU A 12 -6.713 -27.997 -0.068 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -4.617 -27.075 1.936 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -5.175 -26.187 0.531 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -7.207 -27.023 2.576 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -6.120 -25.708 2.978 1.00 0.00 H new ATOM 138 N GLN A 13 -4.826 -30.114 -0.370 1.00 0.00 N ATOM 139 CA GLN A 13 -3.766 -30.821 -1.080 1.00 0.00 C ATOM 140 C GLN A 13 -4.233 -31.248 -2.468 1.00 0.00 C ATOM 141 O GLN A 13 -5.397 -31.596 -2.662 1.00 0.00 O ATOM 142 CB GLN A 13 -3.316 -32.045 -0.280 1.00 0.00 C ATOM 143 CG GLN A 13 -2.810 -31.709 1.113 1.00 0.00 C ATOM 144 CD GLN A 13 -1.491 -30.962 1.090 1.00 0.00 C ATOM 145 OE1 GLN A 13 -0.420 -31.568 1.125 1.00 0.00 O ATOM 146 NE2 GLN A 13 -1.562 -29.637 1.031 1.00 0.00 N ATOM 0 H GLN A 13 -5.620 -30.698 -0.106 1.00 0.00 H new ATOM 0 HA GLN A 13 -2.922 -30.141 -1.194 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -4.151 -32.741 -0.196 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -2.527 -32.558 -0.830 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.556 -31.106 1.631 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -2.692 -32.630 1.684 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -2.471 -29.176 1.004 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -0.707 -29.081 1.013 1.00 0.00 H new ATOM 155 N ASN A 14 -3.316 -31.220 -3.430 1.00 0.00 N ATOM 156 CA ASN A 14 -3.634 -31.604 -4.800 1.00 0.00 C ATOM 157 C ASN A 14 -2.364 -31.912 -5.587 1.00 0.00 C ATOM 158 O ASN A 14 -1.254 -31.696 -5.102 1.00 0.00 O ATOM 159 CB ASN A 14 -4.421 -30.491 -5.494 1.00 0.00 C ATOM 160 CG ASN A 14 -3.884 -29.111 -5.164 1.00 0.00 C ATOM 161 OD1 ASN A 14 -3.933 -28.673 -4.014 1.00 0.00 O ATOM 162 ND2 ASN A 14 -3.369 -28.420 -6.174 1.00 0.00 N ATOM 0 H ASN A 14 -2.347 -30.935 -3.286 1.00 0.00 H new ATOM 0 HA ASN A 14 -4.246 -32.505 -4.766 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -4.386 -30.643 -6.573 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -5.468 -30.551 -5.198 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -2.993 -27.486 -6.013 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -3.350 -28.824 -7.111 1.00 0.00 H new ATOM 169 N TRP A 15 -2.537 -32.416 -6.804 1.00 0.00 N ATOM 170 CA TRP A 15 -1.404 -32.753 -7.659 1.00 0.00 C ATOM 171 C TRP A 15 -1.133 -31.641 -8.666 1.00 0.00 C ATOM 172 O TRP A 15 -0.856 -31.905 -9.836 1.00 0.00 O ATOM 173 CB TRP A 15 -1.666 -34.070 -8.392 1.00 0.00 C ATOM 174 CG TRP A 15 -2.981 -34.097 -9.112 1.00 0.00 C ATOM 175 CD1 TRP A 15 -3.219 -33.702 -10.398 1.00 0.00 C ATOM 176 CD2 TRP A 15 -4.236 -34.540 -8.587 1.00 0.00 C ATOM 177 NE1 TRP A 15 -4.548 -33.874 -10.704 1.00 0.00 N ATOM 178 CE2 TRP A 15 -5.193 -34.387 -9.610 1.00 0.00 C ATOM 179 CE3 TRP A 15 -4.646 -35.054 -7.354 1.00 0.00 C ATOM 180 CZ2 TRP A 15 -6.531 -34.729 -9.434 1.00 0.00 C ATOM 181 CZ3 TRP A 15 -5.974 -35.392 -7.181 1.00 0.00 C ATOM 182 CH2 TRP A 15 -6.904 -35.229 -8.216 1.00 0.00 C ATOM 0 H TRP A 15 -3.450 -32.600 -7.221 1.00 0.00 H new ATOM 0 HA TRP A 15 -0.524 -32.867 -7.026 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -0.864 -34.245 -9.109 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -1.636 -34.890 -7.674 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -2.473 -33.312 -11.075 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -4.983 -33.655 -11.600 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -3.937 -35.185 -6.550 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -7.249 -34.604 -10.231 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -6.301 -35.789 -6.231 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -7.935 -35.503 -8.049 1.00 0.00 H new ATOM 193 N TRP A 16 -1.215 -30.398 -8.205 1.00 0.00 N ATOM 194 CA TRP A 16 -0.977 -29.246 -9.067 1.00 0.00 C ATOM 195 C TRP A 16 0.242 -28.459 -8.600 1.00 0.00 C ATOM 196 O TRP A 16 0.453 -28.279 -7.401 1.00 0.00 O ATOM 197 CB TRP A 16 -2.208 -28.338 -9.090 1.00 0.00 C ATOM 198 CG TRP A 16 -2.361 -27.577 -10.372 1.00 0.00 C ATOM 199 CD1 TRP A 16 -2.063 -26.261 -10.584 1.00 0.00 C ATOM 200 CD2 TRP A 16 -2.850 -28.086 -11.617 1.00 0.00 C ATOM 201 NE1 TRP A 16 -2.338 -25.921 -11.887 1.00 0.00 N ATOM 202 CE2 TRP A 16 -2.821 -27.023 -12.542 1.00 0.00 C ATOM 203 CE3 TRP A 16 -3.309 -29.336 -12.043 1.00 0.00 C ATOM 204 CZ2 TRP A 16 -3.234 -27.174 -13.863 1.00 0.00 C ATOM 205 CZ3 TRP A 16 -3.718 -29.484 -13.354 1.00 0.00 C ATOM 206 CH2 TRP A 16 -3.678 -28.409 -14.252 1.00 0.00 C ATOM 0 H TRP A 16 -1.444 -30.162 -7.240 1.00 0.00 H new ATOM 0 HA TRP A 16 -0.785 -29.612 -10.076 1.00 0.00 H new ATOM 0 HB2 TRP A 16 -3.100 -28.943 -8.926 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -2.145 -27.632 -8.262 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -1.669 -25.587 -9.838 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -2.204 -24.998 -12.299 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -3.343 -30.171 -11.359 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -3.205 -26.346 -14.556 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -4.075 -30.445 -13.693 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.004 -28.558 -15.271 1.00 0.00 H new ATOM 217 N GLU A 17 1.040 -27.991 -9.554 1.00 0.00 N ATOM 218 CA GLU A 17 2.239 -27.223 -9.237 1.00 0.00 C ATOM 219 C GLU A 17 1.892 -25.992 -8.405 1.00 0.00 C ATOM 220 O GLU A 17 2.624 -25.623 -7.488 1.00 0.00 O ATOM 221 CB GLU A 17 2.954 -26.799 -10.522 1.00 0.00 C ATOM 222 CG GLU A 17 2.084 -25.979 -11.461 1.00 0.00 C ATOM 223 CD GLU A 17 2.892 -25.243 -12.511 1.00 0.00 C ATOM 224 OE1 GLU A 17 3.355 -24.119 -12.225 1.00 0.00 O ATOM 225 OE2 GLU A 17 3.061 -25.791 -13.621 1.00 0.00 O ATOM 0 H GLU A 17 0.879 -28.130 -10.552 1.00 0.00 H new ATOM 0 HA GLU A 17 2.904 -27.859 -8.653 1.00 0.00 H new ATOM 0 HB2 GLU A 17 3.839 -26.219 -10.261 1.00 0.00 H new ATOM 0 HB3 GLU A 17 3.300 -27.690 -11.046 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.368 -26.637 -11.954 1.00 0.00 H new ATOM 0 HG3 GLU A 17 1.508 -25.259 -10.880 1.00 0.00 H new ATOM 232 N GLY A 18 0.770 -25.359 -8.734 1.00 0.00 N ATOM 233 CA GLY A 18 0.345 -24.176 -8.009 1.00 0.00 C ATOM 234 C GLY A 18 -0.247 -23.119 -8.919 1.00 0.00 C ATOM 235 O GLY A 18 0.038 -23.070 -10.116 1.00 0.00 O ATOM 0 H GLY A 18 0.148 -25.645 -9.490 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -0.393 -24.459 -7.259 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.197 -23.755 -7.475 1.00 0.00 H new ATOM 239 N PRO A 19 -1.093 -22.248 -8.350 1.00 0.00 N ATOM 240 CA PRO A 19 -1.746 -21.171 -9.101 1.00 0.00 C ATOM 241 C PRO A 19 -0.764 -20.087 -9.530 1.00 0.00 C ATOM 242 O PRO A 19 0.174 -19.745 -8.809 1.00 0.00 O ATOM 243 CB PRO A 19 -2.762 -20.609 -8.105 1.00 0.00 C ATOM 244 CG PRO A 19 -2.202 -20.939 -6.764 1.00 0.00 C ATOM 245 CD PRO A 19 -1.479 -22.248 -6.929 1.00 0.00 C ATOM 0 HA PRO A 19 -2.193 -21.532 -10.027 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.884 -19.533 -8.229 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.745 -21.060 -8.245 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.523 -20.158 -6.422 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -2.994 -21.021 -6.020 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -0.608 -22.311 -6.276 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -2.121 -23.095 -6.687 1.00 0.00 H new ATOM 253 N PRO A 20 -0.982 -19.530 -10.731 1.00 0.00 N ATOM 254 CA PRO A 20 -0.127 -18.475 -11.281 1.00 0.00 C ATOM 255 C PRO A 20 -0.281 -17.155 -10.533 1.00 0.00 C ATOM 256 O PRO A 20 -1.394 -16.666 -10.342 1.00 0.00 O ATOM 257 CB PRO A 20 -0.623 -18.333 -12.723 1.00 0.00 C ATOM 258 CG PRO A 20 -2.035 -18.807 -12.686 1.00 0.00 C ATOM 259 CD PRO A 20 -2.081 -19.889 -11.643 1.00 0.00 C ATOM 0 HA PRO A 20 0.931 -18.725 -11.202 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -0.561 -17.299 -13.063 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -0.023 -18.931 -13.409 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -2.714 -17.992 -12.433 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -2.344 -19.189 -13.659 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -3.041 -19.909 -11.127 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -1.934 -20.876 -12.081 1.00 0.00 H new ATOM 267 N GLN A 21 0.844 -16.584 -10.113 1.00 0.00 N ATOM 268 CA GLN A 21 0.833 -15.321 -9.385 1.00 0.00 C ATOM 269 C GLN A 21 1.894 -14.370 -9.928 1.00 0.00 C ATOM 270 O GLN A 21 3.092 -14.600 -9.759 1.00 0.00 O ATOM 271 CB GLN A 21 1.065 -15.565 -7.893 1.00 0.00 C ATOM 272 CG GLN A 21 -0.201 -15.919 -7.130 1.00 0.00 C ATOM 273 CD GLN A 21 0.082 -16.693 -5.858 1.00 0.00 C ATOM 274 OE1 GLN A 21 -0.335 -17.843 -5.711 1.00 0.00 O ATOM 275 NE2 GLN A 21 0.793 -16.066 -4.928 1.00 0.00 N ATOM 0 H GLN A 21 1.773 -16.976 -10.264 1.00 0.00 H new ATOM 0 HA GLN A 21 -0.145 -14.861 -9.522 1.00 0.00 H new ATOM 0 HB2 GLN A 21 1.789 -16.371 -7.774 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.507 -14.672 -7.452 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -0.739 -15.004 -6.882 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -0.855 -16.509 -7.772 1.00 0.00 H new ATOM 0 HE21 GLN A 21 1.119 -15.113 -5.091 1.00 0.00 H new ATOM 0 HE22 GLN A 21 1.013 -16.537 -4.051 1.00 0.00 H new ATOM 284 N ASP A 22 1.448 -13.303 -10.581 1.00 0.00 N ATOM 285 CA ASP A 22 2.360 -12.317 -11.149 1.00 0.00 C ATOM 286 C ASP A 22 2.200 -10.967 -10.457 1.00 0.00 C ATOM 287 O ASP A 22 1.324 -10.176 -10.811 1.00 0.00 O ATOM 288 CB ASP A 22 2.112 -12.167 -12.651 1.00 0.00 C ATOM 289 CG ASP A 22 2.865 -13.199 -13.467 1.00 0.00 C ATOM 290 OD1 ASP A 22 2.847 -14.387 -13.083 1.00 0.00 O ATOM 291 OD2 ASP A 22 3.472 -12.819 -14.490 1.00 0.00 O ATOM 0 H ASP A 22 0.460 -13.098 -10.730 1.00 0.00 H new ATOM 0 HA ASP A 22 3.380 -12.668 -10.990 1.00 0.00 H new ATOM 0 HB2 ASP A 22 1.044 -12.258 -12.851 1.00 0.00 H new ATOM 0 HB3 ASP A 22 2.412 -11.168 -12.968 1.00 0.00 H new ATOM 296 N LEU A 23 3.049 -10.710 -9.469 1.00 0.00 N ATOM 297 CA LEU A 23 3.002 -9.455 -8.726 1.00 0.00 C ATOM 298 C LEU A 23 4.040 -8.470 -9.253 1.00 0.00 C ATOM 299 O LEU A 23 3.901 -7.258 -9.088 1.00 0.00 O ATOM 300 CB LEU A 23 3.236 -9.712 -7.236 1.00 0.00 C ATOM 301 CG LEU A 23 2.234 -10.640 -6.549 1.00 0.00 C ATOM 302 CD1 LEU A 23 2.703 -10.988 -5.145 1.00 0.00 C ATOM 303 CD2 LEU A 23 0.854 -9.999 -6.509 1.00 0.00 C ATOM 0 H LEU A 23 3.779 -11.354 -9.163 1.00 0.00 H new ATOM 0 HA LEU A 23 2.013 -9.018 -8.862 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.234 -10.133 -7.113 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.228 -8.754 -6.717 1.00 0.00 H new ATOM 0 HG LEU A 23 2.168 -11.562 -7.126 1.00 0.00 H new ATOM 0 HD11 LEU A 23 1.977 -11.649 -4.672 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.669 -11.489 -5.198 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.799 -10.075 -4.557 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.154 -10.674 -6.017 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.904 -9.061 -5.956 1.00 0.00 H new ATOM 0 HD23 LEU A 23 0.514 -9.803 -7.526 1.00 0.00 H new ATOM 315 N SER A 24 5.080 -8.999 -9.890 1.00 0.00 N ATOM 316 CA SER A 24 6.143 -8.167 -10.440 1.00 0.00 C ATOM 317 C SER A 24 5.579 -7.141 -11.418 1.00 0.00 C ATOM 318 O SER A 24 6.047 -6.004 -11.483 1.00 0.00 O ATOM 319 CB SER A 24 7.189 -9.036 -11.142 1.00 0.00 C ATOM 320 OG SER A 24 8.266 -8.250 -11.623 1.00 0.00 O ATOM 0 H SER A 24 5.209 -10.000 -10.038 1.00 0.00 H new ATOM 0 HA SER A 24 6.617 -7.635 -9.615 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.565 -9.789 -10.449 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.725 -9.570 -11.972 1.00 0.00 H new ATOM 0 HG SER A 24 8.921 -8.829 -12.066 1.00 0.00 H new ATOM 326 N VAL A 25 4.569 -7.551 -12.179 1.00 0.00 N ATOM 327 CA VAL A 25 3.938 -6.669 -13.153 1.00 0.00 C ATOM 328 C VAL A 25 3.477 -5.370 -12.502 1.00 0.00 C ATOM 329 O VAL A 25 3.337 -4.344 -13.168 1.00 0.00 O ATOM 330 CB VAL A 25 2.732 -7.349 -13.828 1.00 0.00 C ATOM 331 CG1 VAL A 25 3.146 -8.671 -14.456 1.00 0.00 C ATOM 332 CG2 VAL A 25 1.607 -7.554 -12.825 1.00 0.00 C ATOM 0 H VAL A 25 4.170 -8.489 -12.139 1.00 0.00 H new ATOM 0 HA VAL A 25 4.690 -6.445 -13.910 1.00 0.00 H new ATOM 0 HB VAL A 25 2.366 -6.697 -14.621 1.00 0.00 H new ATOM 0 HG11 VAL A 25 2.281 -9.136 -14.928 1.00 0.00 H new ATOM 0 HG12 VAL A 25 3.916 -8.492 -15.206 1.00 0.00 H new ATOM 0 HG13 VAL A 25 3.538 -9.333 -13.684 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.763 -8.036 -13.319 1.00 0.00 H new ATOM 0 HG22 VAL A 25 1.958 -8.185 -12.008 1.00 0.00 H new ATOM 0 HG23 VAL A 25 1.293 -6.589 -12.428 1.00 0.00 H new ATOM 342 N HIS A 26 3.241 -5.422 -11.194 1.00 0.00 N ATOM 343 CA HIS A 26 2.795 -4.249 -10.451 1.00 0.00 C ATOM 344 C HIS A 26 3.916 -3.219 -10.339 1.00 0.00 C ATOM 345 O HIS A 26 5.094 -3.551 -10.471 1.00 0.00 O ATOM 346 CB HIS A 26 2.318 -4.654 -9.056 1.00 0.00 C ATOM 347 CG HIS A 26 1.339 -5.787 -9.063 1.00 0.00 C ATOM 348 ND1 HIS A 26 0.308 -5.884 -9.974 1.00 0.00 N ATOM 349 CD2 HIS A 26 1.239 -6.876 -8.266 1.00 0.00 C ATOM 350 CE1 HIS A 26 -0.385 -6.983 -9.734 1.00 0.00 C ATOM 351 NE2 HIS A 26 0.159 -7.603 -8.703 1.00 0.00 N ATOM 0 H HIS A 26 3.351 -6.263 -10.628 1.00 0.00 H new ATOM 0 HA HIS A 26 1.964 -3.799 -10.994 1.00 0.00 H new ATOM 0 HB2 HIS A 26 3.182 -4.935 -8.453 1.00 0.00 H new ATOM 0 HB3 HIS A 26 1.859 -3.791 -8.573 1.00 0.00 H new ATOM 0 HD1 HIS A 26 0.111 -5.213 -10.716 1.00 0.00 H new ATOM 0 HD2 HIS A 26 1.888 -7.127 -7.440 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.250 -7.318 -10.287 1.00 0.00 H new ATOM 359 N LEU A 27 3.540 -1.968 -10.096 1.00 0.00 N ATOM 360 CA LEU A 27 4.513 -0.889 -9.968 1.00 0.00 C ATOM 361 C LEU A 27 5.015 -0.776 -8.532 1.00 0.00 C ATOM 362 O LEU A 27 6.171 -0.426 -8.293 1.00 0.00 O ATOM 363 CB LEU A 27 3.894 0.439 -10.408 1.00 0.00 C ATOM 364 CG LEU A 27 3.676 0.611 -11.912 1.00 0.00 C ATOM 365 CD1 LEU A 27 2.963 1.923 -12.201 1.00 0.00 C ATOM 366 CD2 LEU A 27 5.004 0.549 -12.654 1.00 0.00 C ATOM 0 H LEU A 27 2.569 -1.676 -9.984 1.00 0.00 H new ATOM 0 HA LEU A 27 5.360 -1.120 -10.614 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.933 0.553 -9.906 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.534 1.249 -10.059 1.00 0.00 H new ATOM 0 HG LEU A 27 3.047 -0.206 -12.265 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.816 2.028 -13.276 1.00 0.00 H new ATOM 0 HD12 LEU A 27 1.995 1.929 -11.700 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.566 2.753 -11.834 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.830 0.673 -13.723 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.657 1.346 -12.298 1.00 0.00 H new ATOM 0 HD23 LEU A 27 5.477 -0.416 -12.473 1.00 0.00 H new ATOM 378 N TRP A 28 4.140 -1.078 -7.579 1.00 0.00 N ATOM 379 CA TRP A 28 4.495 -1.013 -6.166 1.00 0.00 C ATOM 380 C TRP A 28 5.207 -2.287 -5.725 1.00 0.00 C ATOM 381 O TRP A 28 5.291 -2.581 -4.532 1.00 0.00 O ATOM 382 CB TRP A 28 3.244 -0.792 -5.314 1.00 0.00 C ATOM 383 CG TRP A 28 2.043 -1.531 -5.820 1.00 0.00 C ATOM 384 CD1 TRP A 28 0.971 -0.999 -6.480 1.00 0.00 C ATOM 385 CD2 TRP A 28 1.790 -2.935 -5.706 1.00 0.00 C ATOM 386 NE1 TRP A 28 0.067 -1.989 -6.782 1.00 0.00 N ATOM 387 CE2 TRP A 28 0.546 -3.186 -6.319 1.00 0.00 C ATOM 388 CE3 TRP A 28 2.493 -4.006 -5.148 1.00 0.00 C ATOM 389 CZ2 TRP A 28 -0.006 -4.462 -6.387 1.00 0.00 C ATOM 390 CZ3 TRP A 28 1.943 -5.272 -5.216 1.00 0.00 C ATOM 391 CH2 TRP A 28 0.704 -5.492 -5.832 1.00 0.00 C ATOM 0 H TRP A 28 3.180 -1.370 -7.759 1.00 0.00 H new ATOM 0 HA TRP A 28 5.174 -0.172 -6.026 1.00 0.00 H new ATOM 0 HB2 TRP A 28 3.450 -1.106 -4.291 1.00 0.00 H new ATOM 0 HB3 TRP A 28 3.019 0.274 -5.282 1.00 0.00 H new ATOM 0 HD1 TRP A 28 0.852 0.045 -6.728 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -0.818 -1.854 -7.272 1.00 0.00 H new ATOM 0 HE3 TRP A 28 3.449 -3.847 -4.672 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -0.961 -4.633 -6.861 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 2.478 -6.106 -4.787 1.00 0.00 H new ATOM 0 HH2 TRP A 28 0.302 -6.494 -5.870 1.00 0.00 H new ATOM 402 N TYR A 29 5.718 -3.040 -6.693 1.00 0.00 N ATOM 403 CA TYR A 29 6.421 -4.284 -6.403 1.00 0.00 C ATOM 404 C TYR A 29 7.905 -4.162 -6.737 1.00 0.00 C ATOM 405 O TYR A 29 8.309 -4.321 -7.888 1.00 0.00 O ATOM 406 CB TYR A 29 5.803 -5.439 -7.192 1.00 0.00 C ATOM 407 CG TYR A 29 6.019 -6.793 -6.554 1.00 0.00 C ATOM 408 CD1 TYR A 29 5.205 -7.230 -5.516 1.00 0.00 C ATOM 409 CD2 TYR A 29 7.036 -7.633 -6.987 1.00 0.00 C ATOM 410 CE1 TYR A 29 5.398 -8.466 -4.929 1.00 0.00 C ATOM 411 CE2 TYR A 29 7.236 -8.871 -6.407 1.00 0.00 C ATOM 412 CZ TYR A 29 6.414 -9.282 -5.378 1.00 0.00 C ATOM 413 OH TYR A 29 6.611 -10.514 -4.796 1.00 0.00 O ATOM 0 H TYR A 29 5.658 -2.811 -7.685 1.00 0.00 H new ATOM 0 HA TYR A 29 6.323 -4.487 -5.337 1.00 0.00 H new ATOM 0 HB2 TYR A 29 4.732 -5.263 -7.298 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.226 -5.449 -8.197 1.00 0.00 H new ATOM 0 HD1 TYR A 29 4.408 -6.593 -5.162 1.00 0.00 H new ATOM 0 HD2 TYR A 29 7.682 -7.313 -7.791 1.00 0.00 H new ATOM 0 HE1 TYR A 29 4.756 -8.791 -4.123 1.00 0.00 H new ATOM 0 HE2 TYR A 29 8.031 -9.513 -6.757 1.00 0.00 H new ATOM 0 HH TYR A 29 6.048 -10.592 -3.998 1.00 0.00 H new ATOM 423 N ALA A 30 8.712 -3.878 -5.719 1.00 0.00 N ATOM 424 CA ALA A 30 10.151 -3.737 -5.902 1.00 0.00 C ATOM 425 C ALA A 30 10.885 -5.006 -5.482 1.00 0.00 C ATOM 426 O ALA A 30 11.990 -4.946 -4.943 1.00 0.00 O ATOM 427 CB ALA A 30 10.668 -2.541 -5.117 1.00 0.00 C ATOM 0 H ALA A 30 8.393 -3.741 -4.760 1.00 0.00 H new ATOM 0 HA ALA A 30 10.343 -3.572 -6.962 1.00 0.00 H new ATOM 0 HB1 ALA A 30 11.744 -2.448 -5.263 1.00 0.00 H new ATOM 0 HB2 ALA A 30 10.174 -1.635 -5.468 1.00 0.00 H new ATOM 0 HB3 ALA A 30 10.456 -2.682 -4.057 1.00 0.00 H new ATOM 433 N GLY A 31 10.263 -6.154 -5.731 1.00 0.00 N ATOM 434 CA GLY A 31 10.872 -7.421 -5.370 1.00 0.00 C ATOM 435 C GLY A 31 11.679 -7.333 -4.091 1.00 0.00 C ATOM 436 O GLY A 31 11.364 -6.562 -3.184 1.00 0.00 O ATOM 0 H GLY A 31 9.348 -6.229 -6.176 1.00 0.00 H new ATOM 0 HA2 GLY A 31 10.093 -8.175 -5.253 1.00 0.00 H new ATOM 0 HA3 GLY A 31 11.519 -7.754 -6.182 1.00 0.00 H new ATOM 440 N PRO A 32 12.748 -8.139 -4.004 1.00 0.00 N ATOM 441 CA PRO A 32 13.624 -8.168 -2.829 1.00 0.00 C ATOM 442 C PRO A 32 14.451 -6.895 -2.691 1.00 0.00 C ATOM 443 O PRO A 32 15.577 -6.819 -3.183 1.00 0.00 O ATOM 444 CB PRO A 32 14.534 -9.371 -3.095 1.00 0.00 C ATOM 445 CG PRO A 32 14.545 -9.517 -4.577 1.00 0.00 C ATOM 446 CD PRO A 32 13.183 -9.084 -5.046 1.00 0.00 C ATOM 0 HA PRO A 32 13.058 -8.241 -1.900 1.00 0.00 H new ATOM 0 HB2 PRO A 32 15.538 -9.201 -2.706 1.00 0.00 H new ATOM 0 HB3 PRO A 32 14.153 -10.270 -2.611 1.00 0.00 H new ATOM 0 HG2 PRO A 32 15.326 -8.901 -5.024 1.00 0.00 H new ATOM 0 HG3 PRO A 32 14.748 -10.548 -4.866 1.00 0.00 H new ATOM 0 HD2 PRO A 32 13.228 -8.609 -6.026 1.00 0.00 H new ATOM 0 HD3 PRO A 32 12.500 -9.929 -5.132 1.00 0.00 H new ATOM 454 N MET A 33 13.886 -5.897 -2.020 1.00 0.00 N ATOM 455 CA MET A 33 14.573 -4.627 -1.816 1.00 0.00 C ATOM 456 C MET A 33 14.796 -4.361 -0.331 1.00 0.00 C ATOM 457 O MET A 33 13.909 -4.593 0.490 1.00 0.00 O ATOM 458 CB MET A 33 13.769 -3.483 -2.436 1.00 0.00 C ATOM 459 CG MET A 33 14.491 -2.146 -2.404 1.00 0.00 C ATOM 460 SD MET A 33 13.972 -1.044 -3.734 1.00 0.00 S ATOM 461 CE MET A 33 12.384 -0.493 -3.117 1.00 0.00 C ATOM 0 H MET A 33 12.954 -5.943 -1.608 1.00 0.00 H new ATOM 0 HA MET A 33 15.545 -4.686 -2.306 1.00 0.00 H new ATOM 0 HB2 MET A 33 13.533 -3.734 -3.470 1.00 0.00 H new ATOM 0 HB3 MET A 33 12.821 -3.387 -1.907 1.00 0.00 H new ATOM 0 HG2 MET A 33 14.309 -1.662 -1.444 1.00 0.00 H new ATOM 0 HG3 MET A 33 15.565 -2.316 -2.476 1.00 0.00 H new ATOM 0 HE1 MET A 33 11.851 0.036 -3.907 1.00 0.00 H new ATOM 0 HE2 MET A 33 11.798 -1.355 -2.798 1.00 0.00 H new ATOM 0 HE3 MET A 33 12.535 0.176 -2.270 1.00 0.00 H new ATOM 471 N GLU A 34 15.986 -3.874 0.007 1.00 0.00 N ATOM 472 CA GLU A 34 16.324 -3.579 1.394 1.00 0.00 C ATOM 473 C GLU A 34 15.635 -2.300 1.862 1.00 0.00 C ATOM 474 O GLU A 34 15.170 -1.501 1.049 1.00 0.00 O ATOM 475 CB GLU A 34 17.839 -3.443 1.555 1.00 0.00 C ATOM 476 CG GLU A 34 18.564 -4.775 1.649 1.00 0.00 C ATOM 477 CD GLU A 34 20.030 -4.619 2.003 1.00 0.00 C ATOM 478 OE1 GLU A 34 20.331 -4.389 3.193 1.00 0.00 O ATOM 479 OE2 GLU A 34 20.876 -4.727 1.091 1.00 0.00 O ATOM 0 H GLU A 34 16.731 -3.676 -0.660 1.00 0.00 H new ATOM 0 HA GLU A 34 15.973 -4.407 2.010 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.237 -2.882 0.710 1.00 0.00 H new ATOM 0 HB3 GLU A 34 18.050 -2.860 2.452 1.00 0.00 H new ATOM 0 HG2 GLU A 34 18.077 -5.397 2.400 1.00 0.00 H new ATOM 0 HG3 GLU A 34 18.478 -5.299 0.697 1.00 0.00 H new ATOM 486 N ARG A 35 15.573 -2.115 3.176 1.00 0.00 N ATOM 487 CA ARG A 35 14.940 -0.935 3.753 1.00 0.00 C ATOM 488 C ARG A 35 15.556 0.343 3.190 1.00 0.00 C ATOM 489 O ARG A 35 14.848 1.219 2.694 1.00 0.00 O ATOM 490 CB ARG A 35 15.074 -0.950 5.276 1.00 0.00 C ATOM 491 CG ARG A 35 14.387 0.220 5.961 1.00 0.00 C ATOM 492 CD ARG A 35 14.392 0.062 7.473 1.00 0.00 C ATOM 493 NE ARG A 35 15.683 0.417 8.056 1.00 0.00 N ATOM 494 CZ ARG A 35 16.709 -0.423 8.137 1.00 0.00 C ATOM 495 NH1 ARG A 35 16.594 -1.661 7.675 1.00 0.00 N ATOM 496 NH2 ARG A 35 17.852 -0.027 8.681 1.00 0.00 N ATOM 0 H ARG A 35 15.953 -2.767 3.862 1.00 0.00 H new ATOM 0 HA ARG A 35 13.883 -0.956 3.488 1.00 0.00 H new ATOM 0 HB2 ARG A 35 14.656 -1.881 5.660 1.00 0.00 H new ATOM 0 HB3 ARG A 35 16.132 -0.943 5.539 1.00 0.00 H new ATOM 0 HG2 ARG A 35 14.890 1.148 5.690 1.00 0.00 H new ATOM 0 HG3 ARG A 35 13.359 0.299 5.606 1.00 0.00 H new ATOM 0 HD2 ARG A 35 13.614 0.691 7.906 1.00 0.00 H new ATOM 0 HD3 ARG A 35 14.149 -0.969 7.731 1.00 0.00 H new ATOM 0 HE ARG A 35 15.804 1.362 8.421 1.00 0.00 H new ATOM 0 HH11 ARG A 35 15.717 -1.970 7.256 1.00 0.00 H new ATOM 0 HH12 ARG A 35 17.383 -2.304 7.738 1.00 0.00 H new ATOM 0 HH21 ARG A 35 17.944 0.924 9.038 1.00 0.00 H new ATOM 0 HH22 ARG A 35 18.639 -0.673 8.742 1.00 0.00 H new ATOM 510 N ALA A 36 16.879 0.441 3.271 1.00 0.00 N ATOM 511 CA ALA A 36 17.590 1.610 2.769 1.00 0.00 C ATOM 512 C ALA A 36 17.049 2.039 1.409 1.00 0.00 C ATOM 513 O ALA A 36 16.612 3.176 1.235 1.00 0.00 O ATOM 514 CB ALA A 36 19.081 1.321 2.678 1.00 0.00 C ATOM 0 H ALA A 36 17.480 -0.275 3.679 1.00 0.00 H new ATOM 0 HA ALA A 36 17.431 2.430 3.469 1.00 0.00 H new ATOM 0 HB1 ALA A 36 19.600 2.202 2.302 1.00 0.00 H new ATOM 0 HB2 ALA A 36 19.464 1.069 3.667 1.00 0.00 H new ATOM 0 HB3 ALA A 36 19.249 0.484 2.000 1.00 0.00 H new ATOM 520 N GLY A 37 17.082 1.122 0.447 1.00 0.00 N ATOM 521 CA GLY A 37 16.592 1.426 -0.885 1.00 0.00 C ATOM 522 C GLY A 37 15.259 2.147 -0.862 1.00 0.00 C ATOM 523 O GLY A 37 15.109 3.209 -1.465 1.00 0.00 O ATOM 0 H GLY A 37 17.439 0.174 0.566 1.00 0.00 H new ATOM 0 HA2 GLY A 37 17.325 2.041 -1.407 1.00 0.00 H new ATOM 0 HA3 GLY A 37 16.491 0.500 -1.452 1.00 0.00 H new ATOM 527 N ALA A 38 14.287 1.567 -0.165 1.00 0.00 N ATOM 528 CA ALA A 38 12.959 2.161 -0.066 1.00 0.00 C ATOM 529 C ALA A 38 13.023 3.545 0.570 1.00 0.00 C ATOM 530 O ALA A 38 12.274 4.446 0.195 1.00 0.00 O ATOM 531 CB ALA A 38 12.033 1.254 0.730 1.00 0.00 C ATOM 0 H ALA A 38 14.394 0.687 0.339 1.00 0.00 H new ATOM 0 HA ALA A 38 12.561 2.272 -1.075 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.045 1.710 0.796 1.00 0.00 H new ATOM 0 HB2 ALA A 38 11.954 0.288 0.232 1.00 0.00 H new ATOM 0 HB3 ALA A 38 12.435 1.114 1.733 1.00 0.00 H new ATOM 537 N GLU A 39 13.922 3.706 1.536 1.00 0.00 N ATOM 538 CA GLU A 39 14.082 4.981 2.226 1.00 0.00 C ATOM 539 C GLU A 39 14.750 6.010 1.319 1.00 0.00 C ATOM 540 O GLU A 39 14.546 7.215 1.472 1.00 0.00 O ATOM 541 CB GLU A 39 14.907 4.797 3.501 1.00 0.00 C ATOM 542 CG GLU A 39 14.189 4.005 4.581 1.00 0.00 C ATOM 543 CD GLU A 39 14.740 4.277 5.967 1.00 0.00 C ATOM 544 OE1 GLU A 39 15.954 4.068 6.176 1.00 0.00 O ATOM 545 OE2 GLU A 39 13.958 4.701 6.844 1.00 0.00 O ATOM 0 H GLU A 39 14.550 2.970 1.858 1.00 0.00 H new ATOM 0 HA GLU A 39 13.091 5.347 2.494 1.00 0.00 H new ATOM 0 HB2 GLU A 39 15.840 4.291 3.251 1.00 0.00 H new ATOM 0 HB3 GLU A 39 15.172 5.777 3.897 1.00 0.00 H new ATOM 0 HG2 GLU A 39 13.127 4.251 4.561 1.00 0.00 H new ATOM 0 HG3 GLU A 39 14.274 2.940 4.363 1.00 0.00 H new ATOM 552 N SER A 40 15.551 5.527 0.374 1.00 0.00 N ATOM 553 CA SER A 40 16.253 6.404 -0.555 1.00 0.00 C ATOM 554 C SER A 40 15.445 6.599 -1.835 1.00 0.00 C ATOM 555 O SER A 40 15.622 7.586 -2.549 1.00 0.00 O ATOM 556 CB SER A 40 17.630 5.828 -0.891 1.00 0.00 C ATOM 557 OG SER A 40 18.225 6.526 -1.972 1.00 0.00 O ATOM 0 H SER A 40 15.730 4.533 0.232 1.00 0.00 H new ATOM 0 HA SER A 40 16.380 7.374 -0.075 1.00 0.00 H new ATOM 0 HB2 SER A 40 18.276 5.888 -0.015 1.00 0.00 H new ATOM 0 HB3 SER A 40 17.534 4.772 -1.144 1.00 0.00 H new ATOM 0 HG SER A 40 19.105 6.140 -2.166 1.00 0.00 H new ATOM 563 N ILE A 41 14.558 5.650 -2.117 1.00 0.00 N ATOM 564 CA ILE A 41 13.722 5.717 -3.309 1.00 0.00 C ATOM 565 C ILE A 41 12.564 6.689 -3.114 1.00 0.00 C ATOM 566 O ILE A 41 12.387 7.627 -3.893 1.00 0.00 O ATOM 567 CB ILE A 41 13.159 4.333 -3.680 1.00 0.00 C ATOM 568 CG1 ILE A 41 14.281 3.416 -4.172 1.00 0.00 C ATOM 569 CG2 ILE A 41 12.076 4.468 -4.740 1.00 0.00 C ATOM 570 CD1 ILE A 41 14.009 1.947 -3.937 1.00 0.00 C ATOM 0 H ILE A 41 14.400 4.826 -1.536 1.00 0.00 H new ATOM 0 HA ILE A 41 14.358 6.071 -4.121 1.00 0.00 H new ATOM 0 HB ILE A 41 12.715 3.888 -2.789 1.00 0.00 H new ATOM 0 HG12 ILE A 41 14.434 3.583 -5.238 1.00 0.00 H new ATOM 0 HG13 ILE A 41 15.209 3.690 -3.670 1.00 0.00 H new ATOM 0 HG21 ILE A 41 11.688 3.481 -4.992 1.00 0.00 H new ATOM 0 HG22 ILE A 41 11.267 5.089 -4.356 1.00 0.00 H new ATOM 0 HG23 ILE A 41 12.496 4.931 -5.633 1.00 0.00 H new ATOM 0 HD11 ILE A 41 14.846 1.358 -4.311 1.00 0.00 H new ATOM 0 HD12 ILE A 41 13.886 1.766 -2.869 1.00 0.00 H new ATOM 0 HD13 ILE A 41 13.099 1.657 -4.462 1.00 0.00 H new ATOM 582 N LEU A 42 11.777 6.461 -2.068 1.00 0.00 N ATOM 583 CA LEU A 42 10.635 7.317 -1.769 1.00 0.00 C ATOM 584 C LEU A 42 11.089 8.631 -1.141 1.00 0.00 C ATOM 585 O LEU A 42 10.344 9.610 -1.118 1.00 0.00 O ATOM 586 CB LEU A 42 9.665 6.598 -0.829 1.00 0.00 C ATOM 587 CG LEU A 42 9.243 5.190 -1.249 1.00 0.00 C ATOM 588 CD1 LEU A 42 8.489 4.500 -0.123 1.00 0.00 C ATOM 589 CD2 LEU A 42 8.391 5.243 -2.509 1.00 0.00 C ATOM 0 H LEU A 42 11.909 5.690 -1.413 1.00 0.00 H new ATOM 0 HA LEU A 42 10.125 7.540 -2.706 1.00 0.00 H new ATOM 0 HB2 LEU A 42 10.124 6.539 0.158 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.768 7.209 -0.728 1.00 0.00 H new ATOM 0 HG LEU A 42 10.141 4.611 -1.465 1.00 0.00 H new ATOM 0 HD11 LEU A 42 8.197 3.499 -0.441 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.131 4.429 0.755 1.00 0.00 H new ATOM 0 HD13 LEU A 42 7.598 5.077 0.125 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.099 4.232 -2.794 1.00 0.00 H new ATOM 0 HD22 LEU A 42 7.498 5.838 -2.320 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.965 5.696 -3.317 1.00 0.00 H new ATOM 601 N ALA A 43 12.318 8.645 -0.634 1.00 0.00 N ATOM 602 CA ALA A 43 12.874 9.839 -0.010 1.00 0.00 C ATOM 603 C ALA A 43 12.625 11.074 -0.869 1.00 0.00 C ATOM 604 O ALA A 43 12.238 12.126 -0.363 1.00 0.00 O ATOM 605 CB ALA A 43 14.364 9.659 0.240 1.00 0.00 C ATOM 0 H ALA A 43 12.947 7.842 -0.643 1.00 0.00 H new ATOM 0 HA ALA A 43 12.372 9.987 0.946 1.00 0.00 H new ATOM 0 HB1 ALA A 43 14.766 10.558 0.706 1.00 0.00 H new ATOM 0 HB2 ALA A 43 14.522 8.806 0.900 1.00 0.00 H new ATOM 0 HB3 ALA A 43 14.873 9.483 -0.708 1.00 0.00 H new ATOM 611 N ASN A 44 12.851 10.938 -2.172 1.00 0.00 N ATOM 612 CA ASN A 44 12.653 12.044 -3.102 1.00 0.00 C ATOM 613 C ASN A 44 11.216 12.071 -3.615 1.00 0.00 C ATOM 614 O ASN A 44 10.671 13.136 -3.907 1.00 0.00 O ATOM 615 CB ASN A 44 13.625 11.929 -4.278 1.00 0.00 C ATOM 616 CG ASN A 44 15.074 12.015 -3.840 1.00 0.00 C ATOM 617 OD1 ASN A 44 15.728 13.043 -4.016 1.00 0.00 O ATOM 618 ND2 ASN A 44 15.584 10.930 -3.267 1.00 0.00 N ATOM 0 H ASN A 44 13.171 10.073 -2.607 1.00 0.00 H new ATOM 0 HA ASN A 44 12.848 12.975 -2.569 1.00 0.00 H new ATOM 0 HB2 ASN A 44 13.459 10.982 -4.792 1.00 0.00 H new ATOM 0 HB3 ASN A 44 13.418 12.722 -4.996 1.00 0.00 H new ATOM 0 HD21 ASN A 44 16.554 10.927 -2.953 1.00 0.00 H new ATOM 0 HD22 ASN A 44 15.005 10.100 -3.141 1.00 0.00 H new ATOM 625 N ARG A 45 10.609 10.894 -3.723 1.00 0.00 N ATOM 626 CA ARG A 45 9.237 10.783 -4.202 1.00 0.00 C ATOM 627 C ARG A 45 8.326 11.767 -3.475 1.00 0.00 C ATOM 628 O ARG A 45 8.738 12.414 -2.512 1.00 0.00 O ATOM 629 CB ARG A 45 8.721 9.356 -4.009 1.00 0.00 C ATOM 630 CG ARG A 45 9.402 8.335 -4.906 1.00 0.00 C ATOM 631 CD ARG A 45 8.827 8.358 -6.313 1.00 0.00 C ATOM 632 NE ARG A 45 9.523 9.310 -7.174 1.00 0.00 N ATOM 633 CZ ARG A 45 10.664 9.038 -7.798 1.00 0.00 C ATOM 634 NH1 ARG A 45 11.233 7.849 -7.659 1.00 0.00 N ATOM 635 NH2 ARG A 45 11.237 9.958 -8.565 1.00 0.00 N ATOM 0 H ARG A 45 11.046 10.004 -3.485 1.00 0.00 H new ATOM 0 HA ARG A 45 9.229 11.025 -5.265 1.00 0.00 H new ATOM 0 HB2 ARG A 45 8.863 9.065 -2.968 1.00 0.00 H new ATOM 0 HB3 ARG A 45 7.648 9.338 -4.201 1.00 0.00 H new ATOM 0 HG2 ARG A 45 10.472 8.540 -4.946 1.00 0.00 H new ATOM 0 HG3 ARG A 45 9.284 7.339 -4.480 1.00 0.00 H new ATOM 0 HD2 ARG A 45 8.893 7.361 -6.748 1.00 0.00 H new ATOM 0 HD3 ARG A 45 7.769 8.617 -6.268 1.00 0.00 H new ATOM 0 HE ARG A 45 9.111 10.234 -7.303 1.00 0.00 H new ATOM 0 HH11 ARG A 45 10.795 7.139 -7.072 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.109 7.644 -8.139 1.00 0.00 H new ATOM 0 HH21 ARG A 45 10.801 10.874 -8.675 1.00 0.00 H new ATOM 0 HH22 ARG A 45 12.113 9.749 -9.044 1.00 0.00 H new ATOM 649 N SER A 46 7.087 11.875 -3.942 1.00 0.00 N ATOM 650 CA SER A 46 6.118 12.784 -3.339 1.00 0.00 C ATOM 651 C SER A 46 5.333 12.085 -2.233 1.00 0.00 C ATOM 652 O SER A 46 4.916 10.937 -2.383 1.00 0.00 O ATOM 653 CB SER A 46 5.157 13.318 -4.403 1.00 0.00 C ATOM 654 OG SER A 46 5.637 14.529 -4.962 1.00 0.00 O ATOM 0 H SER A 46 6.730 11.344 -4.736 1.00 0.00 H new ATOM 0 HA SER A 46 6.664 13.619 -2.901 1.00 0.00 H new ATOM 0 HB2 SER A 46 5.032 12.575 -5.190 1.00 0.00 H new ATOM 0 HB3 SER A 46 4.174 13.482 -3.961 1.00 0.00 H new ATOM 0 HG SER A 46 5.006 14.849 -5.640 1.00 0.00 H new ATOM 660 N ASP A 47 5.136 12.787 -1.123 1.00 0.00 N ATOM 661 CA ASP A 47 4.401 12.236 0.009 1.00 0.00 C ATOM 662 C ASP A 47 3.200 11.425 -0.466 1.00 0.00 C ATOM 663 O ASP A 47 2.329 11.938 -1.168 1.00 0.00 O ATOM 664 CB ASP A 47 3.937 13.359 0.939 1.00 0.00 C ATOM 665 CG ASP A 47 5.044 13.847 1.854 1.00 0.00 C ATOM 666 OD1 ASP A 47 6.028 14.421 1.342 1.00 0.00 O ATOM 667 OD2 ASP A 47 4.925 13.655 3.082 1.00 0.00 O ATOM 0 H ASP A 47 5.475 13.739 -0.983 1.00 0.00 H new ATOM 0 HA ASP A 47 5.071 11.574 0.557 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.569 14.193 0.341 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.101 13.005 1.542 1.00 0.00 H new ATOM 672 N GLY A 48 3.160 10.153 -0.079 1.00 0.00 N ATOM 673 CA GLY A 48 2.063 9.291 -0.476 1.00 0.00 C ATOM 674 C GLY A 48 2.518 8.136 -1.346 1.00 0.00 C ATOM 675 O GLY A 48 1.821 7.128 -1.469 1.00 0.00 O ATOM 0 H GLY A 48 3.868 9.705 0.502 1.00 0.00 H new ATOM 0 HA2 GLY A 48 1.572 8.899 0.415 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.321 9.878 -1.017 1.00 0.00 H new ATOM 679 N THR A 49 3.691 8.282 -1.954 1.00 0.00 N ATOM 680 CA THR A 49 4.238 7.244 -2.819 1.00 0.00 C ATOM 681 C THR A 49 4.564 5.983 -2.027 1.00 0.00 C ATOM 682 O THR A 49 5.546 5.939 -1.286 1.00 0.00 O ATOM 683 CB THR A 49 5.511 7.727 -3.540 1.00 0.00 C ATOM 684 OG1 THR A 49 5.308 9.045 -4.062 1.00 0.00 O ATOM 685 CG2 THR A 49 5.884 6.780 -4.671 1.00 0.00 C ATOM 0 H THR A 49 4.281 9.109 -1.863 1.00 0.00 H new ATOM 0 HA THR A 49 3.473 7.016 -3.561 1.00 0.00 H new ATOM 0 HB THR A 49 6.327 7.745 -2.818 1.00 0.00 H new ATOM 0 HG1 THR A 49 5.501 9.706 -3.365 1.00 0.00 H new ATOM 0 HG21 THR A 49 6.786 7.141 -5.166 1.00 0.00 H new ATOM 0 HG22 THR A 49 6.066 5.784 -4.267 1.00 0.00 H new ATOM 0 HG23 THR A 49 5.068 6.735 -5.392 1.00 0.00 H new ATOM 693 N PHE A 50 3.734 4.958 -2.189 1.00 0.00 N ATOM 694 CA PHE A 50 3.933 3.695 -1.488 1.00 0.00 C ATOM 695 C PHE A 50 4.721 2.713 -2.351 1.00 0.00 C ATOM 696 O PHE A 50 4.655 2.757 -3.580 1.00 0.00 O ATOM 697 CB PHE A 50 2.585 3.083 -1.101 1.00 0.00 C ATOM 698 CG PHE A 50 1.828 2.515 -2.266 1.00 0.00 C ATOM 699 CD1 PHE A 50 1.131 3.346 -3.128 1.00 0.00 C ATOM 700 CD2 PHE A 50 1.813 1.149 -2.501 1.00 0.00 C ATOM 701 CE1 PHE A 50 0.432 2.826 -4.201 1.00 0.00 C ATOM 702 CE2 PHE A 50 1.116 0.623 -3.572 1.00 0.00 C ATOM 703 CZ PHE A 50 0.426 1.463 -4.424 1.00 0.00 C ATOM 0 H PHE A 50 2.917 4.977 -2.800 1.00 0.00 H new ATOM 0 HA PHE A 50 4.505 3.897 -0.583 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.750 2.295 -0.366 1.00 0.00 H new ATOM 0 HB3 PHE A 50 1.974 3.846 -0.618 1.00 0.00 H new ATOM 0 HD1 PHE A 50 1.134 4.413 -2.960 1.00 0.00 H new ATOM 0 HD2 PHE A 50 2.353 0.488 -1.839 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -0.109 3.485 -4.864 1.00 0.00 H new ATOM 0 HE2 PHE A 50 1.111 -0.443 -3.743 1.00 0.00 H new ATOM 0 HZ PHE A 50 -0.117 1.055 -5.263 1.00 0.00 H new ATOM 713 N LEU A 51 5.466 1.827 -1.699 1.00 0.00 N ATOM 714 CA LEU A 51 6.267 0.833 -2.405 1.00 0.00 C ATOM 715 C LEU A 51 6.387 -0.450 -1.589 1.00 0.00 C ATOM 716 O LEU A 51 6.758 -0.419 -0.415 1.00 0.00 O ATOM 717 CB LEU A 51 7.659 1.392 -2.705 1.00 0.00 C ATOM 718 CG LEU A 51 8.740 1.097 -1.664 1.00 0.00 C ATOM 719 CD1 LEU A 51 9.180 -0.356 -1.749 1.00 0.00 C ATOM 720 CD2 LEU A 51 9.929 2.028 -1.852 1.00 0.00 C ATOM 0 H LEU A 51 5.532 1.777 -0.682 1.00 0.00 H new ATOM 0 HA LEU A 51 5.765 0.598 -3.344 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.989 0.994 -3.665 1.00 0.00 H new ATOM 0 HB3 LEU A 51 7.578 2.473 -2.819 1.00 0.00 H new ATOM 0 HG LEU A 51 8.321 1.271 -0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 51 9.949 -0.548 -1.001 1.00 0.00 H new ATOM 0 HD12 LEU A 51 8.325 -1.006 -1.565 1.00 0.00 H new ATOM 0 HD13 LEU A 51 9.581 -0.557 -2.742 1.00 0.00 H new ATOM 0 HD21 LEU A 51 10.688 1.804 -1.103 1.00 0.00 H new ATOM 0 HD22 LEU A 51 10.349 1.886 -2.848 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.603 3.062 -1.740 1.00 0.00 H new ATOM 732 N VAL A 52 6.072 -1.577 -2.218 1.00 0.00 N ATOM 733 CA VAL A 52 6.148 -2.872 -1.552 1.00 0.00 C ATOM 734 C VAL A 52 7.464 -3.575 -1.865 1.00 0.00 C ATOM 735 O VAL A 52 7.935 -3.554 -3.002 1.00 0.00 O ATOM 736 CB VAL A 52 4.979 -3.785 -1.967 1.00 0.00 C ATOM 737 CG1 VAL A 52 4.844 -4.952 -1.000 1.00 0.00 C ATOM 738 CG2 VAL A 52 3.683 -2.992 -2.041 1.00 0.00 C ATOM 0 H VAL A 52 5.761 -1.620 -3.189 1.00 0.00 H new ATOM 0 HA VAL A 52 6.088 -2.681 -0.480 1.00 0.00 H new ATOM 0 HB VAL A 52 5.189 -4.187 -2.958 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.013 -5.586 -1.309 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.765 -5.534 -1.002 1.00 0.00 H new ATOM 0 HG13 VAL A 52 4.657 -4.572 0.004 1.00 0.00 H new ATOM 0 HG21 VAL A 52 2.868 -3.653 -2.336 1.00 0.00 H new ATOM 0 HG22 VAL A 52 3.465 -2.560 -1.064 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.786 -2.194 -2.776 1.00 0.00 H new ATOM 748 N ARG A 53 8.052 -4.197 -0.848 1.00 0.00 N ATOM 749 CA ARG A 53 9.315 -4.906 -1.014 1.00 0.00 C ATOM 750 C ARG A 53 9.345 -6.169 -0.158 1.00 0.00 C ATOM 751 O ARG A 53 8.633 -6.270 0.840 1.00 0.00 O ATOM 752 CB ARG A 53 10.488 -3.997 -0.643 1.00 0.00 C ATOM 753 CG ARG A 53 10.393 -3.425 0.762 1.00 0.00 C ATOM 754 CD ARG A 53 11.285 -2.204 0.927 1.00 0.00 C ATOM 755 NE ARG A 53 11.409 -1.802 2.325 1.00 0.00 N ATOM 756 CZ ARG A 53 12.068 -2.508 3.238 1.00 0.00 C ATOM 757 NH1 ARG A 53 12.659 -3.645 2.900 1.00 0.00 N ATOM 758 NH2 ARG A 53 12.137 -2.076 4.490 1.00 0.00 N ATOM 0 H ARG A 53 7.674 -4.224 0.099 1.00 0.00 H new ATOM 0 HA ARG A 53 9.406 -5.195 -2.061 1.00 0.00 H new ATOM 0 HB2 ARG A 53 11.417 -4.560 -0.735 1.00 0.00 H new ATOM 0 HB3 ARG A 53 10.541 -3.176 -1.358 1.00 0.00 H new ATOM 0 HG2 ARG A 53 9.359 -3.154 0.977 1.00 0.00 H new ATOM 0 HG3 ARG A 53 10.680 -4.187 1.487 1.00 0.00 H new ATOM 0 HD2 ARG A 53 12.274 -2.420 0.523 1.00 0.00 H new ATOM 0 HD3 ARG A 53 10.878 -1.376 0.347 1.00 0.00 H new ATOM 0 HE ARG A 53 10.965 -0.931 2.617 1.00 0.00 H new ATOM 0 HH11 ARG A 53 12.609 -3.980 1.938 1.00 0.00 H new ATOM 0 HH12 ARG A 53 13.164 -4.185 3.602 1.00 0.00 H new ATOM 0 HH21 ARG A 53 11.684 -1.201 4.753 1.00 0.00 H new ATOM 0 HH22 ARG A 53 12.643 -2.619 5.190 1.00 0.00 H new ATOM 772 N GLN A 54 10.174 -7.128 -0.557 1.00 0.00 N ATOM 773 CA GLN A 54 10.296 -8.385 0.173 1.00 0.00 C ATOM 774 C GLN A 54 11.646 -8.477 0.876 1.00 0.00 C ATOM 775 O GLN A 54 12.696 -8.436 0.234 1.00 0.00 O ATOM 776 CB GLN A 54 10.121 -9.570 -0.778 1.00 0.00 C ATOM 777 CG GLN A 54 9.921 -10.898 -0.064 1.00 0.00 C ATOM 778 CD GLN A 54 11.095 -11.266 0.822 1.00 0.00 C ATOM 779 OE1 GLN A 54 11.097 -10.980 2.020 1.00 0.00 O ATOM 780 NE2 GLN A 54 12.101 -11.905 0.237 1.00 0.00 N ATOM 0 H GLN A 54 10.771 -7.059 -1.381 1.00 0.00 H new ATOM 0 HA GLN A 54 9.511 -8.415 0.928 1.00 0.00 H new ATOM 0 HB2 GLN A 54 9.264 -9.382 -1.425 1.00 0.00 H new ATOM 0 HB3 GLN A 54 10.998 -9.641 -1.422 1.00 0.00 H new ATOM 0 HG2 GLN A 54 9.016 -10.848 0.541 1.00 0.00 H new ATOM 0 HG3 GLN A 54 9.768 -11.684 -0.803 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.057 -12.122 -0.759 1.00 0.00 H new ATOM 0 HE22 GLN A 54 12.918 -12.179 0.783 1.00 0.00 H new ATOM 789 N ARG A 55 11.611 -8.601 2.199 1.00 0.00 N ATOM 790 CA ARG A 55 12.832 -8.698 2.990 1.00 0.00 C ATOM 791 C ARG A 55 13.898 -9.501 2.249 1.00 0.00 C ATOM 792 O ARG A 55 13.584 -10.316 1.381 1.00 0.00 O ATOM 793 CB ARG A 55 12.539 -9.346 4.344 1.00 0.00 C ATOM 794 CG ARG A 55 11.940 -8.388 5.361 1.00 0.00 C ATOM 795 CD ARG A 55 11.119 -9.127 6.406 1.00 0.00 C ATOM 796 NE ARG A 55 11.930 -9.542 7.547 1.00 0.00 N ATOM 797 CZ ARG A 55 12.068 -8.819 8.652 1.00 0.00 C ATOM 798 NH1 ARG A 55 11.451 -7.651 8.766 1.00 0.00 N ATOM 799 NH2 ARG A 55 12.824 -9.264 9.648 1.00 0.00 N ATOM 0 H ARG A 55 10.750 -8.637 2.745 1.00 0.00 H new ATOM 0 HA ARG A 55 13.210 -7.689 3.153 1.00 0.00 H new ATOM 0 HB2 ARG A 55 11.854 -10.181 4.197 1.00 0.00 H new ATOM 0 HB3 ARG A 55 13.464 -9.759 4.747 1.00 0.00 H new ATOM 0 HG2 ARG A 55 12.738 -7.830 5.851 1.00 0.00 H new ATOM 0 HG3 ARG A 55 11.310 -7.660 4.850 1.00 0.00 H new ATOM 0 HD2 ARG A 55 10.309 -8.484 6.752 1.00 0.00 H new ATOM 0 HD3 ARG A 55 10.658 -10.004 5.951 1.00 0.00 H new ATOM 0 HE ARG A 55 12.417 -10.436 7.492 1.00 0.00 H new ATOM 0 HH11 ARG A 55 10.868 -7.305 8.003 1.00 0.00 H new ATOM 0 HH12 ARG A 55 11.559 -7.098 9.616 1.00 0.00 H new ATOM 0 HH21 ARG A 55 13.300 -10.162 9.565 1.00 0.00 H new ATOM 0 HH22 ARG A 55 12.929 -8.708 10.496 1.00 0.00 H new ATOM 813 N VAL A 56 15.158 -9.265 2.598 1.00 0.00 N ATOM 814 CA VAL A 56 16.270 -9.967 1.968 1.00 0.00 C ATOM 815 C VAL A 56 16.374 -11.401 2.475 1.00 0.00 C ATOM 816 O VAL A 56 17.445 -11.852 2.881 1.00 0.00 O ATOM 817 CB VAL A 56 17.607 -9.245 2.224 1.00 0.00 C ATOM 818 CG1 VAL A 56 18.702 -9.821 1.339 1.00 0.00 C ATOM 819 CG2 VAL A 56 17.456 -7.749 1.996 1.00 0.00 C ATOM 0 H VAL A 56 15.435 -8.593 3.314 1.00 0.00 H new ATOM 0 HA VAL A 56 16.071 -9.978 0.896 1.00 0.00 H new ATOM 0 HB VAL A 56 17.893 -9.403 3.264 1.00 0.00 H new ATOM 0 HG11 VAL A 56 19.639 -9.299 1.533 1.00 0.00 H new ATOM 0 HG12 VAL A 56 18.826 -10.882 1.557 1.00 0.00 H new ATOM 0 HG13 VAL A 56 18.427 -9.695 0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 56 18.410 -7.255 2.181 1.00 0.00 H new ATOM 0 HG22 VAL A 56 17.147 -7.567 0.967 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.703 -7.351 2.677 1.00 0.00 H new ATOM 829 N LYS A 57 15.253 -12.114 2.448 1.00 0.00 N ATOM 830 CA LYS A 57 15.216 -13.499 2.903 1.00 0.00 C ATOM 831 C LYS A 57 14.172 -14.298 2.130 1.00 0.00 C ATOM 832 O LYS A 57 13.230 -13.732 1.573 1.00 0.00 O ATOM 833 CB LYS A 57 14.911 -13.557 4.402 1.00 0.00 C ATOM 834 CG LYS A 57 16.130 -13.333 5.280 1.00 0.00 C ATOM 835 CD LYS A 57 15.745 -12.759 6.633 1.00 0.00 C ATOM 836 CE LYS A 57 15.463 -13.859 7.645 1.00 0.00 C ATOM 837 NZ LYS A 57 16.705 -14.577 8.044 1.00 0.00 N ATOM 0 H LYS A 57 14.358 -11.755 2.116 1.00 0.00 H new ATOM 0 HA LYS A 57 16.195 -13.942 2.720 1.00 0.00 H new ATOM 0 HB2 LYS A 57 14.159 -12.805 4.641 1.00 0.00 H new ATOM 0 HB3 LYS A 57 14.477 -14.528 4.639 1.00 0.00 H new ATOM 0 HG2 LYS A 57 16.656 -14.277 5.421 1.00 0.00 H new ATOM 0 HG3 LYS A 57 16.821 -12.655 4.779 1.00 0.00 H new ATOM 0 HD2 LYS A 57 16.549 -12.122 7.001 1.00 0.00 H new ATOM 0 HD3 LYS A 57 14.863 -12.128 6.524 1.00 0.00 H new ATOM 0 HE2 LYS A 57 14.993 -13.428 8.529 1.00 0.00 H new ATOM 0 HE3 LYS A 57 14.753 -14.569 7.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 16.548 -15.066 8.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 16.953 -15.274 7.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 17.482 -13.894 8.150 1.00 0.00 H new ATOM 851 N ASP A 58 14.344 -15.615 2.100 1.00 0.00 N ATOM 852 CA ASP A 58 13.415 -16.492 1.397 1.00 0.00 C ATOM 853 C ASP A 58 11.982 -15.986 1.533 1.00 0.00 C ATOM 854 O ASP A 58 11.347 -16.163 2.572 1.00 0.00 O ATOM 855 CB ASP A 58 13.519 -17.919 1.938 1.00 0.00 C ATOM 856 CG ASP A 58 12.541 -18.864 1.269 1.00 0.00 C ATOM 857 OD1 ASP A 58 11.353 -18.860 1.656 1.00 0.00 O ATOM 858 OD2 ASP A 58 12.962 -19.607 0.358 1.00 0.00 O ATOM 0 H ASP A 58 15.118 -16.099 2.555 1.00 0.00 H new ATOM 0 HA ASP A 58 13.682 -16.492 0.340 1.00 0.00 H new ATOM 0 HB2 ASP A 58 14.534 -18.287 1.791 1.00 0.00 H new ATOM 0 HB3 ASP A 58 13.335 -17.911 3.012 1.00 0.00 H new ATOM 863 N ALA A 59 11.480 -15.355 0.476 1.00 0.00 N ATOM 864 CA ALA A 59 10.123 -14.825 0.477 1.00 0.00 C ATOM 865 C ALA A 59 9.719 -14.350 1.869 1.00 0.00 C ATOM 866 O ALA A 59 8.578 -14.534 2.292 1.00 0.00 O ATOM 867 CB ALA A 59 9.145 -15.876 -0.028 1.00 0.00 C ATOM 0 H ALA A 59 11.993 -15.199 -0.391 1.00 0.00 H new ATOM 0 HA ALA A 59 10.095 -13.966 -0.194 1.00 0.00 H new ATOM 0 HB1 ALA A 59 8.135 -15.466 -0.022 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.413 -16.164 -1.044 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.185 -16.752 0.620 1.00 0.00 H new ATOM 873 N ALA A 60 10.664 -13.739 2.578 1.00 0.00 N ATOM 874 CA ALA A 60 10.406 -13.237 3.922 1.00 0.00 C ATOM 875 C ALA A 60 9.209 -12.293 3.935 1.00 0.00 C ATOM 876 O ALA A 60 8.964 -11.574 2.967 1.00 0.00 O ATOM 877 CB ALA A 60 11.640 -12.535 4.469 1.00 0.00 C ATOM 0 H ALA A 60 11.614 -13.580 2.244 1.00 0.00 H new ATOM 0 HA ALA A 60 10.172 -14.088 4.562 1.00 0.00 H new ATOM 0 HB1 ALA A 60 11.433 -12.165 5.473 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.472 -13.238 4.506 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.900 -11.698 3.821 1.00 0.00 H new ATOM 883 N GLU A 61 8.466 -12.302 5.037 1.00 0.00 N ATOM 884 CA GLU A 61 7.293 -11.447 5.174 1.00 0.00 C ATOM 885 C GLU A 61 7.489 -10.131 4.427 1.00 0.00 C ATOM 886 O GLU A 61 8.449 -9.401 4.674 1.00 0.00 O ATOM 887 CB GLU A 61 7.006 -11.169 6.651 1.00 0.00 C ATOM 888 CG GLU A 61 6.764 -12.426 7.471 1.00 0.00 C ATOM 889 CD GLU A 61 6.604 -12.135 8.951 1.00 0.00 C ATOM 890 OE1 GLU A 61 7.510 -11.504 9.533 1.00 0.00 O ATOM 891 OE2 GLU A 61 5.572 -12.539 9.526 1.00 0.00 O ATOM 0 H GLU A 61 8.655 -12.892 5.847 1.00 0.00 H new ATOM 0 HA GLU A 61 6.442 -11.970 4.738 1.00 0.00 H new ATOM 0 HB2 GLU A 61 7.846 -10.622 7.079 1.00 0.00 H new ATOM 0 HB3 GLU A 61 6.132 -10.522 6.727 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.869 -12.928 7.104 1.00 0.00 H new ATOM 0 HG3 GLU A 61 7.597 -13.115 7.328 1.00 0.00 H new ATOM 898 N PHE A 62 6.572 -9.835 3.512 1.00 0.00 N ATOM 899 CA PHE A 62 6.644 -8.608 2.727 1.00 0.00 C ATOM 900 C PHE A 62 6.504 -7.380 3.622 1.00 0.00 C ATOM 901 O PHE A 62 6.252 -7.498 4.821 1.00 0.00 O ATOM 902 CB PHE A 62 5.552 -8.599 1.655 1.00 0.00 C ATOM 903 CG PHE A 62 5.784 -9.595 0.555 1.00 0.00 C ATOM 904 CD1 PHE A 62 5.505 -10.938 0.749 1.00 0.00 C ATOM 905 CD2 PHE A 62 6.280 -9.188 -0.673 1.00 0.00 C ATOM 906 CE1 PHE A 62 5.718 -11.857 -0.262 1.00 0.00 C ATOM 907 CE2 PHE A 62 6.494 -10.102 -1.688 1.00 0.00 C ATOM 908 CZ PHE A 62 6.212 -11.438 -1.482 1.00 0.00 C ATOM 0 H PHE A 62 5.771 -10.428 3.296 1.00 0.00 H new ATOM 0 HA PHE A 62 7.620 -8.573 2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 62 4.591 -8.806 2.125 1.00 0.00 H new ATOM 0 HB3 PHE A 62 5.487 -7.601 1.223 1.00 0.00 H new ATOM 0 HD1 PHE A 62 5.117 -11.271 1.700 1.00 0.00 H new ATOM 0 HD2 PHE A 62 6.502 -8.144 -0.839 1.00 0.00 H new ATOM 0 HE1 PHE A 62 5.498 -12.902 -0.098 1.00 0.00 H new ATOM 0 HE2 PHE A 62 6.881 -9.772 -2.641 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.377 -12.154 -2.273 1.00 0.00 H new ATOM 918 N ALA A 63 6.670 -6.202 3.030 1.00 0.00 N ATOM 919 CA ALA A 63 6.561 -4.952 3.773 1.00 0.00 C ATOM 920 C ALA A 63 6.245 -3.786 2.842 1.00 0.00 C ATOM 921 O ALA A 63 6.827 -3.666 1.763 1.00 0.00 O ATOM 922 CB ALA A 63 7.845 -4.682 4.543 1.00 0.00 C ATOM 0 H ALA A 63 6.880 -6.087 2.039 1.00 0.00 H new ATOM 0 HA ALA A 63 5.739 -5.050 4.482 1.00 0.00 H new ATOM 0 HB1 ALA A 63 7.749 -3.746 5.093 1.00 0.00 H new ATOM 0 HB2 ALA A 63 8.028 -5.497 5.243 1.00 0.00 H new ATOM 0 HB3 ALA A 63 8.679 -4.609 3.845 1.00 0.00 H new ATOM 928 N ILE A 64 5.320 -2.931 3.265 1.00 0.00 N ATOM 929 CA ILE A 64 4.928 -1.775 2.468 1.00 0.00 C ATOM 930 C ILE A 64 5.488 -0.485 3.058 1.00 0.00 C ATOM 931 O ILE A 64 5.225 -0.154 4.214 1.00 0.00 O ATOM 932 CB ILE A 64 3.396 -1.656 2.365 1.00 0.00 C ATOM 933 CG1 ILE A 64 2.854 -2.650 1.336 1.00 0.00 C ATOM 934 CG2 ILE A 64 2.999 -0.234 1.996 1.00 0.00 C ATOM 935 CD1 ILE A 64 1.465 -3.155 1.658 1.00 0.00 C ATOM 0 H ILE A 64 4.828 -3.017 4.155 1.00 0.00 H new ATOM 0 HA ILE A 64 5.341 -1.925 1.470 1.00 0.00 H new ATOM 0 HB ILE A 64 2.961 -1.893 3.336 1.00 0.00 H new ATOM 0 HG12 ILE A 64 2.841 -2.174 0.355 1.00 0.00 H new ATOM 0 HG13 ILE A 64 3.534 -3.499 1.269 1.00 0.00 H new ATOM 0 HG21 ILE A 64 1.913 -0.166 1.927 1.00 0.00 H new ATOM 0 HG22 ILE A 64 3.358 0.454 2.761 1.00 0.00 H new ATOM 0 HG23 ILE A 64 3.441 0.029 1.035 1.00 0.00 H new ATOM 0 HD11 ILE A 64 1.145 -3.855 0.887 1.00 0.00 H new ATOM 0 HD12 ILE A 64 1.476 -3.660 2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.772 -2.315 1.696 1.00 0.00 H new ATOM 947 N SER A 65 6.261 0.240 2.256 1.00 0.00 N ATOM 948 CA SER A 65 6.860 1.493 2.699 1.00 0.00 C ATOM 949 C SER A 65 6.431 2.648 1.800 1.00 0.00 C ATOM 950 O SER A 65 6.500 2.553 0.574 1.00 0.00 O ATOM 951 CB SER A 65 8.386 1.378 2.708 1.00 0.00 C ATOM 952 OG SER A 65 8.979 2.507 3.326 1.00 0.00 O ATOM 0 H SER A 65 6.487 -0.019 1.296 1.00 0.00 H new ATOM 0 HA SER A 65 6.512 1.695 3.712 1.00 0.00 H new ATOM 0 HB2 SER A 65 8.682 0.472 3.237 1.00 0.00 H new ATOM 0 HB3 SER A 65 8.753 1.284 1.686 1.00 0.00 H new ATOM 0 HG SER A 65 9.279 2.267 4.227 1.00 0.00 H new ATOM 958 N ILE A 66 5.989 3.738 2.418 1.00 0.00 N ATOM 959 CA ILE A 66 5.550 4.912 1.674 1.00 0.00 C ATOM 960 C ILE A 66 6.046 6.196 2.331 1.00 0.00 C ATOM 961 O ILE A 66 6.445 6.197 3.496 1.00 0.00 O ATOM 962 CB ILE A 66 4.015 4.966 1.563 1.00 0.00 C ATOM 963 CG1 ILE A 66 3.432 5.858 2.661 1.00 0.00 C ATOM 964 CG2 ILE A 66 3.428 3.565 1.645 1.00 0.00 C ATOM 965 CD1 ILE A 66 3.735 5.369 4.060 1.00 0.00 C ATOM 0 H ILE A 66 5.925 3.833 3.432 1.00 0.00 H new ATOM 0 HA ILE A 66 5.976 4.830 0.674 1.00 0.00 H new ATOM 0 HB ILE A 66 3.751 5.394 0.596 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.825 6.868 2.545 1.00 0.00 H new ATOM 0 HG13 ILE A 66 2.351 5.920 2.532 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.342 3.620 1.565 1.00 0.00 H new ATOM 0 HG22 ILE A 66 3.821 2.957 0.830 1.00 0.00 H new ATOM 0 HG23 ILE A 66 3.699 3.112 2.599 1.00 0.00 H new ATOM 0 HD11 ILE A 66 3.291 6.049 4.787 1.00 0.00 H new ATOM 0 HD12 ILE A 66 3.318 4.371 4.195 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.814 5.334 4.207 1.00 0.00 H new ATOM 977 N LYS A 67 6.016 7.290 1.577 1.00 0.00 N ATOM 978 CA LYS A 67 6.459 8.582 2.085 1.00 0.00 C ATOM 979 C LYS A 67 5.328 9.296 2.818 1.00 0.00 C ATOM 980 O LYS A 67 4.322 9.669 2.214 1.00 0.00 O ATOM 981 CB LYS A 67 6.969 9.457 0.937 1.00 0.00 C ATOM 982 CG LYS A 67 7.536 10.790 1.394 1.00 0.00 C ATOM 983 CD LYS A 67 8.920 10.628 2.002 1.00 0.00 C ATOM 984 CE LYS A 67 9.490 11.963 2.454 1.00 0.00 C ATOM 985 NZ LYS A 67 10.231 12.649 1.360 1.00 0.00 N ATOM 0 H LYS A 67 5.689 7.307 0.611 1.00 0.00 H new ATOM 0 HA LYS A 67 7.272 8.407 2.790 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.739 8.912 0.391 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.152 9.639 0.239 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.587 11.474 0.547 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.866 11.240 2.127 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.868 9.947 2.852 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.589 10.174 1.271 1.00 0.00 H new ATOM 0 HE2 LYS A 67 8.680 12.604 2.802 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.158 11.805 3.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.675 13.513 1.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.966 12.014 0.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 9.570 12.899 0.597 1.00 0.00 H new ATOM 999 N TYR A 68 5.499 9.483 4.122 1.00 0.00 N ATOM 1000 CA TYR A 68 4.492 10.151 4.938 1.00 0.00 C ATOM 1001 C TYR A 68 5.145 10.999 6.024 1.00 0.00 C ATOM 1002 O TYR A 68 6.196 10.644 6.557 1.00 0.00 O ATOM 1003 CB TYR A 68 3.555 9.122 5.573 1.00 0.00 C ATOM 1004 CG TYR A 68 2.223 9.697 5.998 1.00 0.00 C ATOM 1005 CD1 TYR A 68 1.144 9.723 5.123 1.00 0.00 C ATOM 1006 CD2 TYR A 68 2.043 10.213 7.275 1.00 0.00 C ATOM 1007 CE1 TYR A 68 -0.075 10.248 5.507 1.00 0.00 C ATOM 1008 CE2 TYR A 68 0.827 10.739 7.668 1.00 0.00 C ATOM 1009 CZ TYR A 68 -0.228 10.754 6.781 1.00 0.00 C ATOM 1010 OH TYR A 68 -1.441 11.277 7.167 1.00 0.00 O ATOM 0 H TYR A 68 6.326 9.181 4.637 1.00 0.00 H new ATOM 0 HA TYR A 68 3.913 10.808 4.289 1.00 0.00 H new ATOM 0 HB2 TYR A 68 3.382 8.313 4.863 1.00 0.00 H new ATOM 0 HB3 TYR A 68 4.046 8.684 6.442 1.00 0.00 H new ATOM 0 HD1 TYR A 68 1.260 9.326 4.125 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.867 10.203 7.973 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -0.903 10.262 4.814 1.00 0.00 H new ATOM 0 HE2 TYR A 68 0.704 11.136 8.665 1.00 0.00 H new ATOM 0 HH TYR A 68 -2.051 10.548 7.405 1.00 0.00 H new ATOM 1020 N ASN A 69 4.514 12.123 6.348 1.00 0.00 N ATOM 1021 CA ASN A 69 5.033 13.023 7.371 1.00 0.00 C ATOM 1022 C ASN A 69 6.497 13.362 7.106 1.00 0.00 C ATOM 1023 O ASN A 69 7.276 13.567 8.037 1.00 0.00 O ATOM 1024 CB ASN A 69 4.887 12.392 8.757 1.00 0.00 C ATOM 1025 CG ASN A 69 4.660 13.426 9.843 1.00 0.00 C ATOM 1026 OD1 ASN A 69 4.807 14.626 9.613 1.00 0.00 O ATOM 1027 ND2 ASN A 69 4.300 12.963 11.035 1.00 0.00 N ATOM 0 H ASN A 69 3.643 12.432 5.917 1.00 0.00 H new ATOM 0 HA ASN A 69 4.453 13.945 7.336 1.00 0.00 H new ATOM 0 HB2 ASN A 69 4.053 11.690 8.747 1.00 0.00 H new ATOM 0 HB3 ASN A 69 5.784 11.818 8.988 1.00 0.00 H new ATOM 0 HD21 ASN A 69 4.134 13.611 11.805 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.190 11.959 11.180 1.00 0.00 H new ATOM 1034 N VAL A 70 6.863 13.421 5.830 1.00 0.00 N ATOM 1035 CA VAL A 70 8.232 13.737 5.441 1.00 0.00 C ATOM 1036 C VAL A 70 9.197 12.648 5.893 1.00 0.00 C ATOM 1037 O VAL A 70 10.387 12.899 6.084 1.00 0.00 O ATOM 1038 CB VAL A 70 8.686 15.086 6.030 1.00 0.00 C ATOM 1039 CG1 VAL A 70 7.497 16.018 6.209 1.00 0.00 C ATOM 1040 CG2 VAL A 70 9.410 14.874 7.351 1.00 0.00 C ATOM 0 H VAL A 70 6.230 13.254 5.048 1.00 0.00 H new ATOM 0 HA VAL A 70 8.245 13.801 4.353 1.00 0.00 H new ATOM 0 HB VAL A 70 9.381 15.552 5.331 1.00 0.00 H new ATOM 0 HG11 VAL A 70 7.837 16.966 6.626 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.025 16.195 5.243 1.00 0.00 H new ATOM 0 HG13 VAL A 70 6.776 15.561 6.887 1.00 0.00 H new ATOM 0 HG21 VAL A 70 9.724 15.838 7.753 1.00 0.00 H new ATOM 0 HG22 VAL A 70 8.740 14.386 8.059 1.00 0.00 H new ATOM 0 HG23 VAL A 70 10.286 14.246 7.189 1.00 0.00 H new ATOM 1050 N GLU A 71 8.676 11.436 6.063 1.00 0.00 N ATOM 1051 CA GLU A 71 9.493 10.308 6.494 1.00 0.00 C ATOM 1052 C GLU A 71 9.041 9.018 5.814 1.00 0.00 C ATOM 1053 O GLU A 71 7.845 8.769 5.664 1.00 0.00 O ATOM 1054 CB GLU A 71 9.421 10.148 8.014 1.00 0.00 C ATOM 1055 CG GLU A 71 8.057 10.476 8.596 1.00 0.00 C ATOM 1056 CD GLU A 71 8.038 10.409 10.111 1.00 0.00 C ATOM 1057 OE1 GLU A 71 8.639 9.469 10.672 1.00 0.00 O ATOM 1058 OE2 GLU A 71 7.422 11.298 10.736 1.00 0.00 O ATOM 0 H GLU A 71 7.693 11.211 5.909 1.00 0.00 H new ATOM 0 HA GLU A 71 10.525 10.509 6.206 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.681 9.122 8.276 1.00 0.00 H new ATOM 0 HB3 GLU A 71 10.168 10.794 8.475 1.00 0.00 H new ATOM 0 HG2 GLU A 71 7.760 11.475 8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.319 9.781 8.196 1.00 0.00 H new ATOM 1065 N VAL A 72 10.007 8.202 5.404 1.00 0.00 N ATOM 1066 CA VAL A 72 9.710 6.938 4.741 1.00 0.00 C ATOM 1067 C VAL A 72 9.305 5.870 5.751 1.00 0.00 C ATOM 1068 O VAL A 72 10.156 5.219 6.357 1.00 0.00 O ATOM 1069 CB VAL A 72 10.917 6.432 3.931 1.00 0.00 C ATOM 1070 CG1 VAL A 72 10.600 5.095 3.278 1.00 0.00 C ATOM 1071 CG2 VAL A 72 11.327 7.460 2.887 1.00 0.00 C ATOM 0 H VAL A 72 11.002 8.394 5.519 1.00 0.00 H new ATOM 0 HA VAL A 72 8.879 7.125 4.061 1.00 0.00 H new ATOM 0 HB VAL A 72 11.754 6.287 4.613 1.00 0.00 H new ATOM 0 HG11 VAL A 72 11.465 4.753 2.710 1.00 0.00 H new ATOM 0 HG12 VAL A 72 10.359 4.362 4.048 1.00 0.00 H new ATOM 0 HG13 VAL A 72 9.748 5.210 2.608 1.00 0.00 H new ATOM 0 HG21 VAL A 72 12.182 7.086 2.324 1.00 0.00 H new ATOM 0 HG22 VAL A 72 10.495 7.640 2.207 1.00 0.00 H new ATOM 0 HG23 VAL A 72 11.599 8.392 3.382 1.00 0.00 H new ATOM 1081 N LYS A 73 8.000 5.693 5.926 1.00 0.00 N ATOM 1082 CA LYS A 73 7.480 4.702 6.861 1.00 0.00 C ATOM 1083 C LYS A 73 7.436 3.319 6.219 1.00 0.00 C ATOM 1084 O LYS A 73 7.332 3.226 4.996 1.00 0.00 O ATOM 1085 CB LYS A 73 6.080 5.101 7.333 1.00 0.00 C ATOM 1086 CG LYS A 73 5.947 6.579 7.659 1.00 0.00 C ATOM 1087 CD LYS A 73 6.427 6.885 9.068 1.00 0.00 C ATOM 1088 CE LYS A 73 5.639 8.027 9.690 1.00 0.00 C ATOM 1089 NZ LYS A 73 6.090 8.321 11.078 1.00 0.00 N ATOM 0 H LYS A 73 7.282 6.223 5.432 1.00 0.00 H new ATOM 0 HA LYS A 73 8.149 4.664 7.720 1.00 0.00 H new ATOM 0 HB2 LYS A 73 5.357 4.841 6.560 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.824 4.518 8.217 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.524 7.164 6.942 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.906 6.883 7.554 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.329 5.994 9.688 1.00 0.00 H new ATOM 0 HD3 LYS A 73 7.486 7.143 9.045 1.00 0.00 H new ATOM 0 HE2 LYS A 73 5.749 8.921 9.076 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.579 7.774 9.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 5.679 9.223 11.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 5.779 7.558 11.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.128 8.387 11.099 1.00 0.00 H new ATOM 1103 N HIS A 74 7.514 2.287 7.046 1.00 0.00 N ATOM 1104 CA HIS A 74 7.480 0.923 6.546 1.00 0.00 C ATOM 1105 C HIS A 74 6.356 0.150 7.238 1.00 0.00 C ATOM 1106 O HIS A 74 6.018 0.389 8.398 1.00 0.00 O ATOM 1107 CB HIS A 74 8.846 0.252 6.705 1.00 0.00 C ATOM 1108 CG HIS A 74 10.014 1.159 6.399 1.00 0.00 C ATOM 1109 ND1 HIS A 74 10.587 1.245 5.142 1.00 0.00 N ATOM 1110 CD2 HIS A 74 10.710 2.017 7.199 1.00 0.00 C ATOM 1111 CE1 HIS A 74 11.582 2.118 5.195 1.00 0.00 C ATOM 1112 NE2 HIS A 74 11.657 2.595 6.470 1.00 0.00 N ATOM 0 H HIS A 74 7.601 2.368 8.059 1.00 0.00 H new ATOM 0 HA HIS A 74 7.265 0.929 5.477 1.00 0.00 H new ATOM 0 HB2 HIS A 74 8.942 -0.116 7.727 1.00 0.00 H new ATOM 0 HB3 HIS A 74 8.892 -0.617 6.048 1.00 0.00 H new ATOM 0 HD2 HIS A 74 10.522 2.196 8.247 1.00 0.00 H new ATOM 0 HE1 HIS A 74 12.222 2.402 4.372 1.00 0.00 H new ATOM 0 HE2 HIS A 74 12.330 3.283 6.808 1.00 0.00 H new ATOM 1120 N ILE A 75 5.779 -0.789 6.495 1.00 0.00 N ATOM 1121 CA ILE A 75 4.693 -1.612 7.013 1.00 0.00 C ATOM 1122 C ILE A 75 5.072 -3.089 7.007 1.00 0.00 C ATOM 1123 O ILE A 75 5.796 -3.552 6.125 1.00 0.00 O ATOM 1124 CB ILE A 75 3.403 -1.421 6.194 1.00 0.00 C ATOM 1125 CG1 ILE A 75 3.033 0.062 6.122 1.00 0.00 C ATOM 1126 CG2 ILE A 75 2.265 -2.227 6.802 1.00 0.00 C ATOM 1127 CD1 ILE A 75 2.659 0.657 7.462 1.00 0.00 C ATOM 0 H ILE A 75 6.045 -0.999 5.533 1.00 0.00 H new ATOM 0 HA ILE A 75 4.514 -1.290 8.039 1.00 0.00 H new ATOM 0 HB ILE A 75 3.577 -1.782 5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 75 3.874 0.618 5.708 1.00 0.00 H new ATOM 0 HG13 ILE A 75 2.198 0.187 5.432 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.360 -2.081 6.212 1.00 0.00 H new ATOM 0 HG22 ILE A 75 2.530 -3.284 6.806 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.089 -1.893 7.825 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.409 1.710 7.335 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.798 0.126 7.868 1.00 0.00 H new ATOM 0 HD13 ILE A 75 3.500 0.564 8.149 1.00 0.00 H new ATOM 1139 N LYS A 76 4.577 -3.825 7.996 1.00 0.00 N ATOM 1140 CA LYS A 76 4.860 -5.251 8.104 1.00 0.00 C ATOM 1141 C LYS A 76 3.731 -6.078 7.497 1.00 0.00 C ATOM 1142 O LYS A 76 2.606 -6.070 7.997 1.00 0.00 O ATOM 1143 CB LYS A 76 5.062 -5.642 9.570 1.00 0.00 C ATOM 1144 CG LYS A 76 4.996 -7.140 9.815 1.00 0.00 C ATOM 1145 CD LYS A 76 5.876 -7.553 10.983 1.00 0.00 C ATOM 1146 CE LYS A 76 7.248 -8.010 10.514 1.00 0.00 C ATOM 1147 NZ LYS A 76 8.112 -6.862 10.124 1.00 0.00 N ATOM 0 H LYS A 76 3.977 -3.457 8.735 1.00 0.00 H new ATOM 0 HA LYS A 76 5.776 -5.457 7.550 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.030 -5.270 9.907 1.00 0.00 H new ATOM 0 HB3 LYS A 76 4.302 -5.149 10.177 1.00 0.00 H new ATOM 0 HG2 LYS A 76 3.965 -7.432 10.014 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.310 -7.671 8.916 1.00 0.00 H new ATOM 0 HD2 LYS A 76 5.986 -6.715 11.671 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.393 -8.358 11.537 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.733 -8.576 11.309 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.135 -8.685 9.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.082 -7.198 9.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.741 -6.428 9.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 8.117 -6.156 10.888 1.00 0.00 H new ATOM 1161 N ILE A 77 4.039 -6.790 6.419 1.00 0.00 N ATOM 1162 CA ILE A 77 3.051 -7.624 5.746 1.00 0.00 C ATOM 1163 C ILE A 77 3.100 -9.059 6.260 1.00 0.00 C ATOM 1164 O ILE A 77 4.157 -9.689 6.270 1.00 0.00 O ATOM 1165 CB ILE A 77 3.263 -7.629 4.221 1.00 0.00 C ATOM 1166 CG1 ILE A 77 3.083 -6.219 3.654 1.00 0.00 C ATOM 1167 CG2 ILE A 77 2.299 -8.600 3.556 1.00 0.00 C ATOM 1168 CD1 ILE A 77 3.362 -6.125 2.170 1.00 0.00 C ATOM 0 H ILE A 77 4.965 -6.806 5.992 1.00 0.00 H new ATOM 0 HA ILE A 77 2.074 -7.195 5.967 1.00 0.00 H new ATOM 0 HB ILE A 77 4.281 -7.957 4.012 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.063 -5.886 3.846 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.746 -5.535 4.184 1.00 0.00 H new ATOM 0 HG21 ILE A 77 2.461 -8.593 2.478 1.00 0.00 H new ATOM 0 HG22 ILE A 77 2.471 -9.605 3.942 1.00 0.00 H new ATOM 0 HG23 ILE A 77 1.274 -8.299 3.771 1.00 0.00 H new ATOM 0 HD11 ILE A 77 3.215 -5.098 1.836 1.00 0.00 H new ATOM 0 HD12 ILE A 77 4.391 -6.426 1.973 1.00 0.00 H new ATOM 0 HD13 ILE A 77 2.682 -6.783 1.629 1.00 0.00 H new ATOM 1180 N MET A 78 1.949 -9.569 6.685 1.00 0.00 N ATOM 1181 CA MET A 78 1.861 -10.931 7.198 1.00 0.00 C ATOM 1182 C MET A 78 1.149 -11.842 6.202 1.00 0.00 C ATOM 1183 O MET A 78 0.410 -11.374 5.335 1.00 0.00 O ATOM 1184 CB MET A 78 1.124 -10.948 8.539 1.00 0.00 C ATOM 1185 CG MET A 78 1.634 -9.909 9.525 1.00 0.00 C ATOM 1186 SD MET A 78 1.427 -10.420 11.241 1.00 0.00 S ATOM 1187 CE MET A 78 -0.125 -9.623 11.648 1.00 0.00 C ATOM 0 H MET A 78 1.065 -9.060 6.684 1.00 0.00 H new ATOM 0 HA MET A 78 2.875 -11.303 7.344 1.00 0.00 H new ATOM 0 HB2 MET A 78 0.062 -10.779 8.363 1.00 0.00 H new ATOM 0 HB3 MET A 78 1.220 -11.938 8.985 1.00 0.00 H new ATOM 0 HG2 MET A 78 2.690 -9.718 9.332 1.00 0.00 H new ATOM 0 HG3 MET A 78 1.105 -8.970 9.363 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.714 -10.279 12.289 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.073 -8.687 12.170 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.679 -9.417 10.732 1.00 0.00 H new ATOM 1197 N THR A 79 1.376 -13.145 6.332 1.00 0.00 N ATOM 1198 CA THR A 79 0.757 -14.121 5.443 1.00 0.00 C ATOM 1199 C THR A 79 0.201 -15.304 6.227 1.00 0.00 C ATOM 1200 O THR A 79 0.824 -15.780 7.175 1.00 0.00 O ATOM 1201 CB THR A 79 1.759 -14.640 4.394 1.00 0.00 C ATOM 1202 OG1 THR A 79 3.064 -14.749 4.975 1.00 0.00 O ATOM 1203 CG2 THR A 79 1.811 -13.712 3.190 1.00 0.00 C ATOM 0 H THR A 79 1.984 -13.549 7.044 1.00 0.00 H new ATOM 0 HA THR A 79 -0.060 -13.611 4.933 1.00 0.00 H new ATOM 0 HB THR A 79 1.426 -15.623 4.061 1.00 0.00 H new ATOM 0 HG1 THR A 79 3.695 -15.081 4.303 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.525 -14.099 2.463 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.823 -13.654 2.733 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.122 -12.718 3.510 1.00 0.00 H new ATOM 1211 N ALA A 80 -0.974 -15.775 5.823 1.00 0.00 N ATOM 1212 CA ALA A 80 -1.612 -16.905 6.487 1.00 0.00 C ATOM 1213 C ALA A 80 -2.685 -17.528 5.600 1.00 0.00 C ATOM 1214 O ALA A 80 -3.598 -16.843 5.141 1.00 0.00 O ATOM 1215 CB ALA A 80 -2.212 -16.467 7.815 1.00 0.00 C ATOM 0 H ALA A 80 -1.503 -15.392 5.040 1.00 0.00 H new ATOM 0 HA ALA A 80 -0.850 -17.661 6.677 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -2.685 -17.321 8.300 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -1.424 -16.075 8.458 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -2.957 -15.691 7.639 1.00 0.00 H new ATOM 1221 N GLU A 81 -2.566 -18.831 5.361 1.00 0.00 N ATOM 1222 CA GLU A 81 -3.525 -19.545 4.527 1.00 0.00 C ATOM 1223 C GLU A 81 -3.417 -19.101 3.071 1.00 0.00 C ATOM 1224 O GLU A 81 -4.375 -19.205 2.306 1.00 0.00 O ATOM 1225 CB GLU A 81 -4.949 -19.314 5.038 1.00 0.00 C ATOM 1226 CG GLU A 81 -5.061 -19.319 6.553 1.00 0.00 C ATOM 1227 CD GLU A 81 -6.499 -19.278 7.032 1.00 0.00 C ATOM 1228 OE1 GLU A 81 -7.113 -18.192 6.978 1.00 0.00 O ATOM 1229 OE2 GLU A 81 -7.011 -20.334 7.461 1.00 0.00 O ATOM 0 H GLU A 81 -1.815 -19.413 5.733 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.295 -20.609 4.582 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.311 -18.359 4.659 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -5.602 -20.087 4.631 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -4.576 -20.213 6.946 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.523 -18.461 6.956 1.00 0.00 H new ATOM 1236 N GLY A 82 -2.242 -18.604 2.696 1.00 0.00 N ATOM 1237 CA GLY A 82 -2.029 -18.150 1.334 1.00 0.00 C ATOM 1238 C GLY A 82 -2.568 -16.754 1.097 1.00 0.00 C ATOM 1239 O GLY A 82 -2.824 -16.364 -0.043 1.00 0.00 O ATOM 0 H GLY A 82 -1.434 -18.508 3.311 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -0.962 -18.167 1.112 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.509 -18.844 0.644 1.00 0.00 H new ATOM 1243 N LEU A 83 -2.744 -15.998 2.176 1.00 0.00 N ATOM 1244 CA LEU A 83 -3.258 -14.636 2.081 1.00 0.00 C ATOM 1245 C LEU A 83 -2.195 -13.623 2.495 1.00 0.00 C ATOM 1246 O LEU A 83 -1.163 -13.986 3.058 1.00 0.00 O ATOM 1247 CB LEU A 83 -4.500 -14.477 2.959 1.00 0.00 C ATOM 1248 CG LEU A 83 -5.631 -15.476 2.710 1.00 0.00 C ATOM 1249 CD1 LEU A 83 -6.518 -15.595 3.939 1.00 0.00 C ATOM 1250 CD2 LEU A 83 -6.450 -15.063 1.496 1.00 0.00 C ATOM 0 H LEU A 83 -2.538 -16.305 3.127 1.00 0.00 H new ATOM 0 HA LEU A 83 -3.528 -14.447 1.042 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -4.195 -14.557 4.002 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -4.894 -13.470 2.818 1.00 0.00 H new ATOM 0 HG LEU A 83 -5.190 -16.453 2.510 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -7.317 -16.310 3.743 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -5.923 -15.938 4.785 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -6.951 -14.622 4.171 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -7.250 -15.785 1.334 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.881 -14.076 1.666 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -5.807 -15.031 0.617 1.00 0.00 H new ATOM 1262 N TYR A 84 -2.456 -12.352 2.213 1.00 0.00 N ATOM 1263 CA TYR A 84 -1.523 -11.285 2.555 1.00 0.00 C ATOM 1264 C TYR A 84 -2.228 -10.168 3.319 1.00 0.00 C ATOM 1265 O TYR A 84 -3.215 -9.606 2.846 1.00 0.00 O ATOM 1266 CB TYR A 84 -0.873 -10.722 1.290 1.00 0.00 C ATOM 1267 CG TYR A 84 -0.048 -11.737 0.530 1.00 0.00 C ATOM 1268 CD1 TYR A 84 -0.657 -12.706 -0.257 1.00 0.00 C ATOM 1269 CD2 TYR A 84 1.339 -11.727 0.600 1.00 0.00 C ATOM 1270 CE1 TYR A 84 0.092 -13.636 -0.953 1.00 0.00 C ATOM 1271 CE2 TYR A 84 2.096 -12.651 -0.093 1.00 0.00 C ATOM 1272 CZ TYR A 84 1.468 -13.604 -0.868 1.00 0.00 C ATOM 1273 OH TYR A 84 2.218 -14.527 -1.559 1.00 0.00 O ATOM 0 H TYR A 84 -3.307 -12.035 1.748 1.00 0.00 H new ATOM 0 HA TYR A 84 -0.749 -11.706 3.196 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -1.652 -10.334 0.633 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.237 -9.880 1.562 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -1.734 -12.733 -0.326 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.834 -10.984 1.207 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -0.398 -14.383 -1.560 1.00 0.00 H new ATOM 0 HE2 TYR A 84 3.174 -12.628 -0.029 1.00 0.00 H new ATOM 0 HH TYR A 84 3.170 -14.366 -1.392 1.00 0.00 H new ATOM 1283 N ARG A 85 -1.712 -9.853 4.502 1.00 0.00 N ATOM 1284 CA ARG A 85 -2.291 -8.803 5.332 1.00 0.00 C ATOM 1285 C ARG A 85 -1.295 -8.335 6.390 1.00 0.00 C ATOM 1286 O ARG A 85 -0.691 -9.148 7.090 1.00 0.00 O ATOM 1287 CB ARG A 85 -3.569 -9.305 6.007 1.00 0.00 C ATOM 1288 CG ARG A 85 -3.544 -10.789 6.333 1.00 0.00 C ATOM 1289 CD ARG A 85 -4.300 -11.090 7.618 1.00 0.00 C ATOM 1290 NE ARG A 85 -3.420 -11.089 8.783 1.00 0.00 N ATOM 1291 CZ ARG A 85 -2.458 -11.985 8.978 1.00 0.00 C ATOM 1292 NH1 ARG A 85 -2.254 -12.947 8.090 1.00 0.00 N ATOM 1293 NH2 ARG A 85 -1.698 -11.918 10.064 1.00 0.00 N ATOM 0 H ARG A 85 -0.895 -10.309 4.907 1.00 0.00 H new ATOM 0 HA ARG A 85 -2.535 -7.958 4.688 1.00 0.00 H new ATOM 0 HB2 ARG A 85 -3.729 -8.742 6.927 1.00 0.00 H new ATOM 0 HB3 ARG A 85 -4.418 -9.099 5.356 1.00 0.00 H new ATOM 0 HG2 ARG A 85 -3.985 -11.351 5.510 1.00 0.00 H new ATOM 0 HG3 ARG A 85 -2.511 -11.124 6.430 1.00 0.00 H new ATOM 0 HD2 ARG A 85 -5.087 -10.349 7.758 1.00 0.00 H new ATOM 0 HD3 ARG A 85 -4.788 -12.061 7.533 1.00 0.00 H new ATOM 0 HE ARG A 85 -3.551 -10.361 9.485 1.00 0.00 H new ATOM 0 HH11 ARG A 85 -2.836 -13.001 7.254 1.00 0.00 H new ATOM 0 HH12 ARG A 85 -1.515 -13.633 8.242 1.00 0.00 H new ATOM 0 HH21 ARG A 85 -1.852 -11.179 10.749 1.00 0.00 H new ATOM 0 HH22 ARG A 85 -0.960 -12.606 10.213 1.00 0.00 H new ATOM 1307 N ILE A 86 -1.130 -7.021 6.499 1.00 0.00 N ATOM 1308 CA ILE A 86 -0.209 -6.446 7.470 1.00 0.00 C ATOM 1309 C ILE A 86 -0.742 -6.598 8.891 1.00 0.00 C ATOM 1310 O ILE A 86 -0.022 -6.374 9.864 1.00 0.00 O ATOM 1311 CB ILE A 86 0.048 -4.954 7.188 1.00 0.00 C ATOM 1312 CG1 ILE A 86 -1.229 -4.142 7.417 1.00 0.00 C ATOM 1313 CG2 ILE A 86 0.555 -4.763 5.766 1.00 0.00 C ATOM 1314 CD1 ILE A 86 -0.981 -2.794 8.056 1.00 0.00 C ATOM 0 H ILE A 86 -1.622 -6.335 5.927 1.00 0.00 H new ATOM 0 HA ILE A 86 0.729 -6.992 7.376 1.00 0.00 H new ATOM 0 HB ILE A 86 0.813 -4.596 7.877 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.733 -3.995 6.462 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.906 -4.716 8.049 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.732 -3.703 5.582 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.486 -5.315 5.634 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.189 -5.134 5.061 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.930 -2.274 8.188 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.505 -2.934 9.027 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.329 -2.202 7.414 1.00 0.00 H new ATOM 1326 N THR A 87 -2.009 -6.983 9.003 1.00 0.00 N ATOM 1327 CA THR A 87 -2.640 -7.167 10.304 1.00 0.00 C ATOM 1328 C THR A 87 -3.693 -8.268 10.254 1.00 0.00 C ATOM 1329 O THR A 87 -4.103 -8.698 9.177 1.00 0.00 O ATOM 1330 CB THR A 87 -3.297 -5.865 10.799 1.00 0.00 C ATOM 1331 OG1 THR A 87 -3.952 -6.092 12.052 1.00 0.00 O ATOM 1332 CG2 THR A 87 -4.304 -5.347 9.782 1.00 0.00 C ATOM 0 H THR A 87 -2.619 -7.174 8.208 1.00 0.00 H new ATOM 0 HA THR A 87 -1.852 -7.454 11.000 1.00 0.00 H new ATOM 0 HB THR A 87 -2.516 -5.116 10.928 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.366 -5.259 12.361 1.00 0.00 H new ATOM 0 HG21 THR A 87 -4.755 -4.427 10.153 1.00 0.00 H new ATOM 0 HG22 THR A 87 -3.798 -5.148 8.838 1.00 0.00 H new ATOM 0 HG23 THR A 87 -5.081 -6.095 9.626 1.00 0.00 H new ATOM 1340 N GLU A 88 -4.128 -8.719 11.427 1.00 0.00 N ATOM 1341 CA GLU A 88 -5.134 -9.770 11.515 1.00 0.00 C ATOM 1342 C GLU A 88 -6.540 -9.177 11.530 1.00 0.00 C ATOM 1343 O GLU A 88 -7.427 -9.670 12.227 1.00 0.00 O ATOM 1344 CB GLU A 88 -4.912 -10.615 12.771 1.00 0.00 C ATOM 1345 CG GLU A 88 -5.183 -9.866 14.065 1.00 0.00 C ATOM 1346 CD GLU A 88 -5.633 -10.781 15.187 1.00 0.00 C ATOM 1347 OE1 GLU A 88 -6.850 -11.043 15.286 1.00 0.00 O ATOM 1348 OE2 GLU A 88 -4.769 -11.236 15.964 1.00 0.00 O ATOM 0 H GLU A 88 -3.799 -8.373 12.328 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.036 -10.406 10.635 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.557 -11.492 12.727 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -3.884 -10.976 12.779 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.279 -9.339 14.371 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -5.948 -9.110 13.889 1.00 0.00 H new ATOM 1355 N LYS A 89 -6.736 -8.115 10.756 1.00 0.00 N ATOM 1356 CA LYS A 89 -8.033 -7.454 10.677 1.00 0.00 C ATOM 1357 C LYS A 89 -8.800 -7.905 9.439 1.00 0.00 C ATOM 1358 O LYS A 89 -10.015 -8.099 9.484 1.00 0.00 O ATOM 1359 CB LYS A 89 -7.853 -5.934 10.654 1.00 0.00 C ATOM 1360 CG LYS A 89 -7.756 -5.311 12.035 1.00 0.00 C ATOM 1361 CD LYS A 89 -9.124 -4.913 12.565 1.00 0.00 C ATOM 1362 CE LYS A 89 -9.582 -3.585 11.983 1.00 0.00 C ATOM 1363 NZ LYS A 89 -10.111 -3.739 10.599 1.00 0.00 N ATOM 0 H LYS A 89 -6.012 -7.693 10.174 1.00 0.00 H new ATOM 0 HA LYS A 89 -8.609 -7.732 11.560 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -6.951 -5.692 10.092 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -8.691 -5.486 10.121 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -7.290 -6.018 12.722 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -7.111 -4.433 11.995 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -9.850 -5.688 12.320 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -9.088 -4.842 13.652 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -10.354 -3.156 12.621 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -8.747 -2.884 11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -10.850 -3.028 10.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -9.339 -3.606 9.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -10.514 -4.691 10.485 1.00 0.00 H new ATOM 1377 N LYS A 90 -8.083 -8.071 8.332 1.00 0.00 N ATOM 1378 CA LYS A 90 -8.695 -8.503 7.081 1.00 0.00 C ATOM 1379 C LYS A 90 -7.636 -8.998 6.101 1.00 0.00 C ATOM 1380 O LYS A 90 -6.724 -8.259 5.731 1.00 0.00 O ATOM 1381 CB LYS A 90 -9.487 -7.354 6.454 1.00 0.00 C ATOM 1382 CG LYS A 90 -10.771 -7.799 5.775 1.00 0.00 C ATOM 1383 CD LYS A 90 -10.573 -7.990 4.280 1.00 0.00 C ATOM 1384 CE LYS A 90 -11.014 -6.762 3.499 1.00 0.00 C ATOM 1385 NZ LYS A 90 -12.489 -6.566 3.560 1.00 0.00 N ATOM 0 H LYS A 90 -7.077 -7.913 8.276 1.00 0.00 H new ATOM 0 HA LYS A 90 -9.374 -9.326 7.302 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.729 -6.626 7.228 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.857 -6.846 5.724 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -11.114 -8.733 6.220 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.551 -7.058 5.948 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.523 -8.196 4.074 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.140 -8.859 3.945 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -10.514 -5.879 3.897 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -10.704 -6.862 2.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -12.699 -5.565 3.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -12.914 -6.844 2.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -12.886 -7.152 4.322 1.00 0.00 H new ATOM 1399 N ALA A 91 -7.765 -10.253 5.682 1.00 0.00 N ATOM 1400 CA ALA A 91 -6.822 -10.845 4.742 1.00 0.00 C ATOM 1401 C ALA A 91 -7.346 -10.762 3.312 1.00 0.00 C ATOM 1402 O ALA A 91 -8.546 -10.597 3.089 1.00 0.00 O ATOM 1403 CB ALA A 91 -6.540 -12.292 5.119 1.00 0.00 C ATOM 0 H ALA A 91 -8.514 -10.879 5.979 1.00 0.00 H new ATOM 0 HA ALA A 91 -5.892 -10.279 4.794 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -5.834 -12.722 4.409 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -6.115 -12.330 6.122 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -7.469 -12.861 5.097 1.00 0.00 H new ATOM 1409 N PHE A 92 -6.440 -10.877 2.347 1.00 0.00 N ATOM 1410 CA PHE A 92 -6.812 -10.813 0.938 1.00 0.00 C ATOM 1411 C PHE A 92 -6.078 -11.881 0.133 1.00 0.00 C ATOM 1412 O PHE A 92 -5.035 -12.383 0.553 1.00 0.00 O ATOM 1413 CB PHE A 92 -6.500 -9.426 0.370 1.00 0.00 C ATOM 1414 CG PHE A 92 -7.112 -8.304 1.159 1.00 0.00 C ATOM 1415 CD1 PHE A 92 -6.652 -8.003 2.431 1.00 0.00 C ATOM 1416 CD2 PHE A 92 -8.145 -7.549 0.628 1.00 0.00 C ATOM 1417 CE1 PHE A 92 -7.214 -6.972 3.159 1.00 0.00 C ATOM 1418 CE2 PHE A 92 -8.710 -6.515 1.351 1.00 0.00 C ATOM 1419 CZ PHE A 92 -8.243 -6.226 2.618 1.00 0.00 C ATOM 0 H PHE A 92 -5.443 -11.015 2.514 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.883 -10.998 0.861 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.419 -9.290 0.338 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.858 -9.374 -0.658 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.845 -8.581 2.858 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -8.513 -7.771 -0.363 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -6.849 -6.749 4.151 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -9.515 -5.934 0.926 1.00 0.00 H new ATOM 0 HZ PHE A 92 -8.682 -5.418 3.185 1.00 0.00 H new ATOM 1429 N ARG A 93 -6.632 -12.225 -1.025 1.00 0.00 N ATOM 1430 CA ARG A 93 -6.033 -13.235 -1.888 1.00 0.00 C ATOM 1431 C ARG A 93 -4.553 -12.944 -2.119 1.00 0.00 C ATOM 1432 O ARG A 93 -3.707 -13.827 -1.981 1.00 0.00 O ATOM 1433 CB ARG A 93 -6.767 -13.293 -3.229 1.00 0.00 C ATOM 1434 CG ARG A 93 -8.246 -13.620 -3.099 1.00 0.00 C ATOM 1435 CD ARG A 93 -8.491 -15.120 -3.143 1.00 0.00 C ATOM 1436 NE ARG A 93 -9.906 -15.439 -3.314 1.00 0.00 N ATOM 1437 CZ ARG A 93 -10.776 -15.482 -2.311 1.00 0.00 C ATOM 1438 NH1 ARG A 93 -10.377 -15.227 -1.072 1.00 0.00 N ATOM 1439 NH2 ARG A 93 -12.047 -15.779 -2.545 1.00 0.00 N ATOM 0 H ARG A 93 -7.495 -11.819 -1.387 1.00 0.00 H new ATOM 0 HA ARG A 93 -6.123 -14.201 -1.391 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -6.659 -12.334 -3.735 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -6.292 -14.043 -3.862 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.628 -13.215 -2.162 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -8.799 -13.136 -3.904 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -7.919 -15.557 -3.962 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -8.126 -15.574 -2.222 1.00 0.00 H new ATOM 0 HE ARG A 93 -10.245 -15.640 -4.255 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -9.400 -14.997 -0.888 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -11.047 -15.261 -0.303 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -12.358 -15.975 -3.496 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -12.714 -15.812 -1.774 1.00 0.00 H new ATOM 1453 N GLY A 94 -4.248 -11.699 -2.473 1.00 0.00 N ATOM 1454 CA GLY A 94 -2.870 -11.314 -2.718 1.00 0.00 C ATOM 1455 C GLY A 94 -2.632 -9.835 -2.487 1.00 0.00 C ATOM 1456 O GLY A 94 -3.555 -9.096 -2.142 1.00 0.00 O ATOM 0 H GLY A 94 -4.930 -10.951 -2.594 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -2.213 -11.891 -2.066 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -2.602 -11.566 -3.744 1.00 0.00 H new ATOM 1460 N LEU A 95 -1.390 -9.401 -2.674 1.00 0.00 N ATOM 1461 CA LEU A 95 -1.032 -8.000 -2.481 1.00 0.00 C ATOM 1462 C LEU A 95 -2.009 -7.083 -3.210 1.00 0.00 C ATOM 1463 O LEU A 95 -2.720 -6.294 -2.587 1.00 0.00 O ATOM 1464 CB LEU A 95 0.392 -7.745 -2.977 1.00 0.00 C ATOM 1465 CG LEU A 95 1.511 -7.998 -1.966 1.00 0.00 C ATOM 1466 CD1 LEU A 95 1.642 -6.822 -1.010 1.00 0.00 C ATOM 1467 CD2 LEU A 95 1.254 -9.286 -1.198 1.00 0.00 C ATOM 0 H LEU A 95 -0.614 -9.999 -2.959 1.00 0.00 H new ATOM 0 HA LEU A 95 -1.084 -7.780 -1.415 1.00 0.00 H new ATOM 0 HB2 LEU A 95 0.569 -8.374 -3.850 1.00 0.00 H new ATOM 0 HB3 LEU A 95 0.459 -6.710 -3.311 1.00 0.00 H new ATOM 0 HG LEU A 95 2.450 -8.104 -2.510 1.00 0.00 H new ATOM 0 HD11 LEU A 95 2.443 -7.020 -0.298 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.873 -5.918 -1.574 1.00 0.00 H new ATOM 0 HD13 LEU A 95 0.704 -6.684 -0.472 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.060 -9.450 -0.483 1.00 0.00 H new ATOM 0 HD22 LEU A 95 0.306 -9.209 -0.665 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.211 -10.123 -1.895 1.00 0.00 H new ATOM 1479 N THR A 96 -2.040 -7.194 -4.535 1.00 0.00 N ATOM 1480 CA THR A 96 -2.931 -6.376 -5.349 1.00 0.00 C ATOM 1481 C THR A 96 -4.229 -6.073 -4.610 1.00 0.00 C ATOM 1482 O THR A 96 -4.666 -4.924 -4.552 1.00 0.00 O ATOM 1483 CB THR A 96 -3.263 -7.067 -6.685 1.00 0.00 C ATOM 1484 OG1 THR A 96 -2.059 -7.510 -7.320 1.00 0.00 O ATOM 1485 CG2 THR A 96 -4.013 -6.121 -7.611 1.00 0.00 C ATOM 0 H THR A 96 -1.459 -7.842 -5.067 1.00 0.00 H new ATOM 0 HA THR A 96 -2.406 -5.443 -5.551 1.00 0.00 H new ATOM 0 HB THR A 96 -3.900 -7.927 -6.476 1.00 0.00 H new ATOM 0 HG1 THR A 96 -1.426 -6.764 -7.379 1.00 0.00 H new ATOM 0 HG21 THR A 96 -4.237 -6.631 -8.548 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.943 -5.809 -7.136 1.00 0.00 H new ATOM 0 HG23 THR A 96 -3.397 -5.245 -7.813 1.00 0.00 H new ATOM 1493 N GLU A 97 -4.839 -7.110 -4.046 1.00 0.00 N ATOM 1494 CA GLU A 97 -6.088 -6.953 -3.310 1.00 0.00 C ATOM 1495 C GLU A 97 -5.850 -6.247 -1.978 1.00 0.00 C ATOM 1496 O GLU A 97 -6.428 -5.193 -1.709 1.00 0.00 O ATOM 1497 CB GLU A 97 -6.738 -8.317 -3.067 1.00 0.00 C ATOM 1498 CG GLU A 97 -7.409 -8.900 -4.299 1.00 0.00 C ATOM 1499 CD GLU A 97 -8.600 -8.080 -4.758 1.00 0.00 C ATOM 1500 OE1 GLU A 97 -9.618 -8.058 -4.034 1.00 0.00 O ATOM 1501 OE2 GLU A 97 -8.514 -7.461 -5.838 1.00 0.00 O ATOM 0 H GLU A 97 -4.489 -8.067 -4.084 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.759 -6.340 -3.912 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -5.978 -9.014 -2.713 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -7.478 -8.221 -2.272 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.682 -8.963 -5.109 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -7.735 -9.918 -4.084 1.00 0.00 H new ATOM 1508 N LEU A 98 -4.996 -6.835 -1.148 1.00 0.00 N ATOM 1509 CA LEU A 98 -4.681 -6.263 0.157 1.00 0.00 C ATOM 1510 C LEU A 98 -4.463 -4.757 0.053 1.00 0.00 C ATOM 1511 O LEU A 98 -5.077 -3.978 0.782 1.00 0.00 O ATOM 1512 CB LEU A 98 -3.434 -6.931 0.740 1.00 0.00 C ATOM 1513 CG LEU A 98 -2.954 -6.393 2.089 1.00 0.00 C ATOM 1514 CD1 LEU A 98 -2.032 -5.200 1.890 1.00 0.00 C ATOM 1515 CD2 LEU A 98 -4.139 -6.014 2.965 1.00 0.00 C ATOM 0 H LEU A 98 -4.509 -7.707 -1.355 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.527 -6.444 0.820 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.633 -7.997 0.847 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -2.621 -6.829 0.021 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.393 -7.180 2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.700 -4.831 2.860 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -1.166 -5.504 1.302 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -2.568 -4.410 1.365 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -3.778 -5.633 3.921 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.728 -5.244 2.467 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -4.761 -6.893 3.136 1.00 0.00 H new ATOM 1527 N VAL A 99 -3.585 -4.353 -0.860 1.00 0.00 N ATOM 1528 CA VAL A 99 -3.288 -2.940 -1.062 1.00 0.00 C ATOM 1529 C VAL A 99 -4.538 -2.169 -1.471 1.00 0.00 C ATOM 1530 O VAL A 99 -4.811 -1.088 -0.950 1.00 0.00 O ATOM 1531 CB VAL A 99 -2.202 -2.742 -2.136 1.00 0.00 C ATOM 1532 CG1 VAL A 99 -1.884 -1.265 -2.309 1.00 0.00 C ATOM 1533 CG2 VAL A 99 -0.949 -3.527 -1.776 1.00 0.00 C ATOM 0 H VAL A 99 -3.067 -4.984 -1.471 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.922 -2.555 -0.110 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.581 -3.120 -3.085 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.115 -1.145 -3.072 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -2.784 -0.732 -2.615 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.525 -0.857 -1.364 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.192 -3.376 -2.545 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.566 -3.180 -0.816 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.191 -4.588 -1.708 1.00 0.00 H new ATOM 1543 N GLU A 100 -5.294 -2.732 -2.408 1.00 0.00 N ATOM 1544 CA GLU A 100 -6.516 -2.097 -2.888 1.00 0.00 C ATOM 1545 C GLU A 100 -7.386 -1.640 -1.721 1.00 0.00 C ATOM 1546 O GLU A 100 -8.004 -0.577 -1.772 1.00 0.00 O ATOM 1547 CB GLU A 100 -7.303 -3.061 -3.778 1.00 0.00 C ATOM 1548 CG GLU A 100 -6.967 -2.938 -5.255 1.00 0.00 C ATOM 1549 CD GLU A 100 -8.136 -3.299 -6.151 1.00 0.00 C ATOM 1550 OE1 GLU A 100 -9.289 -3.018 -5.764 1.00 0.00 O ATOM 1551 OE2 GLU A 100 -7.896 -3.861 -7.240 1.00 0.00 O ATOM 0 H GLU A 100 -5.082 -3.627 -2.850 1.00 0.00 H new ATOM 0 HA GLU A 100 -6.234 -1.222 -3.473 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -7.108 -4.083 -3.454 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -8.369 -2.881 -3.640 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -6.652 -1.916 -5.468 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -6.122 -3.587 -5.487 1.00 0.00 H new ATOM 1558 N PHE A 101 -7.428 -2.451 -0.669 1.00 0.00 N ATOM 1559 CA PHE A 101 -8.223 -2.132 0.511 1.00 0.00 C ATOM 1560 C PHE A 101 -7.645 -0.926 1.247 1.00 0.00 C ATOM 1561 O PHE A 101 -8.332 0.073 1.460 1.00 0.00 O ATOM 1562 CB PHE A 101 -8.284 -3.336 1.453 1.00 0.00 C ATOM 1563 CG PHE A 101 -9.341 -3.216 2.513 1.00 0.00 C ATOM 1564 CD1 PHE A 101 -10.650 -3.586 2.250 1.00 0.00 C ATOM 1565 CD2 PHE A 101 -9.025 -2.733 3.773 1.00 0.00 C ATOM 1566 CE1 PHE A 101 -11.625 -3.476 3.223 1.00 0.00 C ATOM 1567 CE2 PHE A 101 -9.996 -2.622 4.750 1.00 0.00 C ATOM 1568 CZ PHE A 101 -11.297 -2.993 4.475 1.00 0.00 C ATOM 0 H PHE A 101 -6.921 -3.334 -0.610 1.00 0.00 H new ATOM 0 HA PHE A 101 -9.232 -1.886 0.181 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.469 -4.236 0.867 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -7.313 -3.462 1.932 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -10.911 -3.965 1.273 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -8.009 -2.440 3.994 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.642 -3.767 3.005 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -9.737 -2.245 5.728 1.00 0.00 H new ATOM 0 HZ PHE A 101 -12.057 -2.906 5.237 1.00 0.00 H new ATOM 1578 N TYR A 102 -6.378 -1.028 1.632 1.00 0.00 N ATOM 1579 CA TYR A 102 -5.707 0.052 2.346 1.00 0.00 C ATOM 1580 C TYR A 102 -5.713 1.336 1.522 1.00 0.00 C ATOM 1581 O TYR A 102 -5.512 2.428 2.054 1.00 0.00 O ATOM 1582 CB TYR A 102 -4.269 -0.346 2.681 1.00 0.00 C ATOM 1583 CG TYR A 102 -4.166 -1.377 3.782 1.00 0.00 C ATOM 1584 CD1 TYR A 102 -4.984 -1.309 4.903 1.00 0.00 C ATOM 1585 CD2 TYR A 102 -3.251 -2.420 3.700 1.00 0.00 C ATOM 1586 CE1 TYR A 102 -4.893 -2.249 5.911 1.00 0.00 C ATOM 1587 CE2 TYR A 102 -3.155 -3.365 4.704 1.00 0.00 C ATOM 1588 CZ TYR A 102 -3.977 -3.275 5.807 1.00 0.00 C ATOM 1589 OH TYR A 102 -3.884 -4.214 6.809 1.00 0.00 O ATOM 0 H TYR A 102 -5.795 -1.847 1.462 1.00 0.00 H new ATOM 0 HA TYR A 102 -6.251 0.234 3.273 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -3.791 -0.737 1.783 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -3.714 0.545 2.976 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -5.703 -0.508 4.988 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -2.605 -2.493 2.838 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -5.536 -2.181 6.776 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -2.439 -4.170 4.625 1.00 0.00 H new ATOM 0 HH TYR A 102 -3.551 -5.057 6.437 1.00 0.00 H new ATOM 1599 N GLN A 103 -5.947 1.196 0.222 1.00 0.00 N ATOM 1600 CA GLN A 103 -5.979 2.344 -0.677 1.00 0.00 C ATOM 1601 C GLN A 103 -7.217 3.198 -0.423 1.00 0.00 C ATOM 1602 O GLN A 103 -7.306 4.331 -0.895 1.00 0.00 O ATOM 1603 CB GLN A 103 -5.955 1.879 -2.134 1.00 0.00 C ATOM 1604 CG GLN A 103 -4.581 1.433 -2.608 1.00 0.00 C ATOM 1605 CD GLN A 103 -4.640 0.617 -3.884 1.00 0.00 C ATOM 1606 OE1 GLN A 103 -4.203 -0.533 -3.920 1.00 0.00 O ATOM 1607 NE2 GLN A 103 -5.183 1.210 -4.941 1.00 0.00 N ATOM 0 H GLN A 103 -6.117 0.299 -0.233 1.00 0.00 H new ATOM 0 HA GLN A 103 -5.095 2.951 -0.483 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -6.657 1.054 -2.255 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -6.304 2.691 -2.772 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -3.955 2.310 -2.771 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -4.105 0.842 -1.825 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -5.533 2.165 -4.866 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -5.250 0.710 -5.828 1.00 0.00 H new ATOM 1616 N GLN A 104 -8.168 2.647 0.323 1.00 0.00 N ATOM 1617 CA GLN A 104 -9.401 3.359 0.638 1.00 0.00 C ATOM 1618 C GLN A 104 -9.509 3.624 2.135 1.00 0.00 C ATOM 1619 O GLN A 104 -10.228 4.526 2.565 1.00 0.00 O ATOM 1620 CB GLN A 104 -10.613 2.557 0.160 1.00 0.00 C ATOM 1621 CG GLN A 104 -10.368 1.058 0.104 1.00 0.00 C ATOM 1622 CD GLN A 104 -11.396 0.330 -0.739 1.00 0.00 C ATOM 1623 OE1 GLN A 104 -12.543 0.154 -0.327 1.00 0.00 O ATOM 1624 NE2 GLN A 104 -10.989 -0.099 -1.928 1.00 0.00 N ATOM 0 H GLN A 104 -8.109 1.710 0.721 1.00 0.00 H new ATOM 0 HA GLN A 104 -9.381 4.317 0.119 1.00 0.00 H new ATOM 0 HB2 GLN A 104 -11.454 2.755 0.825 1.00 0.00 H new ATOM 0 HB3 GLN A 104 -10.901 2.907 -0.831 1.00 0.00 H new ATOM 0 HG2 GLN A 104 -9.373 0.871 -0.301 1.00 0.00 H new ATOM 0 HG3 GLN A 104 -10.381 0.653 1.116 1.00 0.00 H new ATOM 0 HE21 GLN A 104 -10.029 0.069 -2.230 1.00 0.00 H new ATOM 0 HE22 GLN A 104 -11.636 -0.596 -2.540 1.00 0.00 H new ATOM 1633 N ASN A 105 -8.792 2.832 2.925 1.00 0.00 N ATOM 1634 CA ASN A 105 -8.808 2.981 4.376 1.00 0.00 C ATOM 1635 C ASN A 105 -7.404 3.245 4.912 1.00 0.00 C ATOM 1636 O ASN A 105 -6.420 2.730 4.382 1.00 0.00 O ATOM 1637 CB ASN A 105 -9.389 1.727 5.032 1.00 0.00 C ATOM 1638 CG ASN A 105 -10.729 1.333 4.441 1.00 0.00 C ATOM 1639 OD1 ASN A 105 -11.782 1.664 4.986 1.00 0.00 O ATOM 1640 ND2 ASN A 105 -10.695 0.622 3.320 1.00 0.00 N ATOM 0 H ASN A 105 -8.192 2.080 2.585 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.438 3.836 4.621 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -8.687 0.901 4.916 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -9.504 1.900 6.102 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -11.565 0.328 2.876 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.799 0.370 2.903 1.00 0.00 H new ATOM 1647 N SER A 106 -7.321 4.050 5.966 1.00 0.00 N ATOM 1648 CA SER A 106 -6.038 4.385 6.572 1.00 0.00 C ATOM 1649 C SER A 106 -5.408 3.158 7.225 1.00 0.00 C ATOM 1650 O SER A 106 -6.104 2.318 7.796 1.00 0.00 O ATOM 1651 CB SER A 106 -6.214 5.495 7.611 1.00 0.00 C ATOM 1652 OG SER A 106 -4.961 5.953 8.086 1.00 0.00 O ATOM 0 H SER A 106 -8.127 4.482 6.418 1.00 0.00 H new ATOM 0 HA SER A 106 -5.373 4.737 5.783 1.00 0.00 H new ATOM 0 HB2 SER A 106 -6.765 6.326 7.170 1.00 0.00 H new ATOM 0 HB3 SER A 106 -6.809 5.125 8.446 1.00 0.00 H new ATOM 0 HG SER A 106 -4.244 5.574 7.536 1.00 0.00 H new ATOM 1658 N LEU A 107 -4.086 3.062 7.135 1.00 0.00 N ATOM 1659 CA LEU A 107 -3.360 1.938 7.716 1.00 0.00 C ATOM 1660 C LEU A 107 -3.293 2.059 9.235 1.00 0.00 C ATOM 1661 O LEU A 107 -2.842 1.143 9.923 1.00 0.00 O ATOM 1662 CB LEU A 107 -1.946 1.864 7.137 1.00 0.00 C ATOM 1663 CG LEU A 107 -1.803 1.114 5.812 1.00 0.00 C ATOM 1664 CD1 LEU A 107 -2.209 2.004 4.648 1.00 0.00 C ATOM 1665 CD2 LEU A 107 -0.375 0.617 5.632 1.00 0.00 C ATOM 0 H LEU A 107 -3.495 3.748 6.666 1.00 0.00 H new ATOM 0 HA LEU A 107 -3.897 1.023 7.466 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -1.578 2.881 6.998 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -1.298 1.388 7.873 1.00 0.00 H new ATOM 0 HG LEU A 107 -2.468 0.251 5.832 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -2.101 1.453 3.714 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -3.248 2.311 4.770 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -1.570 2.887 4.625 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -0.291 0.086 4.684 1.00 0.00 H new ATOM 0 HD22 LEU A 107 0.309 1.466 5.634 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -0.119 -0.057 6.449 1.00 0.00 H new ATOM 1677 N LYS A 108 -3.747 3.196 9.753 1.00 0.00 N ATOM 1678 CA LYS A 108 -3.742 3.437 11.191 1.00 0.00 C ATOM 1679 C LYS A 108 -4.178 2.190 11.954 1.00 0.00 C ATOM 1680 O LYS A 108 -3.668 1.904 13.037 1.00 0.00 O ATOM 1681 CB LYS A 108 -4.667 4.607 11.535 1.00 0.00 C ATOM 1682 CG LYS A 108 -6.135 4.319 11.272 1.00 0.00 C ATOM 1683 CD LYS A 108 -7.029 5.398 11.861 1.00 0.00 C ATOM 1684 CE LYS A 108 -8.499 5.112 11.591 1.00 0.00 C ATOM 1685 NZ LYS A 108 -9.309 6.361 11.557 1.00 0.00 N ATOM 0 H LYS A 108 -4.123 3.965 9.198 1.00 0.00 H new ATOM 0 HA LYS A 108 -2.723 3.686 11.489 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -4.538 4.864 12.586 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -4.367 5.479 10.955 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -6.306 4.249 10.198 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -6.400 3.352 11.700 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -6.861 5.464 12.936 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -6.761 6.366 11.437 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -8.599 4.588 10.640 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -8.888 4.448 12.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -10.304 6.124 11.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -9.235 6.848 12.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -8.955 6.984 10.804 1.00 0.00 H new ATOM 1699 N ASP A 109 -5.121 1.451 11.381 1.00 0.00 N ATOM 1700 CA ASP A 109 -5.623 0.232 12.005 1.00 0.00 C ATOM 1701 C ASP A 109 -4.481 -0.577 12.612 1.00 0.00 C ATOM 1702 O ASP A 109 -4.591 -1.082 13.730 1.00 0.00 O ATOM 1703 CB ASP A 109 -6.379 -0.617 10.982 1.00 0.00 C ATOM 1704 CG ASP A 109 -6.328 -2.097 11.307 1.00 0.00 C ATOM 1705 OD1 ASP A 109 -6.250 -2.439 12.506 1.00 0.00 O ATOM 1706 OD2 ASP A 109 -6.366 -2.913 10.363 1.00 0.00 O ATOM 0 H ASP A 109 -5.554 1.675 10.485 1.00 0.00 H new ATOM 0 HA ASP A 109 -6.307 0.517 12.804 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -7.419 -0.292 10.942 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -5.955 -0.451 9.992 1.00 0.00 H new ATOM 1711 N CYS A 110 -3.387 -0.697 11.868 1.00 0.00 N ATOM 1712 CA CYS A 110 -2.226 -1.447 12.332 1.00 0.00 C ATOM 1713 C CYS A 110 -1.252 -0.537 13.073 1.00 0.00 C ATOM 1714 O CYS A 110 -0.584 -0.962 14.017 1.00 0.00 O ATOM 1715 CB CYS A 110 -1.520 -2.116 11.152 1.00 0.00 C ATOM 1716 SG CYS A 110 -0.217 -3.275 11.631 1.00 0.00 S ATOM 0 H CYS A 110 -3.280 -0.285 10.941 1.00 0.00 H new ATOM 0 HA CYS A 110 -2.573 -2.216 13.022 1.00 0.00 H new ATOM 0 HB2 CYS A 110 -2.260 -2.646 10.553 1.00 0.00 H new ATOM 0 HB3 CYS A 110 -1.088 -1.344 10.516 1.00 0.00 H new ATOM 0 HG CYS A 110 0.945 -2.734 11.417 1.00 0.00 H new ATOM 1722 N PHE A 111 -1.174 0.716 12.639 1.00 0.00 N ATOM 1723 CA PHE A 111 -0.279 1.686 13.260 1.00 0.00 C ATOM 1724 C PHE A 111 -1.002 3.005 13.518 1.00 0.00 C ATOM 1725 O PHE A 111 -0.873 3.959 12.750 1.00 0.00 O ATOM 1726 CB PHE A 111 0.942 1.927 12.370 1.00 0.00 C ATOM 1727 CG PHE A 111 1.754 0.689 12.120 1.00 0.00 C ATOM 1728 CD1 PHE A 111 2.719 0.281 13.028 1.00 0.00 C ATOM 1729 CD2 PHE A 111 1.553 -0.068 10.977 1.00 0.00 C ATOM 1730 CE1 PHE A 111 3.468 -0.858 12.799 1.00 0.00 C ATOM 1731 CE2 PHE A 111 2.299 -1.208 10.743 1.00 0.00 C ATOM 1732 CZ PHE A 111 3.257 -1.604 11.656 1.00 0.00 C ATOM 0 H PHE A 111 -1.720 1.084 11.860 1.00 0.00 H new ATOM 0 HA PHE A 111 0.051 1.279 14.216 1.00 0.00 H new ATOM 0 HB2 PHE A 111 0.611 2.334 11.415 1.00 0.00 H new ATOM 0 HB3 PHE A 111 1.577 2.681 12.835 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.887 0.860 13.924 1.00 0.00 H new ATOM 0 HD2 PHE A 111 0.805 0.236 10.260 1.00 0.00 H new ATOM 0 HE1 PHE A 111 4.218 -1.164 13.513 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.133 -1.788 9.847 1.00 0.00 H new ATOM 0 HZ PHE A 111 3.840 -2.495 11.476 1.00 0.00 H new ATOM 1742 N LYS A 112 -1.764 3.052 14.605 1.00 0.00 N ATOM 1743 CA LYS A 112 -2.508 4.253 14.968 1.00 0.00 C ATOM 1744 C LYS A 112 -1.684 5.507 14.695 1.00 0.00 C ATOM 1745 O LYS A 112 -2.191 6.489 14.152 1.00 0.00 O ATOM 1746 CB LYS A 112 -2.908 4.204 16.444 1.00 0.00 C ATOM 1747 CG LYS A 112 -3.920 5.266 16.835 1.00 0.00 C ATOM 1748 CD LYS A 112 -5.304 4.943 16.299 1.00 0.00 C ATOM 1749 CE LYS A 112 -6.215 6.161 16.334 1.00 0.00 C ATOM 1750 NZ LYS A 112 -6.957 6.262 17.621 1.00 0.00 N ATOM 0 H LYS A 112 -1.883 2.272 15.251 1.00 0.00 H new ATOM 0 HA LYS A 112 -3.409 4.291 14.355 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -3.321 3.220 16.667 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -2.015 4.321 17.058 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -3.960 5.349 17.921 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -3.598 6.235 16.453 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -5.222 4.578 15.275 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -5.746 4.140 16.890 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -5.621 7.063 16.185 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -6.925 6.107 15.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -7.566 7.105 17.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -7.543 5.413 17.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -6.280 6.339 18.407 1.00 0.00 H new ATOM 1764 N SER A 113 -0.410 5.466 15.073 1.00 0.00 N ATOM 1765 CA SER A 113 0.484 6.600 14.871 1.00 0.00 C ATOM 1766 C SER A 113 0.611 6.934 13.387 1.00 0.00 C ATOM 1767 O SER A 113 0.690 8.103 13.007 1.00 0.00 O ATOM 1768 CB SER A 113 1.865 6.299 15.457 1.00 0.00 C ATOM 1769 OG SER A 113 2.559 5.350 14.667 1.00 0.00 O ATOM 0 H SER A 113 0.026 4.660 15.521 1.00 0.00 H new ATOM 0 HA SER A 113 0.059 7.462 15.385 1.00 0.00 H new ATOM 0 HB2 SER A 113 2.446 7.219 15.519 1.00 0.00 H new ATOM 0 HB3 SER A 113 1.757 5.921 16.474 1.00 0.00 H new ATOM 0 HG SER A 113 3.439 5.176 15.062 1.00 0.00 H new ATOM 1775 N LEU A 114 0.630 5.900 12.554 1.00 0.00 N ATOM 1776 CA LEU A 114 0.747 6.082 11.111 1.00 0.00 C ATOM 1777 C LEU A 114 -0.616 5.976 10.437 1.00 0.00 C ATOM 1778 O LEU A 114 -1.080 4.880 10.119 1.00 0.00 O ATOM 1779 CB LEU A 114 1.703 5.042 10.523 1.00 0.00 C ATOM 1780 CG LEU A 114 1.831 5.035 8.999 1.00 0.00 C ATOM 1781 CD1 LEU A 114 2.114 6.436 8.481 1.00 0.00 C ATOM 1782 CD2 LEU A 114 2.923 4.071 8.560 1.00 0.00 C ATOM 0 H LEU A 114 0.566 4.927 12.852 1.00 0.00 H new ATOM 0 HA LEU A 114 1.146 7.079 10.926 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.693 5.205 10.950 1.00 0.00 H new ATOM 0 HB3 LEU A 114 1.375 4.053 10.845 1.00 0.00 H new ATOM 0 HG LEU A 114 0.885 4.698 8.576 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.202 6.411 7.395 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.298 7.100 8.764 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.046 6.802 8.912 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.000 4.079 7.473 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.875 4.378 8.993 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.678 3.064 8.899 1.00 0.00 H new ATOM 1794 N ASP A 115 -1.253 7.121 10.218 1.00 0.00 N ATOM 1795 CA ASP A 115 -2.563 7.158 9.578 1.00 0.00 C ATOM 1796 C ASP A 115 -2.441 7.576 8.116 1.00 0.00 C ATOM 1797 O ASP A 115 -2.900 8.650 7.725 1.00 0.00 O ATOM 1798 CB ASP A 115 -3.491 8.120 10.321 1.00 0.00 C ATOM 1799 CG ASP A 115 -3.256 8.110 11.819 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -2.364 8.849 12.285 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -3.966 7.364 12.525 1.00 0.00 O ATOM 0 H ASP A 115 -0.883 8.036 10.474 1.00 0.00 H new ATOM 0 HA ASP A 115 -2.987 6.155 9.617 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -3.343 9.130 9.940 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -4.527 7.851 10.117 1.00 0.00 H new ATOM 1806 N THR A 116 -1.818 6.721 7.311 1.00 0.00 N ATOM 1807 CA THR A 116 -1.633 7.002 5.893 1.00 0.00 C ATOM 1808 C THR A 116 -2.327 5.954 5.030 1.00 0.00 C ATOM 1809 O THR A 116 -2.961 5.032 5.543 1.00 0.00 O ATOM 1810 CB THR A 116 -0.140 7.051 5.519 1.00 0.00 C ATOM 1811 OG1 THR A 116 0.012 7.472 4.159 1.00 0.00 O ATOM 1812 CG2 THR A 116 0.511 5.689 5.709 1.00 0.00 C ATOM 0 H THR A 116 -1.433 5.828 7.617 1.00 0.00 H new ATOM 0 HA THR A 116 -2.079 7.978 5.704 1.00 0.00 H new ATOM 0 HB THR A 116 0.352 7.767 6.177 1.00 0.00 H new ATOM 0 HG1 THR A 116 -0.110 8.443 4.101 1.00 0.00 H new ATOM 0 HG21 THR A 116 1.565 5.749 5.438 1.00 0.00 H new ATOM 0 HG22 THR A 116 0.421 5.385 6.752 1.00 0.00 H new ATOM 0 HG23 THR A 116 0.014 4.956 5.073 1.00 0.00 H new ATOM 1820 N THR A 117 -2.202 6.100 3.714 1.00 0.00 N ATOM 1821 CA THR A 117 -2.817 5.166 2.779 1.00 0.00 C ATOM 1822 C THR A 117 -1.972 5.013 1.520 1.00 0.00 C ATOM 1823 O THR A 117 -1.054 5.797 1.276 1.00 0.00 O ATOM 1824 CB THR A 117 -4.234 5.621 2.382 1.00 0.00 C ATOM 1825 OG1 THR A 117 -4.238 7.026 2.108 1.00 0.00 O ATOM 1826 CG2 THR A 117 -5.232 5.311 3.487 1.00 0.00 C ATOM 0 H THR A 117 -1.680 6.857 3.272 1.00 0.00 H new ATOM 0 HA THR A 117 -2.882 4.204 3.288 1.00 0.00 H new ATOM 0 HB THR A 117 -4.529 5.076 1.486 1.00 0.00 H new ATOM 0 HG1 THR A 117 -5.142 7.307 1.855 1.00 0.00 H new ATOM 0 HG21 THR A 117 -6.225 5.642 3.183 1.00 0.00 H new ATOM 0 HG22 THR A 117 -5.248 4.237 3.672 1.00 0.00 H new ATOM 0 HG23 THR A 117 -4.939 5.832 4.398 1.00 0.00 H new ATOM 1834 N LEU A 118 -2.287 3.999 0.722 1.00 0.00 N ATOM 1835 CA LEU A 118 -1.557 3.743 -0.515 1.00 0.00 C ATOM 1836 C LEU A 118 -1.988 4.710 -1.612 1.00 0.00 C ATOM 1837 O LEU A 118 -2.972 4.471 -2.311 1.00 0.00 O ATOM 1838 CB LEU A 118 -1.782 2.301 -0.974 1.00 0.00 C ATOM 1839 CG LEU A 118 -1.372 1.210 0.016 1.00 0.00 C ATOM 1840 CD1 LEU A 118 0.092 1.359 0.400 1.00 0.00 C ATOM 1841 CD2 LEU A 118 -2.256 1.253 1.254 1.00 0.00 C ATOM 0 H LEU A 118 -3.043 3.340 0.909 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.496 3.895 -0.319 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.840 2.175 -1.205 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -1.232 2.146 -1.902 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.503 0.242 -0.467 1.00 0.00 H new ATOM 0 HD11 LEU A 118 0.365 0.574 1.105 1.00 0.00 H new ATOM 0 HD12 LEU A 118 0.712 1.277 -0.492 1.00 0.00 H new ATOM 0 HD13 LEU A 118 0.249 2.333 0.863 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.950 0.470 1.947 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -2.157 2.225 1.738 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.295 1.096 0.965 1.00 0.00 H new ATOM 1853 N GLN A 119 -1.244 5.802 -1.758 1.00 0.00 N ATOM 1854 CA GLN A 119 -1.549 6.804 -2.771 1.00 0.00 C ATOM 1855 C GLN A 119 -1.136 6.320 -4.158 1.00 0.00 C ATOM 1856 O GLN A 119 -1.983 6.000 -4.992 1.00 0.00 O ATOM 1857 CB GLN A 119 -0.841 8.121 -2.446 1.00 0.00 C ATOM 1858 CG GLN A 119 -0.912 8.503 -0.977 1.00 0.00 C ATOM 1859 CD GLN A 119 -0.981 10.003 -0.766 1.00 0.00 C ATOM 1860 OE1 GLN A 119 -0.829 10.781 -1.708 1.00 0.00 O ATOM 1861 NE2 GLN A 119 -1.211 10.417 0.474 1.00 0.00 N ATOM 0 H GLN A 119 -0.426 6.015 -1.187 1.00 0.00 H new ATOM 0 HA GLN A 119 -2.626 6.969 -2.769 1.00 0.00 H new ATOM 0 HB2 GLN A 119 0.205 8.044 -2.743 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -1.284 8.919 -3.042 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -1.788 8.036 -0.526 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -0.038 8.107 -0.460 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -1.331 9.737 1.225 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -1.268 11.415 0.676 1.00 0.00 H new ATOM 1870 N PHE A 120 0.170 6.269 -4.397 1.00 0.00 N ATOM 1871 CA PHE A 120 0.695 5.825 -5.683 1.00 0.00 C ATOM 1872 C PHE A 120 1.978 5.021 -5.498 1.00 0.00 C ATOM 1873 O PHE A 120 2.714 5.192 -4.525 1.00 0.00 O ATOM 1874 CB PHE A 120 0.959 7.027 -6.592 1.00 0.00 C ATOM 1875 CG PHE A 120 0.050 8.192 -6.325 1.00 0.00 C ATOM 1876 CD1 PHE A 120 -1.287 8.141 -6.683 1.00 0.00 C ATOM 1877 CD2 PHE A 120 0.533 9.340 -5.716 1.00 0.00 C ATOM 1878 CE1 PHE A 120 -2.127 9.211 -6.439 1.00 0.00 C ATOM 1879 CE2 PHE A 120 -0.302 10.413 -5.469 1.00 0.00 C ATOM 1880 CZ PHE A 120 -1.634 10.349 -5.832 1.00 0.00 C ATOM 0 H PHE A 120 0.884 6.530 -3.717 1.00 0.00 H new ATOM 0 HA PHE A 120 -0.051 5.182 -6.150 1.00 0.00 H new ATOM 0 HB2 PHE A 120 1.993 7.347 -6.466 1.00 0.00 H new ATOM 0 HB3 PHE A 120 0.845 6.718 -7.631 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.678 7.254 -7.159 1.00 0.00 H new ATOM 0 HD2 PHE A 120 1.573 9.396 -5.431 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -3.168 9.157 -6.723 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.086 11.301 -4.993 1.00 0.00 H new ATOM 0 HZ PHE A 120 -2.288 11.187 -5.641 1.00 0.00 H new ATOM 1890 N PRO A 121 2.255 4.121 -6.453 1.00 0.00 N ATOM 1891 CA PRO A 121 3.449 3.272 -6.419 1.00 0.00 C ATOM 1892 C PRO A 121 4.730 4.063 -6.657 1.00 0.00 C ATOM 1893 O PRO A 121 4.692 5.193 -7.145 1.00 0.00 O ATOM 1894 CB PRO A 121 3.212 2.281 -7.561 1.00 0.00 C ATOM 1895 CG PRO A 121 2.300 2.994 -8.498 1.00 0.00 C ATOM 1896 CD PRO A 121 1.423 3.863 -7.641 1.00 0.00 C ATOM 0 HA PRO A 121 3.585 2.798 -5.447 1.00 0.00 H new ATOM 0 HB2 PRO A 121 4.148 2.009 -8.050 1.00 0.00 H new ATOM 0 HB3 PRO A 121 2.762 1.357 -7.197 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.865 3.593 -9.212 1.00 0.00 H new ATOM 0 HG3 PRO A 121 1.704 2.288 -9.076 1.00 0.00 H new ATOM 0 HD2 PRO A 121 1.153 4.788 -8.151 1.00 0.00 H new ATOM 0 HD3 PRO A 121 0.492 3.360 -7.378 1.00 0.00 H new ATOM 1904 N PHE A 122 5.864 3.463 -6.310 1.00 0.00 N ATOM 1905 CA PHE A 122 7.158 4.113 -6.486 1.00 0.00 C ATOM 1906 C PHE A 122 7.613 4.033 -7.940 1.00 0.00 C ATOM 1907 O PHE A 122 8.148 4.996 -8.490 1.00 0.00 O ATOM 1908 CB PHE A 122 8.204 3.468 -5.575 1.00 0.00 C ATOM 1909 CG PHE A 122 8.822 2.228 -6.156 1.00 0.00 C ATOM 1910 CD1 PHE A 122 8.189 1.002 -6.037 1.00 0.00 C ATOM 1911 CD2 PHE A 122 10.036 2.290 -6.822 1.00 0.00 C ATOM 1912 CE1 PHE A 122 8.755 -0.140 -6.570 1.00 0.00 C ATOM 1913 CE2 PHE A 122 10.607 1.151 -7.357 1.00 0.00 C ATOM 1914 CZ PHE A 122 9.965 -0.066 -7.232 1.00 0.00 C ATOM 0 H PHE A 122 5.913 2.528 -5.905 1.00 0.00 H new ATOM 0 HA PHE A 122 7.050 5.163 -6.215 1.00 0.00 H new ATOM 0 HB2 PHE A 122 8.991 4.194 -5.368 1.00 0.00 H new ATOM 0 HB3 PHE A 122 7.740 3.220 -4.621 1.00 0.00 H new ATOM 0 HD1 PHE A 122 7.242 0.938 -5.522 1.00 0.00 H new ATOM 0 HD2 PHE A 122 10.541 3.239 -6.924 1.00 0.00 H new ATOM 0 HE1 PHE A 122 8.252 -1.090 -6.469 1.00 0.00 H new ATOM 0 HE2 PHE A 122 11.554 1.212 -7.872 1.00 0.00 H new ATOM 0 HZ PHE A 122 10.408 -0.957 -7.651 1.00 0.00 H new ATOM 1924 N LYS A 123 7.399 2.876 -8.558 1.00 0.00 N ATOM 1925 CA LYS A 123 7.786 2.668 -9.948 1.00 0.00 C ATOM 1926 C LYS A 123 7.031 3.618 -10.872 1.00 0.00 C ATOM 1927 O LYS A 123 7.510 3.958 -11.953 1.00 0.00 O ATOM 1928 CB LYS A 123 7.519 1.218 -10.361 1.00 0.00 C ATOM 1929 CG LYS A 123 8.559 0.238 -9.847 1.00 0.00 C ATOM 1930 CD LYS A 123 8.666 -0.984 -10.745 1.00 0.00 C ATOM 1931 CE LYS A 123 9.344 -2.143 -10.030 1.00 0.00 C ATOM 1932 NZ LYS A 123 10.822 -2.115 -10.209 1.00 0.00 N ATOM 0 H LYS A 123 6.959 2.068 -8.118 1.00 0.00 H new ATOM 0 HA LYS A 123 8.852 2.875 -10.037 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.537 0.919 -9.993 1.00 0.00 H new ATOM 0 HB3 LYS A 123 7.483 1.160 -11.449 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.528 0.733 -9.787 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.298 -0.074 -8.836 1.00 0.00 H new ATOM 0 HD2 LYS A 123 7.670 -1.287 -11.069 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.229 -0.729 -11.643 1.00 0.00 H new ATOM 0 HE2 LYS A 123 9.106 -2.104 -8.967 1.00 0.00 H new ATOM 0 HE3 LYS A 123 8.950 -3.085 -10.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 11.248 -2.920 -9.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 11.050 -2.178 -11.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.202 -1.227 -9.823 1.00 0.00 H new ATOM 1946 N GLU A 124 5.849 4.044 -10.437 1.00 0.00 N ATOM 1947 CA GLU A 124 5.030 4.956 -11.226 1.00 0.00 C ATOM 1948 C GLU A 124 5.902 5.884 -12.067 1.00 0.00 C ATOM 1949 O GLU A 124 6.821 6.534 -11.568 1.00 0.00 O ATOM 1950 CB GLU A 124 4.122 5.782 -10.311 1.00 0.00 C ATOM 1951 CG GLU A 124 2.753 6.064 -10.906 1.00 0.00 C ATOM 1952 CD GLU A 124 2.031 7.196 -10.200 1.00 0.00 C ATOM 1953 OE1 GLU A 124 2.709 8.148 -9.762 1.00 0.00 O ATOM 1954 OE2 GLU A 124 0.790 7.128 -10.086 1.00 0.00 O ATOM 0 H GLU A 124 5.438 3.772 -9.544 1.00 0.00 H new ATOM 0 HA GLU A 124 4.413 4.359 -11.898 1.00 0.00 H new ATOM 0 HB2 GLU A 124 3.996 5.254 -9.366 1.00 0.00 H new ATOM 0 HB3 GLU A 124 4.613 6.729 -10.085 1.00 0.00 H new ATOM 0 HG2 GLU A 124 2.864 6.311 -11.962 1.00 0.00 H new ATOM 0 HG3 GLU A 124 2.145 5.161 -10.852 1.00 0.00 H new ATOM 1961 N PRO A 125 5.611 5.945 -13.374 1.00 0.00 N ATOM 1962 CA PRO A 125 6.357 6.789 -14.313 1.00 0.00 C ATOM 1963 C PRO A 125 6.101 8.275 -14.085 1.00 0.00 C ATOM 1964 O PRO A 125 5.036 8.665 -13.607 1.00 0.00 O ATOM 1965 CB PRO A 125 5.821 6.358 -15.680 1.00 0.00 C ATOM 1966 CG PRO A 125 4.458 5.824 -15.402 1.00 0.00 C ATOM 1967 CD PRO A 125 4.530 5.197 -14.037 1.00 0.00 C ATOM 0 HA PRO A 125 7.435 6.666 -14.204 1.00 0.00 H new ATOM 0 HB2 PRO A 125 5.783 7.198 -16.373 1.00 0.00 H new ATOM 0 HB3 PRO A 125 6.458 5.599 -16.134 1.00 0.00 H new ATOM 0 HG2 PRO A 125 3.714 6.620 -15.427 1.00 0.00 H new ATOM 0 HG3 PRO A 125 4.165 5.091 -16.153 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.586 5.294 -13.500 1.00 0.00 H new ATOM 0 HD3 PRO A 125 4.755 4.132 -14.095 1.00 0.00 H new ATOM 1975 N GLU A 126 7.085 9.100 -14.431 1.00 0.00 N ATOM 1976 CA GLU A 126 6.965 10.543 -14.264 1.00 0.00 C ATOM 1977 C GLU A 126 6.354 11.186 -15.505 1.00 0.00 C ATOM 1978 O GLU A 126 6.421 10.632 -16.603 1.00 0.00 O ATOM 1979 CB GLU A 126 8.335 11.161 -13.977 1.00 0.00 C ATOM 1980 CG GLU A 126 8.272 12.630 -13.592 1.00 0.00 C ATOM 1981 CD GLU A 126 7.724 12.844 -12.195 1.00 0.00 C ATOM 1982 OE1 GLU A 126 8.446 12.541 -11.222 1.00 0.00 O ATOM 1983 OE2 GLU A 126 6.573 13.313 -12.074 1.00 0.00 O ATOM 0 H GLU A 126 7.973 8.793 -14.828 1.00 0.00 H new ATOM 0 HA GLU A 126 6.305 10.731 -13.417 1.00 0.00 H new ATOM 0 HB2 GLU A 126 8.814 10.603 -13.172 1.00 0.00 H new ATOM 0 HB3 GLU A 126 8.965 11.052 -14.860 1.00 0.00 H new ATOM 0 HG2 GLU A 126 9.271 13.062 -13.656 1.00 0.00 H new ATOM 0 HG3 GLU A 126 7.647 13.163 -14.309 1.00 0.00 H new ATOM 1990 N LYS A 127 5.759 12.360 -15.324 1.00 0.00 N ATOM 1991 CA LYS A 127 5.136 13.081 -16.428 1.00 0.00 C ATOM 1992 C LYS A 127 6.067 14.163 -16.966 1.00 0.00 C ATOM 1993 O LYS A 127 5.970 15.328 -16.580 1.00 0.00 O ATOM 1994 CB LYS A 127 3.816 13.709 -15.974 1.00 0.00 C ATOM 1995 CG LYS A 127 2.659 12.727 -15.928 1.00 0.00 C ATOM 1996 CD LYS A 127 2.805 11.747 -14.775 1.00 0.00 C ATOM 1997 CE LYS A 127 2.491 12.406 -13.441 1.00 0.00 C ATOM 1998 NZ LYS A 127 2.090 11.407 -12.411 1.00 0.00 N ATOM 0 H LYS A 127 5.695 12.833 -14.423 1.00 0.00 H new ATOM 0 HA LYS A 127 4.936 12.368 -17.228 1.00 0.00 H new ATOM 0 HB2 LYS A 127 3.952 14.144 -14.984 1.00 0.00 H new ATOM 0 HB3 LYS A 127 3.561 14.526 -16.649 1.00 0.00 H new ATOM 0 HG2 LYS A 127 1.721 13.273 -15.826 1.00 0.00 H new ATOM 0 HG3 LYS A 127 2.608 12.179 -16.869 1.00 0.00 H new ATOM 0 HD2 LYS A 127 2.137 10.899 -14.930 1.00 0.00 H new ATOM 0 HD3 LYS A 127 3.821 11.353 -14.757 1.00 0.00 H new ATOM 0 HE2 LYS A 127 3.365 12.956 -13.093 1.00 0.00 H new ATOM 0 HE3 LYS A 127 1.689 13.132 -13.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 1.884 11.895 -11.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 1.241 10.899 -12.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 2.865 10.729 -12.265 1.00 0.00 H new ATOM 2012 N ARG A 128 6.969 13.770 -17.860 1.00 0.00 N ATOM 2013 CA ARG A 128 7.918 14.706 -18.451 1.00 0.00 C ATOM 2014 C ARG A 128 7.194 15.761 -19.283 1.00 0.00 C ATOM 2015 O ARG A 128 6.734 15.485 -20.391 1.00 0.00 O ATOM 2016 CB ARG A 128 8.929 13.959 -19.322 1.00 0.00 C ATOM 2017 CG ARG A 128 10.039 13.288 -18.529 1.00 0.00 C ATOM 2018 CD ARG A 128 11.068 14.299 -18.047 1.00 0.00 C ATOM 2019 NE ARG A 128 11.981 13.723 -17.064 1.00 0.00 N ATOM 2020 CZ ARG A 128 13.068 13.031 -17.387 1.00 0.00 C ATOM 2021 NH1 ARG A 128 13.375 12.829 -18.661 1.00 0.00 N ATOM 2022 NH2 ARG A 128 13.850 12.538 -16.435 1.00 0.00 N ATOM 0 H ARG A 128 7.062 12.810 -18.191 1.00 0.00 H new ATOM 0 HA ARG A 128 8.448 15.207 -17.641 1.00 0.00 H new ATOM 0 HB2 ARG A 128 8.404 13.203 -19.906 1.00 0.00 H new ATOM 0 HB3 ARG A 128 9.372 14.659 -20.030 1.00 0.00 H new ATOM 0 HG2 ARG A 128 9.612 12.766 -17.673 1.00 0.00 H new ATOM 0 HG3 ARG A 128 10.528 12.537 -19.149 1.00 0.00 H new ATOM 0 HD2 ARG A 128 11.639 14.670 -18.898 1.00 0.00 H new ATOM 0 HD3 ARG A 128 10.557 15.156 -17.609 1.00 0.00 H new ATOM 0 HE ARG A 128 11.773 13.859 -16.075 1.00 0.00 H new ATOM 0 HH11 ARG A 128 12.776 13.205 -19.396 1.00 0.00 H new ATOM 0 HH12 ARG A 128 14.210 12.297 -18.906 1.00 0.00 H new ATOM 0 HH21 ARG A 128 13.617 12.690 -15.454 1.00 0.00 H new ATOM 0 HH22 ARG A 128 14.684 12.007 -16.684 1.00 0.00 H new ATOM 2036 N THR A 129 7.096 16.971 -18.740 1.00 0.00 N ATOM 2037 CA THR A 129 6.427 18.066 -19.431 1.00 0.00 C ATOM 2038 C THR A 129 7.287 19.324 -19.429 1.00 0.00 C ATOM 2039 O THR A 129 8.180 19.476 -18.594 1.00 0.00 O ATOM 2040 CB THR A 129 5.065 18.388 -18.787 1.00 0.00 C ATOM 2041 OG1 THR A 129 5.227 18.608 -17.382 1.00 0.00 O ATOM 2042 CG2 THR A 129 4.077 17.255 -19.017 1.00 0.00 C ATOM 0 H THR A 129 7.471 17.217 -17.824 1.00 0.00 H new ATOM 0 HA THR A 129 6.267 17.740 -20.459 1.00 0.00 H new ATOM 0 HB THR A 129 4.672 19.292 -19.253 1.00 0.00 H new ATOM 0 HG1 THR A 129 4.357 18.814 -16.981 1.00 0.00 H new ATOM 0 HG21 THR A 129 3.123 17.505 -18.553 1.00 0.00 H new ATOM 0 HG22 THR A 129 3.933 17.109 -20.088 1.00 0.00 H new ATOM 0 HG23 THR A 129 4.466 16.338 -18.575 1.00 0.00 H new ATOM 2050 N ILE A 130 7.014 20.224 -20.367 1.00 0.00 N ATOM 2051 CA ILE A 130 7.762 21.471 -20.471 1.00 0.00 C ATOM 2052 C ILE A 130 7.155 22.552 -19.585 1.00 0.00 C ATOM 2053 O ILE A 130 6.098 22.356 -18.984 1.00 0.00 O ATOM 2054 CB ILE A 130 7.809 21.979 -21.924 1.00 0.00 C ATOM 2055 CG1 ILE A 130 6.395 22.260 -22.435 1.00 0.00 C ATOM 2056 CG2 ILE A 130 8.510 20.967 -22.818 1.00 0.00 C ATOM 2057 CD1 ILE A 130 5.929 23.676 -22.177 1.00 0.00 C ATOM 0 H ILE A 130 6.280 20.113 -21.066 1.00 0.00 H new ATOM 0 HA ILE A 130 8.777 21.259 -20.136 1.00 0.00 H new ATOM 0 HB ILE A 130 8.376 22.910 -21.949 1.00 0.00 H new ATOM 0 HG12 ILE A 130 6.359 22.064 -23.507 1.00 0.00 H new ATOM 0 HG13 ILE A 130 5.701 21.566 -21.961 1.00 0.00 H new ATOM 0 HG21 ILE A 130 8.535 21.341 -23.841 1.00 0.00 H new ATOM 0 HG22 ILE A 130 9.529 20.813 -22.463 1.00 0.00 H new ATOM 0 HG23 ILE A 130 7.969 20.021 -22.791 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.919 23.803 -22.566 1.00 0.00 H new ATOM 0 HD12 ILE A 130 5.932 23.870 -21.104 1.00 0.00 H new ATOM 0 HD13 ILE A 130 6.600 24.376 -22.675 1.00 0.00 H new ATOM 2069 N SER A 131 7.829 23.695 -19.509 1.00 0.00 N ATOM 2070 CA SER A 131 7.357 24.809 -18.694 1.00 0.00 C ATOM 2071 C SER A 131 6.324 25.637 -19.452 1.00 0.00 C ATOM 2072 O SER A 131 6.671 26.568 -20.179 1.00 0.00 O ATOM 2073 CB SER A 131 8.531 25.696 -18.276 1.00 0.00 C ATOM 2074 OG SER A 131 8.172 26.541 -17.196 1.00 0.00 O ATOM 0 H SER A 131 8.704 23.874 -20.002 1.00 0.00 H new ATOM 0 HA SER A 131 6.885 24.399 -17.801 1.00 0.00 H new ATOM 0 HB2 SER A 131 9.378 25.073 -17.988 1.00 0.00 H new ATOM 0 HB3 SER A 131 8.854 26.301 -19.123 1.00 0.00 H new ATOM 0 HG SER A 131 8.940 27.097 -16.946 1.00 0.00 H new ATOM 2080 N ARG A 132 5.053 25.290 -19.276 1.00 0.00 N ATOM 2081 CA ARG A 132 3.968 26.000 -19.944 1.00 0.00 C ATOM 2082 C ARG A 132 3.559 27.238 -19.151 1.00 0.00 C ATOM 2083 O ARG A 132 3.891 27.371 -17.974 1.00 0.00 O ATOM 2084 CB ARG A 132 2.762 25.076 -20.126 1.00 0.00 C ATOM 2085 CG ARG A 132 1.693 25.645 -21.045 1.00 0.00 C ATOM 2086 CD ARG A 132 0.882 24.541 -21.706 1.00 0.00 C ATOM 2087 NE ARG A 132 0.219 25.003 -22.922 1.00 0.00 N ATOM 2088 CZ ARG A 132 -0.464 24.204 -23.735 1.00 0.00 C ATOM 2089 NH1 ARG A 132 -0.573 22.912 -23.463 1.00 0.00 N ATOM 2090 NH2 ARG A 132 -1.040 24.699 -24.823 1.00 0.00 N ATOM 0 H ARG A 132 4.749 24.522 -18.677 1.00 0.00 H new ATOM 0 HA ARG A 132 4.324 26.319 -20.924 1.00 0.00 H new ATOM 0 HB2 ARG A 132 3.103 24.121 -20.527 1.00 0.00 H new ATOM 0 HB3 ARG A 132 2.320 24.873 -19.151 1.00 0.00 H new ATOM 0 HG2 ARG A 132 1.029 26.294 -20.474 1.00 0.00 H new ATOM 0 HG3 ARG A 132 2.161 26.263 -21.811 1.00 0.00 H new ATOM 0 HD2 ARG A 132 1.537 23.704 -21.946 1.00 0.00 H new ATOM 0 HD3 ARG A 132 0.135 24.170 -21.004 1.00 0.00 H new ATOM 0 HE ARG A 132 0.284 25.993 -23.160 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -0.132 22.528 -22.627 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -1.098 22.302 -24.089 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -0.959 25.693 -25.036 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -1.564 24.085 -25.447 1.00 0.00 H new ATOM 2104 N SER A 133 2.837 28.142 -19.806 1.00 0.00 N ATOM 2105 CA SER A 133 2.386 29.371 -19.164 1.00 0.00 C ATOM 2106 C SER A 133 0.899 29.297 -18.833 1.00 0.00 C ATOM 2107 O SER A 133 0.488 29.569 -17.706 1.00 0.00 O ATOM 2108 CB SER A 133 2.660 30.574 -20.069 1.00 0.00 C ATOM 2109 OG SER A 133 2.174 31.771 -19.487 1.00 0.00 O ATOM 0 H SER A 133 2.552 28.046 -20.781 1.00 0.00 H new ATOM 0 HA SER A 133 2.941 29.491 -18.234 1.00 0.00 H new ATOM 0 HB2 SER A 133 3.732 30.662 -20.248 1.00 0.00 H new ATOM 0 HB3 SER A 133 2.187 30.419 -21.039 1.00 0.00 H new ATOM 0 HG SER A 133 2.363 32.525 -20.084 1.00 0.00 H new ATOM 2115 N GLY A 134 0.096 28.928 -19.826 1.00 0.00 N ATOM 2116 CA GLY A 134 -1.337 28.825 -19.622 1.00 0.00 C ATOM 2117 C GLY A 134 -1.941 30.110 -19.092 1.00 0.00 C ATOM 2118 O GLY A 134 -2.315 30.210 -17.923 1.00 0.00 O ATOM 0 H GLY A 134 0.412 28.699 -20.768 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -1.817 28.563 -20.565 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -1.544 28.015 -18.923 1.00 0.00 H new ATOM 2122 N PRO A 135 -2.042 31.124 -19.964 1.00 0.00 N ATOM 2123 CA PRO A 135 -2.603 32.429 -19.600 1.00 0.00 C ATOM 2124 C PRO A 135 -4.106 32.364 -19.352 1.00 0.00 C ATOM 2125 O PRO A 135 -4.812 31.561 -19.961 1.00 0.00 O ATOM 2126 CB PRO A 135 -2.300 33.299 -20.823 1.00 0.00 C ATOM 2127 CG PRO A 135 -2.192 32.337 -21.955 1.00 0.00 C ATOM 2128 CD PRO A 135 -1.617 31.076 -21.373 1.00 0.00 C ATOM 0 HA PRO A 135 -2.178 32.811 -18.672 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -3.092 34.027 -20.997 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -1.375 33.860 -20.690 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -3.168 32.150 -22.403 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -1.550 32.732 -22.743 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.000 30.189 -21.878 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -0.531 31.050 -21.464 1.00 0.00 H new ATOM 2136 N SER A 136 -4.590 33.215 -18.452 1.00 0.00 N ATOM 2137 CA SER A 136 -6.009 33.253 -18.121 1.00 0.00 C ATOM 2138 C SER A 136 -6.765 34.176 -19.071 1.00 0.00 C ATOM 2139 O SER A 136 -6.462 35.365 -19.171 1.00 0.00 O ATOM 2140 CB SER A 136 -6.205 33.718 -16.676 1.00 0.00 C ATOM 2141 OG SER A 136 -5.647 32.790 -15.762 1.00 0.00 O ATOM 0 H SER A 136 -4.019 33.887 -17.939 1.00 0.00 H new ATOM 0 HA SER A 136 -6.408 32.245 -18.228 1.00 0.00 H new ATOM 0 HB2 SER A 136 -5.739 34.694 -16.538 1.00 0.00 H new ATOM 0 HB3 SER A 136 -7.269 33.841 -16.471 1.00 0.00 H new ATOM 0 HG SER A 136 -5.784 33.111 -14.846 1.00 0.00 H new ATOM 2147 N SER A 137 -7.751 33.619 -19.768 1.00 0.00 N ATOM 2148 CA SER A 137 -8.549 34.390 -20.714 1.00 0.00 C ATOM 2149 C SER A 137 -9.764 33.592 -21.177 1.00 0.00 C ATOM 2150 O SER A 137 -9.839 32.381 -20.975 1.00 0.00 O ATOM 2151 CB SER A 137 -7.699 34.793 -21.920 1.00 0.00 C ATOM 2152 OG SER A 137 -8.233 35.940 -22.560 1.00 0.00 O ATOM 0 H SER A 137 -8.016 32.637 -19.695 1.00 0.00 H new ATOM 0 HA SER A 137 -8.899 35.290 -20.208 1.00 0.00 H new ATOM 0 HB2 SER A 137 -6.677 34.995 -21.598 1.00 0.00 H new ATOM 0 HB3 SER A 137 -7.652 33.966 -22.629 1.00 0.00 H new ATOM 0 HG SER A 137 -7.671 36.178 -23.327 1.00 0.00 H new ATOM 2158 N GLY A 138 -10.715 34.281 -21.800 1.00 0.00 N ATOM 2159 CA GLY A 138 -11.914 33.622 -22.282 1.00 0.00 C ATOM 2160 C GLY A 138 -13.105 33.845 -21.371 1.00 0.00 C ATOM 2161 O GLY A 138 -14.014 33.017 -21.314 1.00 0.00 O ATOM 0 H GLY A 138 -10.676 35.284 -21.979 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -12.150 33.990 -23.280 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -11.725 32.552 -22.373 1.00 0.00 H new TER 2165 GLY A 138