USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 737 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 100 TYR OH : rot 180:sc= -0.0551 USER MOD Set 1.2: A 115 TYR OH : rot 180:sc= -0.435 USER MOD Set 2.1: A 62 THR OG1 : rot 114:sc= -1.38! USER MOD Set 2.2: A 73 GLN : amide:sc= -2.67 K(o=-4.1,f=-11!) USER MOD Set 3.1: A 49 THR OG1 : rot 180:sc= 0.41 USER MOD Set 3.2: A 61 ASN : amide:sc= -8.93! C(o=-8.5!,f=-18!) USER MOD Set 4.1: A 48 THR OG1 : rot -54:sc= 0.00812 USER MOD Set 4.2: A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.124 X(o=-0.12,f=-0.11) USER MOD Single : A 30 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.0198 USER MOD Single : A 38 THR OG1 : rot -70:sc= 1.13 USER MOD Single : A 39 THR OG1 : rot -65:sc= 1.19 USER MOD Single : A 43 GLN : amide:sc= -2.38! K(o=-2.4!,f=-1.3) USER MOD Single : A 44 TYR OH : rot 180:sc= 0.0758 USER MOD Single : A 46 HIS : no HE2:sc= -7.26! C(o=-7.3!,f=-5.2!) USER MOD Single : A 52 ASN : amide:sc= -0.049 K(o=-0.049,f=-0.56) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= -4.68! USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 30:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -2.22 K(o=-2.2,f=-3.5) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot -30:sc= 0.645 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -9.44! C(o=-9.4!,f=-19!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.394 X(o=-0.39,f=-0.017) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.0199 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.588 K(o=-0.59,f=0.055) USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.29 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 152:sc= 0.348 (180deg=0.0579) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HE2:sc= -0.848 K(o=-0.85,f=-2.5!) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 -8.876 58.546 18.883 1.00 0.00 N ATOM 2 CA GLY A 15 -9.945 57.968 18.088 1.00 0.00 C ATOM 3 C GLY A 15 -9.385 57.045 17.003 1.00 0.00 C ATOM 4 O GLY A 15 -8.625 57.485 16.142 1.00 0.00 O ATOM 0 HA2 GLY A 15 -10.621 57.407 18.734 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -10.531 58.763 17.627 1.00 0.00 H new ATOM 8 N SER A 16 -9.782 55.784 17.081 1.00 0.00 N ATOM 9 CA SER A 16 -9.329 54.796 16.116 1.00 0.00 C ATOM 10 C SER A 16 -10.520 53.992 15.591 1.00 0.00 C ATOM 11 O SER A 16 -11.644 54.165 16.059 1.00 0.00 O ATOM 12 CB SER A 16 -8.289 53.859 16.734 1.00 0.00 C ATOM 13 OG SER A 16 -7.092 54.549 17.086 1.00 0.00 O ATOM 0 H SER A 16 -10.412 55.423 17.797 1.00 0.00 H new ATOM 0 HA SER A 16 -8.858 55.321 15.285 1.00 0.00 H new ATOM 0 HB2 SER A 16 -8.709 53.386 17.621 1.00 0.00 H new ATOM 0 HB3 SER A 16 -8.054 53.062 16.029 1.00 0.00 H new ATOM 0 HG SER A 16 -6.454 53.917 17.479 1.00 0.00 H new ATOM 18 N GLY A 17 -10.233 53.133 14.624 1.00 0.00 N ATOM 19 CA GLY A 17 -11.267 52.303 14.030 1.00 0.00 C ATOM 20 C GLY A 17 -11.056 52.160 12.522 1.00 0.00 C ATOM 21 O GLY A 17 -10.878 53.153 11.819 1.00 0.00 O ATOM 0 H GLY A 17 -9.300 52.994 14.237 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -11.260 51.318 14.497 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -12.246 52.741 14.224 1.00 0.00 H new ATOM 25 N MET A 18 -11.080 50.914 12.068 1.00 0.00 N ATOM 26 CA MET A 18 -10.893 50.628 10.656 1.00 0.00 C ATOM 27 C MET A 18 -10.990 49.126 10.384 1.00 0.00 C ATOM 28 O MET A 18 -11.110 48.329 11.313 1.00 0.00 O ATOM 29 CB MET A 18 -9.522 51.140 10.209 1.00 0.00 C ATOM 30 CG MET A 18 -9.666 52.242 9.157 1.00 0.00 C ATOM 31 SD MET A 18 -9.473 51.554 7.521 1.00 0.00 S ATOM 32 CE MET A 18 -7.753 51.934 7.226 1.00 0.00 C ATOM 0 H MET A 18 -11.226 50.092 12.654 1.00 0.00 H new ATOM 0 HA MET A 18 -11.680 51.132 10.095 1.00 0.00 H new ATOM 0 HB2 MET A 18 -8.974 51.523 11.070 1.00 0.00 H new ATOM 0 HB3 MET A 18 -8.937 50.316 9.800 1.00 0.00 H new ATOM 0 HG2 MET A 18 -10.643 52.717 9.248 1.00 0.00 H new ATOM 0 HG3 MET A 18 -8.918 53.017 9.325 1.00 0.00 H new ATOM 0 HE1 MET A 18 -7.464 51.571 6.240 1.00 0.00 H new ATOM 0 HE2 MET A 18 -7.606 53.013 7.273 1.00 0.00 H new ATOM 0 HE3 MET A 18 -7.138 51.450 7.985 1.00 0.00 H new ATOM 40 N LYS A 19 -10.936 48.784 9.105 1.00 0.00 N ATOM 41 CA LYS A 19 -11.017 47.391 8.699 1.00 0.00 C ATOM 42 C LYS A 19 -12.415 46.853 9.012 1.00 0.00 C ATOM 43 O LYS A 19 -13.221 46.646 8.106 1.00 0.00 O ATOM 44 CB LYS A 19 -9.888 46.580 9.337 1.00 0.00 C ATOM 45 CG LYS A 19 -8.521 47.069 8.856 1.00 0.00 C ATOM 46 CD LYS A 19 -7.428 46.733 9.873 1.00 0.00 C ATOM 47 CE LYS A 19 -7.284 47.848 10.911 1.00 0.00 C ATOM 48 NZ LYS A 19 -5.866 48.016 11.297 1.00 0.00 N ATOM 0 H LYS A 19 -10.837 49.447 8.336 1.00 0.00 H new ATOM 0 HA LYS A 19 -10.874 47.299 7.622 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -9.946 46.661 10.422 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -10.008 45.525 9.089 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -8.284 46.609 7.897 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -8.553 48.146 8.694 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.667 45.794 10.373 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -6.479 46.586 9.357 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.670 48.783 10.505 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -7.881 47.612 11.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -5.786 48.776 12.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -5.509 47.128 11.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -5.304 48.262 10.457 1.00 0.00 H new ATOM 58 N GLU A 20 -12.658 46.643 10.298 1.00 0.00 N ATOM 59 CA GLU A 20 -13.944 46.133 10.742 1.00 0.00 C ATOM 60 C GLU A 20 -14.175 44.724 10.192 1.00 0.00 C ATOM 61 O GLU A 20 -13.382 44.228 9.393 1.00 0.00 O ATOM 62 CB GLU A 20 -15.079 47.074 10.331 1.00 0.00 C ATOM 63 CG GLU A 20 -15.281 48.177 11.373 1.00 0.00 C ATOM 64 CD GLU A 20 -16.720 48.185 11.890 1.00 0.00 C ATOM 65 OE1 GLU A 20 -17.613 47.829 11.091 1.00 0.00 O ATOM 66 OE2 GLU A 20 -16.896 48.548 13.073 1.00 0.00 O ATOM 0 H GLU A 20 -11.986 46.817 11.046 1.00 0.00 H new ATOM 0 HA GLU A 20 -13.935 46.081 11.831 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.853 47.520 9.363 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.002 46.507 10.213 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -14.593 48.027 12.205 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -15.043 49.146 10.933 1.00 0.00 H new ATOM 71 N THR A 21 -15.265 44.120 10.641 1.00 0.00 N ATOM 72 CA THR A 21 -15.610 42.777 10.204 1.00 0.00 C ATOM 73 C THR A 21 -17.065 42.458 10.558 1.00 0.00 C ATOM 74 O THR A 21 -17.612 43.015 11.509 1.00 0.00 O ATOM 75 CB THR A 21 -14.607 41.805 10.827 1.00 0.00 C ATOM 76 OG1 THR A 21 -14.909 40.554 10.214 1.00 0.00 O ATOM 77 CG2 THR A 21 -14.870 41.563 12.314 1.00 0.00 C ATOM 0 H THR A 21 -15.921 44.535 11.303 1.00 0.00 H new ATOM 0 HA THR A 21 -15.544 42.685 9.120 1.00 0.00 H new ATOM 0 HB THR A 21 -13.597 42.194 10.696 1.00 0.00 H new ATOM 0 HG1 THR A 21 -14.303 39.866 10.560 1.00 0.00 H new ATOM 0 HG21 THR A 21 -14.129 40.866 12.706 1.00 0.00 H new ATOM 0 HG22 THR A 21 -14.801 42.507 12.854 1.00 0.00 H new ATOM 0 HG23 THR A 21 -15.868 41.143 12.443 1.00 0.00 H new ATOM 85 N ALA A 22 -17.648 41.565 9.774 1.00 0.00 N ATOM 86 CA ALA A 22 -19.029 41.166 9.992 1.00 0.00 C ATOM 87 C ALA A 22 -19.121 39.639 9.982 1.00 0.00 C ATOM 88 O ALA A 22 -19.632 39.038 10.926 1.00 0.00 O ATOM 89 CB ALA A 22 -19.921 41.812 8.930 1.00 0.00 C ATOM 0 H ALA A 22 -17.190 41.106 8.987 1.00 0.00 H new ATOM 0 HA ALA A 22 -19.380 41.511 10.965 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -20.956 41.513 9.093 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -19.842 42.897 8.999 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -19.601 41.487 7.940 1.00 0.00 H new ATOM 95 N ALA A 23 -18.619 39.055 8.904 1.00 0.00 N ATOM 96 CA ALA A 23 -18.639 37.609 8.758 1.00 0.00 C ATOM 97 C ALA A 23 -20.090 37.124 8.727 1.00 0.00 C ATOM 98 O ALA A 23 -20.913 37.568 9.525 1.00 0.00 O ATOM 99 CB ALA A 23 -17.834 36.971 9.891 1.00 0.00 C ATOM 0 H ALA A 23 -18.196 39.557 8.123 1.00 0.00 H new ATOM 0 HA ALA A 23 -18.172 37.311 7.819 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -17.849 35.887 9.782 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -16.804 37.326 9.850 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -18.275 37.245 10.850 1.00 0.00 H new ATOM 105 N ALA A 24 -20.357 36.218 7.797 1.00 0.00 N ATOM 106 CA ALA A 24 -21.694 35.669 7.652 1.00 0.00 C ATOM 107 C ALA A 24 -21.601 34.264 7.052 1.00 0.00 C ATOM 108 O ALA A 24 -20.506 33.775 6.776 1.00 0.00 O ATOM 109 CB ALA A 24 -22.546 36.612 6.800 1.00 0.00 C ATOM 0 H ALA A 24 -19.671 35.851 7.138 1.00 0.00 H new ATOM 0 HA ALA A 24 -22.180 35.582 8.624 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -23.549 36.199 6.692 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -22.605 37.587 7.285 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -22.092 36.723 5.816 1.00 0.00 H new ATOM 115 N LYS A 25 -22.763 33.656 6.866 1.00 0.00 N ATOM 116 CA LYS A 25 -22.825 32.318 6.303 1.00 0.00 C ATOM 117 C LYS A 25 -21.809 32.199 5.167 1.00 0.00 C ATOM 118 O LYS A 25 -22.044 32.694 4.065 1.00 0.00 O ATOM 119 CB LYS A 25 -24.258 31.978 5.885 1.00 0.00 C ATOM 120 CG LYS A 25 -24.588 30.517 6.196 1.00 0.00 C ATOM 121 CD LYS A 25 -24.830 30.317 7.693 1.00 0.00 C ATOM 122 CE LYS A 25 -25.042 28.837 8.021 1.00 0.00 C ATOM 123 NZ LYS A 25 -23.744 28.128 8.078 1.00 0.00 N ATOM 0 H LYS A 25 -23.669 34.065 7.095 1.00 0.00 H new ATOM 0 HA LYS A 25 -22.552 31.576 7.054 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -24.957 32.631 6.406 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -24.383 32.164 4.818 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -25.473 30.213 5.637 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -23.769 29.877 5.868 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -23.979 30.700 8.257 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -25.703 30.891 8.004 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -25.558 28.740 8.976 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -25.681 28.379 7.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -23.906 27.125 8.302 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -23.266 28.205 7.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -23.147 28.555 8.815 1.00 0.00 H new ATOM 133 N PHE A 26 -20.701 31.540 5.472 1.00 0.00 N ATOM 134 CA PHE A 26 -19.648 31.351 4.490 1.00 0.00 C ATOM 135 C PHE A 26 -19.668 29.926 3.931 1.00 0.00 C ATOM 136 O PHE A 26 -20.442 29.087 4.390 1.00 0.00 O ATOM 137 CB PHE A 26 -18.317 31.584 5.209 1.00 0.00 C ATOM 138 CG PHE A 26 -17.920 33.057 5.318 1.00 0.00 C ATOM 139 CD1 PHE A 26 -17.661 33.777 4.194 1.00 0.00 C ATOM 140 CD2 PHE A 26 -17.824 33.647 6.540 1.00 0.00 C ATOM 141 CE1 PHE A 26 -17.291 35.144 4.296 1.00 0.00 C ATOM 142 CE2 PHE A 26 -17.454 35.014 6.642 1.00 0.00 C ATOM 143 CZ PHE A 26 -17.196 35.734 5.517 1.00 0.00 C ATOM 0 H PHE A 26 -20.510 31.130 6.386 1.00 0.00 H new ATOM 0 HA PHE A 26 -19.788 32.042 3.658 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -18.378 31.159 6.211 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -17.531 31.044 4.681 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -17.737 33.309 3.224 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -18.029 33.075 7.433 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -17.085 35.715 3.403 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -17.377 35.482 7.612 1.00 0.00 H new ATOM 0 HZ PHE A 26 -16.916 36.774 5.594 1.00 0.00 H new ATOM 152 N GLU A 27 -18.809 29.698 2.949 1.00 0.00 N ATOM 153 CA GLU A 27 -18.719 28.389 2.323 1.00 0.00 C ATOM 154 C GLU A 27 -20.117 27.870 1.974 1.00 0.00 C ATOM 155 O GLU A 27 -21.106 28.582 2.140 1.00 0.00 O ATOM 156 CB GLU A 27 -17.977 27.400 3.223 1.00 0.00 C ATOM 157 CG GLU A 27 -18.790 27.085 4.481 1.00 0.00 C ATOM 158 CD GLU A 27 -18.283 25.811 5.157 1.00 0.00 C ATOM 159 OE1 GLU A 27 -18.439 24.737 4.534 1.00 0.00 O ATOM 160 OE2 GLU A 27 -17.750 25.937 6.280 1.00 0.00 O ATOM 0 H GLU A 27 -18.169 30.397 2.571 1.00 0.00 H new ATOM 0 HA GLU A 27 -18.148 28.488 1.400 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -17.780 26.480 2.673 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -17.010 27.815 3.506 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -18.726 27.921 5.178 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -19.841 26.968 4.219 1.00 0.00 H new ATOM 165 N ARG A 28 -20.153 26.635 1.498 1.00 0.00 N ATOM 166 CA ARG A 28 -21.411 26.013 1.124 1.00 0.00 C ATOM 167 C ARG A 28 -22.172 26.904 0.139 1.00 0.00 C ATOM 168 O ARG A 28 -23.384 26.769 -0.015 1.00 0.00 O ATOM 169 CB ARG A 28 -22.286 25.760 2.354 1.00 0.00 C ATOM 170 CG ARG A 28 -22.787 24.315 2.382 1.00 0.00 C ATOM 171 CD ARG A 28 -24.117 24.210 3.130 1.00 0.00 C ATOM 172 NE ARG A 28 -23.922 24.538 4.559 1.00 0.00 N ATOM 173 CZ ARG A 28 -23.387 23.698 5.456 1.00 0.00 C ATOM 174 NH1 ARG A 28 -22.990 22.476 5.076 1.00 0.00 N ATOM 175 NH2 ARG A 28 -23.248 24.080 6.733 1.00 0.00 N ATOM 0 H ARG A 28 -19.330 26.048 1.363 1.00 0.00 H new ATOM 0 HA ARG A 28 -21.182 25.058 0.652 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -21.716 25.969 3.259 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -23.135 26.443 2.347 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -22.909 23.949 1.363 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -22.044 23.678 2.862 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -24.846 24.890 2.689 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -24.520 23.202 3.032 1.00 0.00 H new ATOM 0 HE ARG A 28 -24.213 25.461 4.882 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -23.095 22.185 4.104 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -22.583 21.837 5.759 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -23.549 25.010 7.023 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -22.841 23.440 7.415 1.00 0.00 H new ATOM 186 N GLN A 29 -21.427 27.792 -0.502 1.00 0.00 N ATOM 187 CA GLN A 29 -22.016 28.704 -1.468 1.00 0.00 C ATOM 188 C GLN A 29 -21.367 28.515 -2.840 1.00 0.00 C ATOM 189 O GLN A 29 -21.979 27.954 -3.748 1.00 0.00 O ATOM 190 CB GLN A 29 -21.892 30.154 -0.998 1.00 0.00 C ATOM 191 CG GLN A 29 -23.153 30.951 -1.341 1.00 0.00 C ATOM 192 CD GLN A 29 -23.232 31.233 -2.843 1.00 0.00 C ATOM 193 OE1 GLN A 29 -24.072 30.709 -3.556 1.00 0.00 O ATOM 194 NE2 GLN A 29 -22.312 32.088 -3.282 1.00 0.00 N ATOM 0 H GLN A 29 -20.421 27.900 -0.372 1.00 0.00 H new ATOM 0 HA GLN A 29 -23.078 28.474 -1.555 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -21.724 30.178 0.079 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -21.025 30.619 -1.467 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -24.036 30.395 -1.025 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -23.154 31.892 -0.790 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -21.638 32.490 -2.631 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -22.281 32.341 -4.270 1.00 0.00 H new ATOM 201 N HIS A 30 -20.137 28.996 -2.949 1.00 0.00 N ATOM 202 CA HIS A 30 -19.398 28.886 -4.195 1.00 0.00 C ATOM 203 C HIS A 30 -18.058 29.613 -4.063 1.00 0.00 C ATOM 204 O HIS A 30 -18.011 30.841 -4.061 1.00 0.00 O ATOM 205 CB HIS A 30 -20.235 29.398 -5.370 1.00 0.00 C ATOM 206 CG HIS A 30 -20.311 28.439 -6.533 1.00 0.00 C ATOM 207 ND1 HIS A 30 -21.486 27.815 -6.915 1.00 0.00 N ATOM 208 CD2 HIS A 30 -19.348 28.006 -7.396 1.00 0.00 C ATOM 209 CE1 HIS A 30 -21.228 27.042 -7.960 1.00 0.00 C ATOM 210 NE2 HIS A 30 -19.903 27.161 -8.256 1.00 0.00 N ATOM 0 H HIS A 30 -19.634 29.463 -2.195 1.00 0.00 H new ATOM 0 HA HIS A 30 -19.185 27.838 -4.404 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -21.245 29.608 -5.019 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -19.816 30.342 -5.718 1.00 0.00 H new ATOM 0 HD2 HIS A 30 -18.309 28.301 -7.382 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -21.943 26.426 -8.485 1.00 0.00 H new ATOM 0 HE2 HIS A 30 -19.418 26.680 -9.013 1.00 0.00 H new ATOM 217 N MET A 31 -17.001 28.820 -3.956 1.00 0.00 N ATOM 218 CA MET A 31 -15.663 29.371 -3.823 1.00 0.00 C ATOM 219 C MET A 31 -14.630 28.475 -4.508 1.00 0.00 C ATOM 220 O MET A 31 -13.461 28.463 -4.125 1.00 0.00 O ATOM 221 CB MET A 31 -15.314 29.513 -2.340 1.00 0.00 C ATOM 222 CG MET A 31 -15.116 28.142 -1.691 1.00 0.00 C ATOM 223 SD MET A 31 -15.329 28.266 0.077 1.00 0.00 S ATOM 224 CE MET A 31 -15.001 26.577 0.549 1.00 0.00 C ATOM 0 H MET A 31 -17.044 27.801 -3.959 1.00 0.00 H new ATOM 0 HA MET A 31 -15.644 30.349 -4.305 1.00 0.00 H new ATOM 0 HB2 MET A 31 -14.406 30.106 -2.231 1.00 0.00 H new ATOM 0 HB3 MET A 31 -16.110 30.052 -1.825 1.00 0.00 H new ATOM 0 HG2 MET A 31 -15.831 27.429 -2.102 1.00 0.00 H new ATOM 0 HG3 MET A 31 -14.120 27.763 -1.920 1.00 0.00 H new ATOM 0 HE1 MET A 31 -15.092 26.477 1.631 1.00 0.00 H new ATOM 0 HE2 MET A 31 -15.719 25.917 0.062 1.00 0.00 H new ATOM 0 HE3 MET A 31 -13.991 26.303 0.243 1.00 0.00 H new ATOM 232 N ASP A 32 -15.098 27.745 -5.509 1.00 0.00 N ATOM 233 CA ASP A 32 -14.230 26.847 -6.252 1.00 0.00 C ATOM 234 C ASP A 32 -13.529 25.899 -5.276 1.00 0.00 C ATOM 235 O ASP A 32 -13.627 26.070 -4.062 1.00 0.00 O ATOM 236 CB ASP A 32 -13.153 27.624 -7.010 1.00 0.00 C ATOM 237 CG ASP A 32 -12.316 26.790 -7.982 1.00 0.00 C ATOM 238 OD1 ASP A 32 -12.928 25.964 -8.694 1.00 0.00 O ATOM 239 OD2 ASP A 32 -11.084 26.996 -7.992 1.00 0.00 O ATOM 0 H ASP A 32 -16.068 27.757 -5.824 1.00 0.00 H new ATOM 0 HA ASP A 32 -14.845 26.295 -6.963 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -13.632 28.430 -7.566 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -12.485 28.089 -6.286 1.00 0.00 H new ATOM 243 N SER A 33 -12.839 24.921 -5.843 1.00 0.00 N ATOM 244 CA SER A 33 -12.122 23.947 -5.038 1.00 0.00 C ATOM 245 C SER A 33 -11.423 24.645 -3.871 1.00 0.00 C ATOM 246 O SER A 33 -11.065 25.817 -3.968 1.00 0.00 O ATOM 247 CB SER A 33 -11.106 23.176 -5.882 1.00 0.00 C ATOM 248 OG SER A 33 -11.634 22.811 -7.154 1.00 0.00 O ATOM 0 H SER A 33 -12.761 24.782 -6.850 1.00 0.00 H new ATOM 0 HA SER A 33 -12.844 23.231 -4.644 1.00 0.00 H new ATOM 0 HB2 SER A 33 -10.214 23.786 -6.022 1.00 0.00 H new ATOM 0 HB3 SER A 33 -10.797 22.278 -5.347 1.00 0.00 H new ATOM 0 HG SER A 33 -10.954 22.322 -7.663 1.00 0.00 H new ATOM 253 N PRO A 34 -11.245 23.875 -2.763 1.00 0.00 N ATOM 254 CA PRO A 34 -10.595 24.408 -1.578 1.00 0.00 C ATOM 255 C PRO A 34 -9.083 24.520 -1.785 1.00 0.00 C ATOM 256 O PRO A 34 -8.605 24.499 -2.919 1.00 0.00 O ATOM 257 CB PRO A 34 -10.971 23.450 -0.460 1.00 0.00 C ATOM 258 CG PRO A 34 -11.429 22.171 -1.141 1.00 0.00 C ATOM 259 CD PRO A 34 -11.657 22.483 -2.612 1.00 0.00 C ATOM 0 HA PRO A 34 -10.917 25.422 -1.342 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -10.120 23.261 0.194 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -11.764 23.867 0.161 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -10.679 21.389 -1.028 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -12.346 21.801 -0.682 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -11.070 21.824 -3.252 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -12.703 22.347 -2.888 1.00 0.00 H new ATOM 264 N ASP A 35 -8.372 24.636 -0.674 1.00 0.00 N ATOM 265 CA ASP A 35 -6.925 24.751 -0.720 1.00 0.00 C ATOM 266 C ASP A 35 -6.327 23.426 -1.199 1.00 0.00 C ATOM 267 O ASP A 35 -6.940 22.372 -1.045 1.00 0.00 O ATOM 268 CB ASP A 35 -6.352 25.053 0.667 1.00 0.00 C ATOM 269 CG ASP A 35 -4.834 25.237 0.714 1.00 0.00 C ATOM 270 OD1 ASP A 35 -4.395 26.388 0.501 1.00 0.00 O ATOM 271 OD2 ASP A 35 -4.146 24.223 0.960 1.00 0.00 O ATOM 0 H ASP A 35 -8.771 24.653 0.264 1.00 0.00 H new ATOM 0 HA ASP A 35 -6.673 25.565 -1.400 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -6.824 25.958 1.049 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -6.625 24.241 1.341 1.00 0.00 H new ATOM 275 N LEU A 36 -5.136 23.525 -1.772 1.00 0.00 N ATOM 276 CA LEU A 36 -4.448 22.348 -2.275 1.00 0.00 C ATOM 277 C LEU A 36 -4.095 21.429 -1.105 1.00 0.00 C ATOM 278 O LEU A 36 -4.781 20.438 -0.860 1.00 0.00 O ATOM 279 CB LEU A 36 -3.242 22.755 -3.125 1.00 0.00 C ATOM 280 CG LEU A 36 -2.567 21.630 -3.913 1.00 0.00 C ATOM 281 CD1 LEU A 36 -2.908 21.723 -5.401 1.00 0.00 C ATOM 282 CD2 LEU A 36 -1.057 21.622 -3.671 1.00 0.00 C ATOM 0 H LEU A 36 -4.630 24.402 -1.899 1.00 0.00 H new ATOM 0 HA LEU A 36 -5.100 21.781 -2.939 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.561 23.524 -3.829 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.499 23.210 -2.471 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.956 20.678 -3.552 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.416 20.912 -5.938 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.987 21.643 -5.533 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -2.564 22.680 -5.794 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.601 20.813 -4.242 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.633 22.574 -3.988 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.859 21.473 -2.610 1.00 0.00 H new ATOM 293 N GLY A 37 -3.026 21.791 -0.412 1.00 0.00 N ATOM 294 CA GLY A 37 -2.573 21.011 0.727 1.00 0.00 C ATOM 295 C GLY A 37 -1.424 20.079 0.332 1.00 0.00 C ATOM 296 O GLY A 37 -1.182 19.854 -0.852 1.00 0.00 O ATOM 0 H GLY A 37 -2.460 22.614 -0.617 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -2.246 21.680 1.523 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -3.402 20.424 1.123 1.00 0.00 H new ATOM 300 N THR A 38 -0.748 19.562 1.348 1.00 0.00 N ATOM 301 CA THR A 38 0.368 18.661 1.122 1.00 0.00 C ATOM 302 C THR A 38 0.837 18.051 2.445 1.00 0.00 C ATOM 303 O THR A 38 2.036 17.900 2.673 1.00 0.00 O ATOM 304 CB THR A 38 1.464 19.439 0.390 1.00 0.00 C ATOM 305 OG1 THR A 38 2.587 18.562 0.415 1.00 0.00 O ATOM 306 CG2 THR A 38 1.932 20.668 1.172 1.00 0.00 C ATOM 0 H THR A 38 -0.952 19.750 2.329 1.00 0.00 H new ATOM 0 HA THR A 38 0.075 17.818 0.496 1.00 0.00 H new ATOM 0 HB THR A 38 1.097 19.750 -0.588 1.00 0.00 H new ATOM 0 HG1 THR A 38 2.933 18.499 1.330 1.00 0.00 H new ATOM 0 HG21 THR A 38 2.710 21.184 0.608 1.00 0.00 H new ATOM 0 HG22 THR A 38 1.090 21.342 1.329 1.00 0.00 H new ATOM 0 HG23 THR A 38 2.331 20.355 2.137 1.00 0.00 H new ATOM 314 N THR A 39 -0.134 17.717 3.282 1.00 0.00 N ATOM 315 CA THR A 39 0.165 17.127 4.577 1.00 0.00 C ATOM 316 C THR A 39 -0.651 15.849 4.781 1.00 0.00 C ATOM 317 O THR A 39 -1.037 15.528 5.904 1.00 0.00 O ATOM 318 CB THR A 39 -0.089 18.188 5.649 1.00 0.00 C ATOM 319 OG1 THR A 39 0.073 17.484 6.879 1.00 0.00 O ATOM 320 CG2 THR A 39 -1.545 18.657 5.677 1.00 0.00 C ATOM 0 H THR A 39 -1.128 17.843 3.090 1.00 0.00 H new ATOM 0 HA THR A 39 1.209 16.822 4.642 1.00 0.00 H new ATOM 0 HB THR A 39 0.564 19.043 5.474 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.624 16.800 6.959 1.00 0.00 H new ATOM 0 HG21 THR A 39 -1.670 19.409 6.456 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.807 19.088 4.711 1.00 0.00 H new ATOM 0 HG23 THR A 39 -2.197 17.808 5.885 1.00 0.00 H new ATOM 328 N LEU A 40 -0.891 15.155 3.678 1.00 0.00 N ATOM 329 CA LEU A 40 -1.654 13.919 3.722 1.00 0.00 C ATOM 330 C LEU A 40 -1.176 12.990 2.604 1.00 0.00 C ATOM 331 O LEU A 40 -0.523 13.433 1.661 1.00 0.00 O ATOM 332 CB LEU A 40 -3.154 14.215 3.678 1.00 0.00 C ATOM 333 CG LEU A 40 -3.576 15.419 2.834 1.00 0.00 C ATOM 334 CD1 LEU A 40 -4.810 15.094 1.991 1.00 0.00 C ATOM 335 CD2 LEU A 40 -3.791 16.654 3.711 1.00 0.00 C ATOM 0 H LEU A 40 -0.570 15.425 2.748 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.483 13.398 4.664 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.667 13.332 3.297 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.503 14.372 4.699 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.766 15.651 2.142 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.088 15.967 1.401 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.586 14.262 1.324 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.637 14.821 2.647 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.090 17.496 3.087 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.572 16.449 4.443 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.864 16.898 4.229 1.00 0.00 H new ATOM 346 N LEU A 41 -1.521 11.719 2.747 1.00 0.00 N ATOM 347 CA LEU A 41 -1.137 10.723 1.762 1.00 0.00 C ATOM 348 C LEU A 41 -2.298 10.496 0.792 1.00 0.00 C ATOM 349 O LEU A 41 -2.271 9.560 -0.005 1.00 0.00 O ATOM 350 CB LEU A 41 -0.651 9.446 2.452 1.00 0.00 C ATOM 351 CG LEU A 41 0.189 9.644 3.714 1.00 0.00 C ATOM 352 CD1 LEU A 41 -0.154 8.593 4.771 1.00 0.00 C ATOM 353 CD2 LEU A 41 1.683 9.656 3.383 1.00 0.00 C ATOM 0 H LEU A 41 -2.063 11.356 3.531 1.00 0.00 H new ATOM 0 HA LEU A 41 -0.293 11.078 1.170 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -1.521 8.842 2.710 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -0.065 8.870 1.736 1.00 0.00 H new ATOM 0 HG LEU A 41 -0.055 10.619 4.137 1.00 0.00 H new ATOM 0 HD11 LEU A 41 0.457 8.756 5.658 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -1.208 8.675 5.037 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.044 7.598 4.372 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.257 9.798 4.298 1.00 0.00 H new ATOM 0 HD22 LEU A 41 1.962 8.708 2.924 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.896 10.471 2.691 1.00 0.00 H new ATOM 364 N GLU A 42 -3.290 11.368 0.893 1.00 0.00 N ATOM 365 CA GLU A 42 -4.458 11.274 0.035 1.00 0.00 C ATOM 366 C GLU A 42 -4.613 12.551 -0.794 1.00 0.00 C ATOM 367 O GLU A 42 -5.673 12.801 -1.365 1.00 0.00 O ATOM 368 CB GLU A 42 -5.720 10.997 0.855 1.00 0.00 C ATOM 369 CG GLU A 42 -6.953 10.907 -0.048 1.00 0.00 C ATOM 370 CD GLU A 42 -7.822 12.159 0.086 1.00 0.00 C ATOM 371 OE1 GLU A 42 -7.270 13.189 0.528 1.00 0.00 O ATOM 372 OE2 GLU A 42 -9.020 12.057 -0.258 1.00 0.00 O ATOM 0 H GLU A 42 -3.309 12.143 1.556 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.316 10.436 -0.647 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -5.601 10.065 1.408 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -5.861 11.789 1.591 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -6.641 10.786 -1.085 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -7.537 10.025 0.214 1.00 0.00 H new ATOM 377 N GLN A 43 -3.539 13.325 -0.834 1.00 0.00 N ATOM 378 CA GLN A 43 -3.542 14.570 -1.584 1.00 0.00 C ATOM 379 C GLN A 43 -3.593 14.286 -3.086 1.00 0.00 C ATOM 380 O GLN A 43 -4.484 14.771 -3.783 1.00 0.00 O ATOM 381 CB GLN A 43 -2.324 15.426 -1.229 1.00 0.00 C ATOM 382 CG GLN A 43 -2.456 16.835 -1.809 1.00 0.00 C ATOM 383 CD GLN A 43 -3.598 17.600 -1.137 1.00 0.00 C ATOM 384 OE1 GLN A 43 -4.651 17.827 -1.709 1.00 0.00 O ATOM 385 NE2 GLN A 43 -3.329 17.985 0.108 1.00 0.00 N ATOM 0 H GLN A 43 -2.661 13.115 -0.360 1.00 0.00 H new ATOM 0 HA GLN A 43 -4.434 15.134 -1.311 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -2.219 15.483 -0.146 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -1.419 14.954 -1.613 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -1.520 17.377 -1.673 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.636 16.775 -2.882 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -2.426 17.762 0.527 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -4.026 18.503 0.643 1.00 0.00 H new ATOM 392 N TYR A 44 -2.629 13.500 -3.541 1.00 0.00 N ATOM 393 CA TYR A 44 -2.553 13.145 -4.947 1.00 0.00 C ATOM 394 C TYR A 44 -3.490 11.979 -5.270 1.00 0.00 C ATOM 395 O TYR A 44 -3.087 11.014 -5.917 1.00 0.00 O ATOM 396 CB TYR A 44 -1.108 12.705 -5.194 1.00 0.00 C ATOM 397 CG TYR A 44 -0.580 11.700 -4.169 1.00 0.00 C ATOM 398 CD1 TYR A 44 -0.788 10.348 -4.357 1.00 0.00 C ATOM 399 CD2 TYR A 44 0.105 12.144 -3.057 1.00 0.00 C ATOM 400 CE1 TYR A 44 -0.291 9.401 -3.392 1.00 0.00 C ATOM 401 CE2 TYR A 44 0.602 11.198 -2.092 1.00 0.00 C ATOM 402 CZ TYR A 44 0.380 9.874 -2.308 1.00 0.00 C ATOM 403 OH TYR A 44 0.850 8.979 -1.397 1.00 0.00 O ATOM 0 H TYR A 44 -1.893 13.099 -2.960 1.00 0.00 H new ATOM 0 HA TYR A 44 -2.846 13.989 -5.572 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -1.038 12.265 -6.189 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -0.465 13.585 -5.189 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -1.324 10.000 -5.228 1.00 0.00 H new ATOM 0 HD2 TYR A 44 0.269 13.201 -2.910 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -0.448 8.341 -3.526 1.00 0.00 H new ATOM 0 HE2 TYR A 44 1.139 11.532 -1.217 1.00 0.00 H new ATOM 0 HH TYR A 44 1.310 9.457 -0.676 1.00 0.00 H new ATOM 412 N CYS A 45 -4.724 12.107 -4.802 1.00 0.00 N ATOM 413 CA CYS A 45 -5.722 11.077 -5.033 1.00 0.00 C ATOM 414 C CYS A 45 -7.057 11.760 -5.335 1.00 0.00 C ATOM 415 O CYS A 45 -7.541 11.714 -6.464 1.00 0.00 O ATOM 416 CB CYS A 45 -5.827 10.117 -3.846 1.00 0.00 C ATOM 417 SG CYS A 45 -4.224 9.534 -3.184 1.00 0.00 S ATOM 0 H CYS A 45 -5.054 12.908 -4.264 1.00 0.00 H new ATOM 0 HA CYS A 45 -5.428 10.466 -5.886 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -6.376 10.611 -3.045 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -6.415 9.251 -4.149 1.00 0.00 H new ATOM 421 N HIS A 46 -7.616 12.378 -4.304 1.00 0.00 N ATOM 422 CA HIS A 46 -8.885 13.069 -4.445 1.00 0.00 C ATOM 423 C HIS A 46 -9.826 12.243 -5.324 1.00 0.00 C ATOM 424 O HIS A 46 -10.701 12.791 -5.991 1.00 0.00 O ATOM 425 CB HIS A 46 -8.674 14.489 -4.975 1.00 0.00 C ATOM 426 CG HIS A 46 -8.169 14.545 -6.396 1.00 0.00 C ATOM 427 ND1 HIS A 46 -7.232 15.471 -6.823 1.00 0.00 N ATOM 428 CD2 HIS A 46 -8.477 13.781 -7.483 1.00 0.00 C ATOM 429 CE1 HIS A 46 -6.997 15.265 -8.110 1.00 0.00 C ATOM 430 NE2 HIS A 46 -7.770 14.218 -8.518 1.00 0.00 N ATOM 0 H HIS A 46 -7.212 12.414 -3.368 1.00 0.00 H new ATOM 0 HA HIS A 46 -9.356 13.173 -3.468 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -9.617 15.033 -4.914 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -7.965 15.006 -4.328 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -6.797 16.190 -6.245 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -9.178 12.959 -7.499 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -6.313 15.828 -8.728 1.00 0.00 H new ATOM 437 N ARG A 47 -9.612 10.935 -5.296 1.00 0.00 N ATOM 438 CA ARG A 47 -10.430 10.027 -6.082 1.00 0.00 C ATOM 439 C ARG A 47 -11.234 9.106 -5.162 1.00 0.00 C ATOM 440 O ARG A 47 -12.376 9.409 -4.818 1.00 0.00 O ATOM 441 CB ARG A 47 -9.567 9.176 -7.015 1.00 0.00 C ATOM 442 CG ARG A 47 -9.833 9.527 -8.480 1.00 0.00 C ATOM 443 CD ARG A 47 -8.756 10.466 -9.024 1.00 0.00 C ATOM 444 NE ARG A 47 -9.167 11.002 -10.341 1.00 0.00 N ATOM 445 CZ ARG A 47 -8.406 11.806 -11.097 1.00 0.00 C ATOM 446 NH1 ARG A 47 -7.191 12.173 -10.670 1.00 0.00 N ATOM 447 NH2 ARG A 47 -8.862 12.242 -12.278 1.00 0.00 N ATOM 0 H ARG A 47 -8.885 10.483 -4.742 1.00 0.00 H new ATOM 0 HA ARG A 47 -11.110 10.630 -6.684 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -8.513 9.333 -6.785 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.776 8.120 -6.847 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.860 8.615 -9.077 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -10.812 9.998 -8.573 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -8.590 11.286 -8.325 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.811 9.932 -9.119 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.088 10.743 -10.696 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -6.845 11.841 -9.770 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.612 12.785 -11.245 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -9.788 11.962 -12.602 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.283 12.854 -12.854 1.00 0.00 H new ATOM 458 N THR A 48 -10.607 7.999 -4.789 1.00 0.00 N ATOM 459 CA THR A 48 -11.250 7.033 -3.916 1.00 0.00 C ATOM 460 C THR A 48 -12.727 6.881 -4.284 1.00 0.00 C ATOM 461 O THR A 48 -13.567 6.654 -3.414 1.00 0.00 O ATOM 462 CB THR A 48 -11.027 7.480 -2.470 1.00 0.00 C ATOM 463 OG1 THR A 48 -11.109 6.274 -1.717 1.00 0.00 O ATOM 464 CG2 THR A 48 -12.180 8.332 -1.936 1.00 0.00 C ATOM 0 H THR A 48 -9.660 7.750 -5.076 1.00 0.00 H new ATOM 0 HA THR A 48 -10.814 6.041 -4.036 1.00 0.00 H new ATOM 0 HB THR A 48 -10.097 8.045 -2.405 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.956 5.823 -1.913 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.971 8.622 -0.906 1.00 0.00 H new ATOM 0 HG22 THR A 48 -12.287 9.226 -2.551 1.00 0.00 H new ATOM 0 HG23 THR A 48 -13.104 7.756 -1.970 1.00 0.00 H new ATOM 472 N THR A 49 -12.999 7.012 -5.574 1.00 0.00 N ATOM 473 CA THR A 49 -14.360 6.892 -6.068 1.00 0.00 C ATOM 474 C THR A 49 -14.596 5.497 -6.650 1.00 0.00 C ATOM 475 O THR A 49 -13.708 4.647 -6.612 1.00 0.00 O ATOM 476 CB THR A 49 -14.599 8.019 -7.075 1.00 0.00 C ATOM 477 OG1 THR A 49 -13.392 8.070 -7.831 1.00 0.00 O ATOM 478 CG2 THR A 49 -14.678 9.394 -6.408 1.00 0.00 C ATOM 0 H THR A 49 -12.300 7.200 -6.292 1.00 0.00 H new ATOM 0 HA THR A 49 -15.084 6.999 -5.260 1.00 0.00 H new ATOM 0 HB THR A 49 -15.522 7.827 -7.622 1.00 0.00 H new ATOM 0 HG1 THR A 49 -13.461 8.774 -8.510 1.00 0.00 H new ATOM 0 HG21 THR A 49 -14.849 10.157 -7.167 1.00 0.00 H new ATOM 0 HG22 THR A 49 -15.500 9.404 -5.692 1.00 0.00 H new ATOM 0 HG23 THR A 49 -13.742 9.601 -5.889 1.00 0.00 H new ATOM 486 N ILE A 50 -15.797 5.305 -7.175 1.00 0.00 N ATOM 487 CA ILE A 50 -16.160 4.028 -7.764 1.00 0.00 C ATOM 488 C ILE A 50 -15.573 2.896 -6.920 1.00 0.00 C ATOM 489 O ILE A 50 -14.449 2.455 -7.161 1.00 0.00 O ATOM 490 CB ILE A 50 -15.743 3.979 -9.236 1.00 0.00 C ATOM 491 CG1 ILE A 50 -15.808 2.548 -9.776 1.00 0.00 C ATOM 492 CG2 ILE A 50 -14.362 4.604 -9.435 1.00 0.00 C ATOM 493 CD1 ILE A 50 -15.063 2.431 -11.107 1.00 0.00 C ATOM 0 H ILE A 50 -16.531 6.013 -7.205 1.00 0.00 H new ATOM 0 HA ILE A 50 -17.242 3.900 -7.759 1.00 0.00 H new ATOM 0 HB ILE A 50 -16.452 4.574 -9.812 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -15.373 1.861 -9.050 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -16.849 2.253 -9.910 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -14.090 4.556 -10.489 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -14.384 5.645 -9.113 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -13.627 4.057 -8.845 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -15.124 1.405 -11.469 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -15.516 3.101 -11.838 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -14.017 2.703 -10.964 1.00 0.00 H new ATOM 504 N GLY A 51 -16.357 2.457 -5.947 1.00 0.00 N ATOM 505 CA GLY A 51 -15.929 1.385 -5.065 1.00 0.00 C ATOM 506 C GLY A 51 -16.879 1.240 -3.876 1.00 0.00 C ATOM 507 O GLY A 51 -17.623 0.264 -3.786 1.00 0.00 O ATOM 0 H GLY A 51 -17.288 2.825 -5.750 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.889 0.447 -5.619 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -14.920 1.586 -4.706 1.00 0.00 H new ATOM 511 N ASN A 52 -16.824 2.225 -2.992 1.00 0.00 N ATOM 512 CA ASN A 52 -17.671 2.219 -1.811 1.00 0.00 C ATOM 513 C ASN A 52 -18.695 3.352 -1.918 1.00 0.00 C ATOM 514 O ASN A 52 -19.672 3.383 -1.171 1.00 0.00 O ATOM 515 CB ASN A 52 -16.848 2.445 -0.541 1.00 0.00 C ATOM 516 CG ASN A 52 -16.217 1.138 -0.058 1.00 0.00 C ATOM 517 OD1 ASN A 52 -16.841 0.090 -0.029 1.00 0.00 O ATOM 518 ND2 ASN A 52 -14.946 1.257 0.318 1.00 0.00 N ATOM 0 H ASN A 52 -16.206 3.033 -3.070 1.00 0.00 H new ATOM 0 HA ASN A 52 -18.163 1.248 -1.754 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -16.067 3.180 -0.735 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -17.486 2.856 0.242 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -14.435 0.441 0.655 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -14.482 2.164 0.269 1.00 0.00 H new ATOM 524 N PHE A 53 -18.435 4.254 -2.852 1.00 0.00 N ATOM 525 CA PHE A 53 -19.322 5.386 -3.066 1.00 0.00 C ATOM 526 C PHE A 53 -18.831 6.255 -4.225 1.00 0.00 C ATOM 527 O PHE A 53 -17.634 6.308 -4.502 1.00 0.00 O ATOM 528 CB PHE A 53 -19.308 6.214 -1.780 1.00 0.00 C ATOM 529 CG PHE A 53 -18.131 7.187 -1.679 1.00 0.00 C ATOM 530 CD1 PHE A 53 -16.857 6.712 -1.669 1.00 0.00 C ATOM 531 CD2 PHE A 53 -18.359 8.525 -1.598 1.00 0.00 C ATOM 532 CE1 PHE A 53 -15.764 7.615 -1.576 1.00 0.00 C ATOM 533 CE2 PHE A 53 -17.266 9.427 -1.504 1.00 0.00 C ATOM 534 CZ PHE A 53 -15.992 8.953 -1.496 1.00 0.00 C ATOM 0 H PHE A 53 -17.624 4.225 -3.469 1.00 0.00 H new ATOM 0 HA PHE A 53 -20.324 5.033 -3.311 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -20.239 6.777 -1.713 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -19.282 5.538 -0.925 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -16.676 5.649 -1.732 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -19.371 8.902 -1.605 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -14.752 7.238 -1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -17.447 10.490 -1.439 1.00 0.00 H new ATOM 0 HZ PHE A 53 -15.161 9.639 -1.426 1.00 0.00 H new ATOM 543 N SER A 54 -19.781 6.917 -4.869 1.00 0.00 N ATOM 544 CA SER A 54 -19.460 7.782 -5.992 1.00 0.00 C ATOM 545 C SER A 54 -18.769 6.976 -7.093 1.00 0.00 C ATOM 546 O SER A 54 -17.564 7.107 -7.300 1.00 0.00 O ATOM 547 CB SER A 54 -18.573 8.949 -5.553 1.00 0.00 C ATOM 548 OG SER A 54 -19.106 10.207 -5.957 1.00 0.00 O ATOM 0 H SER A 54 -20.773 6.872 -4.635 1.00 0.00 H new ATOM 0 HA SER A 54 -20.390 8.195 -6.382 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.464 8.933 -4.469 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.576 8.825 -5.976 1.00 0.00 H new ATOM 0 HG SER A 54 -18.512 10.926 -5.656 1.00 0.00 H new ATOM 553 N GLY A 55 -19.562 6.160 -7.771 1.00 0.00 N ATOM 554 CA GLY A 55 -19.043 5.333 -8.847 1.00 0.00 C ATOM 555 C GLY A 55 -19.432 3.866 -8.648 1.00 0.00 C ATOM 556 O GLY A 55 -19.549 3.400 -7.516 1.00 0.00 O ATOM 0 H GLY A 55 -20.561 6.054 -7.596 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -19.429 5.689 -9.802 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -17.957 5.423 -8.888 1.00 0.00 H new ATOM 560 N PRO A 56 -19.627 3.162 -9.795 1.00 0.00 N ATOM 561 CA PRO A 56 -20.001 1.759 -9.757 1.00 0.00 C ATOM 562 C PRO A 56 -18.804 0.882 -9.383 1.00 0.00 C ATOM 563 O PRO A 56 -18.537 0.661 -8.202 1.00 0.00 O ATOM 564 CB PRO A 56 -20.545 1.460 -11.145 1.00 0.00 C ATOM 565 CG PRO A 56 -20.028 2.572 -12.044 1.00 0.00 C ATOM 566 CD PRO A 56 -19.497 3.682 -11.153 1.00 0.00 C ATOM 0 HA PRO A 56 -20.750 1.544 -8.994 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -20.206 0.485 -11.496 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -21.635 1.436 -11.141 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -19.241 2.199 -12.699 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -20.826 2.946 -12.686 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -18.459 3.917 -11.389 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -20.069 4.601 -11.282 1.00 0.00 H new ATOM 571 N TYR A 57 -18.114 0.407 -10.410 1.00 0.00 N ATOM 572 CA TYR A 57 -16.952 -0.440 -10.203 1.00 0.00 C ATOM 573 C TYR A 57 -16.371 -0.909 -11.538 1.00 0.00 C ATOM 574 O TYR A 57 -16.388 -0.168 -12.520 1.00 0.00 O ATOM 575 CB TYR A 57 -17.451 -1.658 -9.422 1.00 0.00 C ATOM 576 CG TYR A 57 -16.391 -2.297 -8.524 1.00 0.00 C ATOM 577 CD1 TYR A 57 -15.062 -1.953 -8.670 1.00 0.00 C ATOM 578 CD2 TYR A 57 -16.763 -3.221 -7.567 1.00 0.00 C ATOM 579 CE1 TYR A 57 -14.065 -2.556 -7.825 1.00 0.00 C ATOM 580 CE2 TYR A 57 -15.765 -3.824 -6.722 1.00 0.00 C ATOM 581 CZ TYR A 57 -14.465 -3.460 -6.893 1.00 0.00 C ATOM 582 OH TYR A 57 -13.523 -4.030 -6.094 1.00 0.00 O ATOM 0 H TYR A 57 -18.338 0.593 -11.388 1.00 0.00 H new ATOM 0 HA TYR A 57 -16.170 0.104 -9.674 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -18.301 -1.360 -8.808 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -17.814 -2.406 -10.127 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -14.770 -1.231 -9.419 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -17.802 -3.491 -7.452 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -13.022 -2.296 -7.930 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -16.042 -4.548 -5.970 1.00 0.00 H new ATOM 0 HH TYR A 57 -13.954 -4.656 -5.475 1.00 0.00 H new ATOM 591 N THR A 58 -15.870 -2.135 -11.531 1.00 0.00 N ATOM 592 CA THR A 58 -15.285 -2.712 -12.730 1.00 0.00 C ATOM 593 C THR A 58 -14.058 -1.908 -13.163 1.00 0.00 C ATOM 594 O THR A 58 -13.781 -1.786 -14.355 1.00 0.00 O ATOM 595 CB THR A 58 -16.375 -2.783 -13.801 1.00 0.00 C ATOM 596 OG1 THR A 58 -17.319 -3.712 -13.275 1.00 0.00 O ATOM 597 CG2 THR A 58 -15.885 -3.439 -15.093 1.00 0.00 C ATOM 0 H THR A 58 -15.857 -2.745 -10.714 1.00 0.00 H new ATOM 0 HA THR A 58 -14.924 -3.724 -12.547 1.00 0.00 H new ATOM 0 HB THR A 58 -16.735 -1.778 -14.019 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.061 -3.817 -13.906 1.00 0.00 H new ATOM 0 HG21 THR A 58 -16.697 -3.464 -15.819 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.052 -2.865 -15.500 1.00 0.00 H new ATOM 0 HG23 THR A 58 -15.555 -4.456 -14.882 1.00 0.00 H new ATOM 605 N TYR A 59 -13.355 -1.380 -12.172 1.00 0.00 N ATOM 606 CA TYR A 59 -12.163 -0.591 -12.436 1.00 0.00 C ATOM 607 C TYR A 59 -11.434 -0.249 -11.136 1.00 0.00 C ATOM 608 O TYR A 59 -12.066 -0.008 -10.109 1.00 0.00 O ATOM 609 CB TYR A 59 -12.652 0.703 -13.089 1.00 0.00 C ATOM 610 CG TYR A 59 -11.527 1.660 -13.491 1.00 0.00 C ATOM 611 CD1 TYR A 59 -10.772 1.402 -14.617 1.00 0.00 C ATOM 612 CD2 TYR A 59 -11.269 2.781 -12.728 1.00 0.00 C ATOM 613 CE1 TYR A 59 -9.712 2.302 -14.995 1.00 0.00 C ATOM 614 CE2 TYR A 59 -10.210 3.680 -13.106 1.00 0.00 C ATOM 615 CZ TYR A 59 -9.484 3.397 -14.221 1.00 0.00 C ATOM 616 OH TYR A 59 -8.485 4.247 -14.579 1.00 0.00 O ATOM 0 H TYR A 59 -13.588 -1.483 -11.184 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.469 -1.143 -13.070 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -13.236 0.453 -13.974 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -13.322 1.216 -12.399 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.976 0.526 -15.215 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -11.861 2.984 -11.848 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.112 2.111 -15.873 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -9.997 4.560 -12.517 1.00 0.00 H new ATOM 0 HH TYR A 59 -8.376 4.232 -15.553 1.00 0.00 H new ATOM 625 N CYS A 60 -10.112 -0.239 -11.223 1.00 0.00 N ATOM 626 CA CYS A 60 -9.289 0.070 -10.065 1.00 0.00 C ATOM 627 C CYS A 60 -9.362 1.577 -9.811 1.00 0.00 C ATOM 628 O CYS A 60 -9.192 2.375 -10.732 1.00 0.00 O ATOM 629 CB CYS A 60 -7.846 -0.407 -10.253 1.00 0.00 C ATOM 630 SG CYS A 60 -7.678 -2.052 -11.036 1.00 0.00 S ATOM 0 H CYS A 60 -9.590 -0.440 -12.076 1.00 0.00 H new ATOM 0 HA CYS A 60 -9.669 -0.463 -9.194 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.312 0.325 -10.859 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.357 -0.432 -9.279 1.00 0.00 H new ATOM 634 N ASN A 61 -9.617 1.922 -8.558 1.00 0.00 N ATOM 635 CA ASN A 61 -9.716 3.319 -8.171 1.00 0.00 C ATOM 636 C ASN A 61 -8.563 3.665 -7.226 1.00 0.00 C ATOM 637 O ASN A 61 -7.914 2.773 -6.682 1.00 0.00 O ATOM 638 CB ASN A 61 -11.029 3.595 -7.436 1.00 0.00 C ATOM 639 CG ASN A 61 -11.255 5.099 -7.263 1.00 0.00 C ATOM 640 OD1 ASN A 61 -10.997 5.675 -6.217 1.00 0.00 O ATOM 641 ND2 ASN A 61 -11.748 5.700 -8.340 1.00 0.00 N ATOM 0 H ASN A 61 -9.758 1.258 -7.797 1.00 0.00 H new ATOM 0 HA ASN A 61 -9.676 3.924 -9.077 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -11.860 3.160 -7.992 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.012 3.111 -6.459 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -11.933 6.703 -8.324 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -11.941 5.159 -9.183 1.00 0.00 H new ATOM 647 N THR A 62 -8.346 4.961 -7.060 1.00 0.00 N ATOM 648 CA THR A 62 -7.283 5.436 -6.190 1.00 0.00 C ATOM 649 C THR A 62 -7.624 5.148 -4.726 1.00 0.00 C ATOM 650 O THR A 62 -8.617 5.653 -4.206 1.00 0.00 O ATOM 651 CB THR A 62 -7.061 6.921 -6.483 1.00 0.00 C ATOM 652 OG1 THR A 62 -6.625 6.947 -7.839 1.00 0.00 O ATOM 653 CG2 THR A 62 -5.882 7.502 -5.701 1.00 0.00 C ATOM 0 H THR A 62 -8.888 5.697 -7.513 1.00 0.00 H new ATOM 0 HA THR A 62 -6.348 4.909 -6.382 1.00 0.00 H new ATOM 0 HB THR A 62 -7.967 7.477 -6.241 1.00 0.00 H new ATOM 0 HG1 THR A 62 -7.300 7.395 -8.391 1.00 0.00 H new ATOM 0 HG21 THR A 62 -5.768 8.558 -5.946 1.00 0.00 H new ATOM 0 HG22 THR A 62 -6.066 7.395 -4.632 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.970 6.968 -5.967 1.00 0.00 H new ATOM 661 N THR A 63 -6.778 4.341 -4.104 1.00 0.00 N ATOM 662 CA THR A 63 -6.977 3.980 -2.710 1.00 0.00 C ATOM 663 C THR A 63 -5.632 3.724 -2.028 1.00 0.00 C ATOM 664 O THR A 63 -4.636 3.446 -2.695 1.00 0.00 O ATOM 665 CB THR A 63 -7.920 2.776 -2.663 1.00 0.00 C ATOM 666 OG1 THR A 63 -9.106 3.288 -2.059 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.443 1.696 -1.690 1.00 0.00 C ATOM 0 H THR A 63 -5.954 3.927 -4.539 1.00 0.00 H new ATOM 0 HA THR A 63 -7.439 4.795 -2.153 1.00 0.00 H new ATOM 0 HB THR A 63 -8.014 2.349 -3.661 1.00 0.00 H new ATOM 0 HG1 THR A 63 -9.773 2.573 -1.991 1.00 0.00 H new ATOM 0 HG21 THR A 63 -8.148 0.865 -1.695 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.459 1.340 -1.996 1.00 0.00 H new ATOM 0 HG23 THR A 63 -7.382 2.113 -0.685 1.00 0.00 H new ATOM 675 N LEU A 64 -5.644 3.829 -0.708 1.00 0.00 N ATOM 676 CA LEU A 64 -4.437 3.612 0.072 1.00 0.00 C ATOM 677 C LEU A 64 -4.736 2.627 1.205 1.00 0.00 C ATOM 678 O LEU A 64 -5.570 2.902 2.065 1.00 0.00 O ATOM 679 CB LEU A 64 -3.864 4.946 0.553 1.00 0.00 C ATOM 680 CG LEU A 64 -4.849 5.890 1.247 1.00 0.00 C ATOM 681 CD1 LEU A 64 -4.721 5.795 2.768 1.00 0.00 C ATOM 682 CD2 LEU A 64 -4.680 7.325 0.746 1.00 0.00 C ATOM 0 H LEU A 64 -6.471 4.062 -0.158 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.660 3.161 -0.546 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -3.044 4.739 1.241 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.437 5.466 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.861 5.577 0.989 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -5.432 6.476 3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.931 4.774 3.088 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.708 6.067 3.066 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.392 7.974 1.255 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.666 7.666 0.953 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.862 7.359 -0.328 1.00 0.00 H new ATOM 693 N ASP A 65 -4.039 1.502 1.166 1.00 0.00 N ATOM 694 CA ASP A 65 -4.219 0.475 2.178 1.00 0.00 C ATOM 695 C ASP A 65 -3.199 0.685 3.299 1.00 0.00 C ATOM 696 O ASP A 65 -2.752 1.806 3.534 1.00 0.00 O ATOM 697 CB ASP A 65 -3.997 -0.921 1.592 1.00 0.00 C ATOM 698 CG ASP A 65 -4.937 -2.004 2.126 1.00 0.00 C ATOM 699 OD1 ASP A 65 -5.580 -1.735 3.164 1.00 0.00 O ATOM 700 OD2 ASP A 65 -4.990 -3.075 1.485 1.00 0.00 O ATOM 0 H ASP A 65 -3.348 1.279 0.450 1.00 0.00 H new ATOM 0 HA ASP A 65 -5.239 0.549 2.556 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -4.109 -0.866 0.509 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -2.969 -1.223 1.791 1.00 0.00 H new ATOM 704 N GLN A 66 -2.861 -0.412 3.961 1.00 0.00 N ATOM 705 CA GLN A 66 -1.902 -0.362 5.051 1.00 0.00 C ATOM 706 C GLN A 66 -0.667 0.438 4.636 1.00 0.00 C ATOM 707 O GLN A 66 0.054 0.960 5.484 1.00 0.00 O ATOM 708 CB GLN A 66 -1.516 -1.770 5.507 1.00 0.00 C ATOM 709 CG GLN A 66 -0.948 -2.587 4.344 1.00 0.00 C ATOM 710 CD GLN A 66 0.569 -2.736 4.468 1.00 0.00 C ATOM 711 OE1 GLN A 66 1.245 -1.953 5.115 1.00 0.00 O ATOM 712 NE2 GLN A 66 1.065 -3.783 3.815 1.00 0.00 N ATOM 0 H GLN A 66 -3.234 -1.340 3.763 1.00 0.00 H new ATOM 0 HA GLN A 66 -2.369 0.142 5.897 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.778 -1.708 6.307 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -2.390 -2.275 5.918 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -1.413 -3.572 4.326 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -1.193 -2.101 3.400 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.443 -4.399 3.292 1.00 0.00 H new ATOM 0 HE22 GLN A 66 2.068 -3.970 3.837 1.00 0.00 H new ATOM 719 N ILE A 67 -0.460 0.510 3.329 1.00 0.00 N ATOM 720 CA ILE A 67 0.677 1.238 2.790 1.00 0.00 C ATOM 721 C ILE A 67 0.234 2.650 2.401 1.00 0.00 C ATOM 722 O ILE A 67 -0.419 2.839 1.376 1.00 0.00 O ATOM 723 CB ILE A 67 1.318 0.456 1.642 1.00 0.00 C ATOM 724 CG1 ILE A 67 2.337 -0.556 2.169 1.00 0.00 C ATOM 725 CG2 ILE A 67 1.932 1.403 0.609 1.00 0.00 C ATOM 726 CD1 ILE A 67 3.574 0.153 2.727 1.00 0.00 C ATOM 0 H ILE A 67 -1.060 0.076 2.628 1.00 0.00 H new ATOM 0 HA ILE A 67 1.455 1.344 3.546 1.00 0.00 H new ATOM 0 HB ILE A 67 0.536 -0.109 1.136 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.880 -1.166 2.948 1.00 0.00 H new ATOM 0 HG13 ILE A 67 2.632 -1.233 1.367 1.00 0.00 H new ATOM 0 HG21 ILE A 67 2.381 0.821 -0.196 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.155 2.049 0.200 1.00 0.00 H new ATOM 0 HG23 ILE A 67 2.698 2.014 1.086 1.00 0.00 H new ATOM 0 HD11 ILE A 67 4.283 -0.588 3.095 1.00 0.00 H new ATOM 0 HD12 ILE A 67 4.042 0.743 1.939 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.279 0.810 3.545 1.00 0.00 H new ATOM 737 N GLY A 68 0.608 3.605 3.239 1.00 0.00 N ATOM 738 CA GLY A 68 0.258 4.994 2.995 1.00 0.00 C ATOM 739 C GLY A 68 0.244 5.301 1.497 1.00 0.00 C ATOM 740 O GLY A 68 -0.714 5.881 0.987 1.00 0.00 O ATOM 0 H GLY A 68 1.150 3.445 4.088 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -0.722 5.206 3.422 1.00 0.00 H new ATOM 0 HA3 GLY A 68 0.973 5.646 3.497 1.00 0.00 H new ATOM 744 N THR A 69 1.318 4.899 0.832 1.00 0.00 N ATOM 745 CA THR A 69 1.441 5.124 -0.598 1.00 0.00 C ATOM 746 C THR A 69 0.091 4.915 -1.289 1.00 0.00 C ATOM 747 O THR A 69 -0.411 3.794 -1.352 1.00 0.00 O ATOM 748 CB THR A 69 2.543 4.205 -1.128 1.00 0.00 C ATOM 749 OG1 THR A 69 3.673 5.063 -1.267 1.00 0.00 O ATOM 750 CG2 THR A 69 2.267 3.719 -2.552 1.00 0.00 C ATOM 0 H THR A 69 2.111 4.419 1.258 1.00 0.00 H new ATOM 0 HA THR A 69 1.725 6.154 -0.813 1.00 0.00 H new ATOM 0 HB THR A 69 2.648 3.346 -0.466 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.435 4.548 -1.605 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.080 3.071 -2.879 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.329 3.164 -2.572 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.195 4.576 -3.221 1.00 0.00 H new ATOM 758 N CYS A 70 -0.457 6.012 -1.790 1.00 0.00 N ATOM 759 CA CYS A 70 -1.738 5.964 -2.473 1.00 0.00 C ATOM 760 C CYS A 70 -1.481 5.697 -3.957 1.00 0.00 C ATOM 761 O CYS A 70 -0.760 6.450 -4.611 1.00 0.00 O ATOM 762 CB CYS A 70 -2.545 7.245 -2.256 1.00 0.00 C ATOM 763 SG CYS A 70 -3.708 7.659 -3.606 1.00 0.00 S ATOM 0 H CYS A 70 -0.037 6.940 -1.736 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.343 5.158 -2.058 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -3.108 7.150 -1.327 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -1.852 8.076 -2.125 1.00 0.00 H new ATOM 767 N TRP A 71 -2.083 4.622 -4.446 1.00 0.00 N ATOM 768 CA TRP A 71 -1.928 4.247 -5.841 1.00 0.00 C ATOM 769 C TRP A 71 -3.074 4.882 -6.632 1.00 0.00 C ATOM 770 O TRP A 71 -4.204 4.947 -6.150 1.00 0.00 O ATOM 771 CB TRP A 71 -1.866 2.725 -5.996 1.00 0.00 C ATOM 772 CG TRP A 71 -0.807 2.053 -5.121 1.00 0.00 C ATOM 773 CD1 TRP A 71 -0.926 1.642 -3.851 1.00 0.00 C ATOM 774 CD2 TRP A 71 0.547 1.732 -5.504 1.00 0.00 C ATOM 775 NE1 TRP A 71 0.248 1.078 -3.390 1.00 0.00 N ATOM 776 CE2 TRP A 71 1.171 1.136 -4.427 1.00 0.00 C ATOM 777 CE3 TRP A 71 1.221 1.936 -6.721 1.00 0.00 C ATOM 778 CZ2 TRP A 71 2.500 0.695 -4.458 1.00 0.00 C ATOM 779 CZ3 TRP A 71 2.549 1.491 -6.736 1.00 0.00 C ATOM 780 CH2 TRP A 71 3.192 0.889 -5.661 1.00 0.00 C ATOM 0 H TRP A 71 -2.679 3.999 -3.901 1.00 0.00 H new ATOM 0 HA TRP A 71 -0.983 4.619 -6.238 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -2.842 2.305 -5.754 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -1.666 2.484 -7.040 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -1.826 1.739 -3.262 1.00 0.00 H new ATOM 0 HE1 TRP A 71 0.408 0.691 -2.460 1.00 0.00 H new ATOM 0 HE3 TRP A 71 0.752 2.399 -7.576 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 2.966 0.231 -3.601 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 3.113 1.625 -7.647 1.00 0.00 H new ATOM 0 HH2 TRP A 71 4.220 0.572 -5.752 1.00 0.00 H new ATOM 790 N PRO A 72 -2.733 5.345 -7.864 1.00 0.00 N ATOM 791 CA PRO A 72 -3.721 5.973 -8.726 1.00 0.00 C ATOM 792 C PRO A 72 -4.656 4.929 -9.339 1.00 0.00 C ATOM 793 O PRO A 72 -4.258 3.787 -9.561 1.00 0.00 O ATOM 794 CB PRO A 72 -2.911 6.728 -9.767 1.00 0.00 C ATOM 795 CG PRO A 72 -1.517 6.121 -9.731 1.00 0.00 C ATOM 796 CD PRO A 72 -1.406 5.284 -8.467 1.00 0.00 C ATOM 0 HA PRO A 72 -4.381 6.651 -8.185 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.356 6.626 -10.757 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -2.879 7.794 -9.540 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.346 5.504 -10.613 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -0.759 6.904 -9.738 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.122 4.257 -8.696 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -0.647 5.682 -7.794 1.00 0.00 H new ATOM 801 N GLN A 73 -5.884 5.358 -9.595 1.00 0.00 N ATOM 802 CA GLN A 73 -6.879 4.475 -10.177 1.00 0.00 C ATOM 803 C GLN A 73 -6.308 3.770 -11.410 1.00 0.00 C ATOM 804 O GLN A 73 -5.288 4.192 -11.954 1.00 0.00 O ATOM 805 CB GLN A 73 -8.156 5.243 -10.528 1.00 0.00 C ATOM 806 CG GLN A 73 -7.901 6.246 -11.655 1.00 0.00 C ATOM 807 CD GLN A 73 -7.918 7.681 -11.125 1.00 0.00 C ATOM 808 OE1 GLN A 73 -8.948 8.332 -11.054 1.00 0.00 O ATOM 809 NE2 GLN A 73 -6.723 8.137 -10.758 1.00 0.00 N ATOM 0 H GLN A 73 -6.212 6.306 -9.410 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.140 3.718 -9.438 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.935 4.542 -10.829 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.523 5.767 -9.646 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.938 6.038 -12.121 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.661 6.131 -12.428 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -5.901 7.539 -10.844 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.629 9.084 -10.391 1.00 0.00 H new ATOM 816 N SER A 74 -6.990 2.709 -11.815 1.00 0.00 N ATOM 817 CA SER A 74 -6.563 1.941 -12.972 1.00 0.00 C ATOM 818 C SER A 74 -7.688 1.008 -13.426 1.00 0.00 C ATOM 819 O SER A 74 -8.795 1.060 -12.892 1.00 0.00 O ATOM 820 CB SER A 74 -5.297 1.138 -12.665 1.00 0.00 C ATOM 821 OG SER A 74 -4.263 1.957 -12.127 1.00 0.00 O ATOM 0 H SER A 74 -7.836 2.363 -11.362 1.00 0.00 H new ATOM 0 HA SER A 74 -6.331 2.638 -13.778 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.534 0.343 -11.958 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.942 0.658 -13.577 1.00 0.00 H new ATOM 0 HG SER A 74 -4.343 2.864 -12.488 1.00 0.00 H new ATOM 826 N ALA A 75 -7.364 0.178 -14.406 1.00 0.00 N ATOM 827 CA ALA A 75 -8.334 -0.766 -14.937 1.00 0.00 C ATOM 828 C ALA A 75 -8.061 -2.154 -14.354 1.00 0.00 C ATOM 829 O ALA A 75 -7.021 -2.378 -13.735 1.00 0.00 O ATOM 830 CB ALA A 75 -8.274 -0.753 -16.465 1.00 0.00 C ATOM 0 H ALA A 75 -6.445 0.139 -14.846 1.00 0.00 H new ATOM 0 HA ALA A 75 -9.346 -0.481 -14.648 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -9.001 -1.461 -16.864 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -8.504 0.248 -16.830 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -7.274 -1.037 -16.792 1.00 0.00 H new ATOM 836 N PRO A 76 -9.036 -3.074 -14.580 1.00 0.00 N ATOM 837 CA PRO A 76 -8.911 -4.434 -14.084 1.00 0.00 C ATOM 838 C PRO A 76 -7.914 -5.234 -14.925 1.00 0.00 C ATOM 839 O PRO A 76 -7.792 -5.012 -16.129 1.00 0.00 O ATOM 840 CB PRO A 76 -10.319 -5.002 -14.133 1.00 0.00 C ATOM 841 CG PRO A 76 -11.098 -4.106 -15.083 1.00 0.00 C ATOM 842 CD PRO A 76 -10.280 -2.845 -15.309 1.00 0.00 C ATOM 0 HA PRO A 76 -8.514 -4.477 -13.070 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.312 -6.033 -14.486 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.772 -5.008 -13.142 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.280 -4.618 -16.028 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -12.073 -3.859 -14.662 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.092 -2.680 -16.370 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.801 -1.963 -14.936 1.00 0.00 H new ATOM 847 N GLY A 77 -7.226 -6.150 -14.258 1.00 0.00 N ATOM 848 CA GLY A 77 -6.243 -6.983 -14.929 1.00 0.00 C ATOM 849 C GLY A 77 -5.074 -6.145 -15.448 1.00 0.00 C ATOM 850 O GLY A 77 -4.453 -6.491 -16.451 1.00 0.00 O ATOM 0 H GLY A 77 -7.330 -6.333 -13.260 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.873 -7.741 -14.239 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.714 -7.510 -15.759 1.00 0.00 H new ATOM 854 N ALA A 78 -4.808 -5.056 -14.740 1.00 0.00 N ATOM 855 CA ALA A 78 -3.725 -4.165 -15.116 1.00 0.00 C ATOM 856 C ALA A 78 -2.388 -4.800 -14.724 1.00 0.00 C ATOM 857 O ALA A 78 -2.255 -6.023 -14.724 1.00 0.00 O ATOM 858 CB ALA A 78 -3.935 -2.798 -14.460 1.00 0.00 C ATOM 0 H ALA A 78 -5.325 -4.771 -13.908 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.714 -4.010 -16.195 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.122 -2.130 -14.743 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.883 -2.376 -14.793 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.950 -2.913 -13.376 1.00 0.00 H new ATOM 864 N LEU A 79 -1.434 -3.939 -14.400 1.00 0.00 N ATOM 865 CA LEU A 79 -0.113 -4.401 -14.007 1.00 0.00 C ATOM 866 C LEU A 79 0.707 -3.215 -13.497 1.00 0.00 C ATOM 867 O LEU A 79 1.481 -2.623 -14.248 1.00 0.00 O ATOM 868 CB LEU A 79 0.553 -5.161 -15.156 1.00 0.00 C ATOM 869 CG LEU A 79 1.124 -6.537 -14.809 1.00 0.00 C ATOM 870 CD1 LEU A 79 2.020 -6.463 -13.572 1.00 0.00 C ATOM 871 CD2 LEU A 79 0.006 -7.569 -14.645 1.00 0.00 C ATOM 0 H LEU A 79 -1.549 -2.926 -14.402 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.188 -5.114 -13.186 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.178 -5.284 -15.955 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.360 -4.545 -15.553 1.00 0.00 H new ATOM 0 HG LEU A 79 1.748 -6.867 -15.640 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.413 -7.455 -13.347 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.848 -5.780 -13.762 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.439 -6.102 -12.723 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.439 -8.538 -14.399 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.663 -7.256 -13.843 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.555 -7.648 -15.576 1.00 0.00 H new ATOM 882 N VAL A 80 0.508 -2.902 -12.225 1.00 0.00 N ATOM 883 CA VAL A 80 1.219 -1.796 -11.606 1.00 0.00 C ATOM 884 C VAL A 80 2.389 -2.343 -10.787 1.00 0.00 C ATOM 885 O VAL A 80 2.455 -2.134 -9.576 1.00 0.00 O ATOM 886 CB VAL A 80 0.251 -0.950 -10.776 1.00 0.00 C ATOM 887 CG1 VAL A 80 1.009 0.028 -9.877 1.00 0.00 C ATOM 888 CG2 VAL A 80 -0.741 -0.211 -11.676 1.00 0.00 C ATOM 0 H VAL A 80 -0.136 -3.395 -11.606 1.00 0.00 H new ATOM 0 HA VAL A 80 1.635 -1.136 -12.367 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.316 -1.624 -10.134 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.297 0.617 -9.298 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.656 -0.528 -9.199 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.615 0.693 -10.492 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.418 0.383 -11.061 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.197 0.446 -12.355 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.316 -0.934 -12.254 1.00 0.00 H new ATOM 898 N GLU A 81 3.284 -3.031 -11.479 1.00 0.00 N ATOM 899 CA GLU A 81 4.448 -3.609 -10.831 1.00 0.00 C ATOM 900 C GLU A 81 5.651 -2.672 -10.962 1.00 0.00 C ATOM 901 O GLU A 81 5.915 -2.144 -12.041 1.00 0.00 O ATOM 902 CB GLU A 81 4.767 -4.991 -11.404 1.00 0.00 C ATOM 903 CG GLU A 81 5.081 -4.905 -12.899 1.00 0.00 C ATOM 904 CD GLU A 81 6.523 -5.333 -13.182 1.00 0.00 C ATOM 905 OE1 GLU A 81 7.422 -4.506 -12.919 1.00 0.00 O ATOM 906 OE2 GLU A 81 6.693 -6.477 -13.655 1.00 0.00 O ATOM 0 H GLU A 81 3.226 -3.201 -12.483 1.00 0.00 H new ATOM 0 HA GLU A 81 4.222 -3.734 -9.772 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.617 -5.421 -10.874 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.921 -5.659 -11.244 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.393 -5.541 -13.456 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.925 -3.884 -13.249 1.00 0.00 H new ATOM 911 N ARG A 82 6.346 -2.493 -9.849 1.00 0.00 N ATOM 912 CA ARG A 82 7.513 -1.628 -9.826 1.00 0.00 C ATOM 913 C ARG A 82 8.440 -2.016 -8.672 1.00 0.00 C ATOM 914 O ARG A 82 8.671 -1.221 -7.763 1.00 0.00 O ATOM 915 CB ARG A 82 7.109 -0.160 -9.675 1.00 0.00 C ATOM 916 CG ARG A 82 6.114 0.019 -8.525 1.00 0.00 C ATOM 917 CD ARG A 82 5.575 1.450 -8.484 1.00 0.00 C ATOM 918 NE ARG A 82 4.512 1.620 -9.500 1.00 0.00 N ATOM 919 CZ ARG A 82 4.005 2.805 -9.865 1.00 0.00 C ATOM 920 NH1 ARG A 82 4.459 3.932 -9.299 1.00 0.00 N ATOM 921 NH2 ARG A 82 3.042 2.863 -10.795 1.00 0.00 N ATOM 0 H ARG A 82 6.123 -2.932 -8.956 1.00 0.00 H new ATOM 0 HA ARG A 82 8.036 -1.753 -10.774 1.00 0.00 H new ATOM 0 HB2 ARG A 82 7.995 0.448 -9.492 1.00 0.00 H new ATOM 0 HB3 ARG A 82 6.664 0.196 -10.604 1.00 0.00 H new ATOM 0 HG2 ARG A 82 5.287 -0.682 -8.642 1.00 0.00 H new ATOM 0 HG3 ARG A 82 6.600 -0.217 -7.579 1.00 0.00 H new ATOM 0 HD2 ARG A 82 5.180 1.670 -7.492 1.00 0.00 H new ATOM 0 HD3 ARG A 82 6.383 2.157 -8.670 1.00 0.00 H new ATOM 0 HE ARG A 82 4.143 0.783 -9.950 1.00 0.00 H new ATOM 0 HH11 ARG A 82 5.191 3.888 -8.590 1.00 0.00 H new ATOM 0 HH12 ARG A 82 4.073 4.834 -9.577 1.00 0.00 H new ATOM 0 HH21 ARG A 82 2.695 2.005 -11.224 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.655 3.765 -11.073 1.00 0.00 H new ATOM 932 N PRO A 83 8.958 -3.271 -8.748 1.00 0.00 N ATOM 933 CA PRO A 83 9.854 -3.775 -7.721 1.00 0.00 C ATOM 934 C PRO A 83 11.246 -3.153 -7.855 1.00 0.00 C ATOM 935 O PRO A 83 11.736 -2.955 -8.966 1.00 0.00 O ATOM 936 CB PRO A 83 9.856 -5.283 -7.905 1.00 0.00 C ATOM 937 CG PRO A 83 9.333 -5.531 -9.311 1.00 0.00 C ATOM 938 CD PRO A 83 8.706 -4.240 -9.811 1.00 0.00 C ATOM 0 HA PRO A 83 9.530 -3.512 -6.714 1.00 0.00 H new ATOM 0 HB2 PRO A 83 10.860 -5.690 -7.784 1.00 0.00 H new ATOM 0 HB3 PRO A 83 9.224 -5.768 -7.162 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.144 -5.842 -9.970 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.598 -6.336 -9.308 1.00 0.00 H new ATOM 0 HD2 PRO A 83 9.153 -3.921 -10.752 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.638 -4.362 -9.991 1.00 0.00 H new ATOM 943 N CYS A 84 11.843 -2.865 -6.709 1.00 0.00 N ATOM 944 CA CYS A 84 13.169 -2.271 -6.684 1.00 0.00 C ATOM 945 C CYS A 84 14.000 -2.904 -7.801 1.00 0.00 C ATOM 946 O CYS A 84 14.533 -4.001 -7.639 1.00 0.00 O ATOM 947 CB CYS A 84 13.836 -2.431 -5.317 1.00 0.00 C ATOM 948 SG CYS A 84 13.339 -3.930 -4.391 1.00 0.00 S ATOM 0 H CYS A 84 11.433 -3.032 -5.790 1.00 0.00 H new ATOM 0 HA CYS A 84 13.091 -1.197 -6.853 1.00 0.00 H new ATOM 0 HB2 CYS A 84 14.917 -2.448 -5.456 1.00 0.00 H new ATOM 0 HB3 CYS A 84 13.606 -1.554 -4.712 1.00 0.00 H new ATOM 952 N PRO A 85 14.087 -2.167 -8.941 1.00 0.00 N ATOM 953 CA PRO A 85 14.845 -2.644 -10.086 1.00 0.00 C ATOM 954 C PRO A 85 16.349 -2.511 -9.843 1.00 0.00 C ATOM 955 O PRO A 85 17.142 -2.574 -10.781 1.00 0.00 O ATOM 956 CB PRO A 85 14.356 -1.809 -11.258 1.00 0.00 C ATOM 957 CG PRO A 85 13.687 -0.587 -10.648 1.00 0.00 C ATOM 958 CD PRO A 85 13.470 -0.864 -9.170 1.00 0.00 C ATOM 0 HA PRO A 85 14.691 -3.706 -10.279 1.00 0.00 H new ATOM 0 HB2 PRO A 85 15.185 -1.519 -11.904 1.00 0.00 H new ATOM 0 HB3 PRO A 85 13.654 -2.372 -11.873 1.00 0.00 H new ATOM 0 HG2 PRO A 85 14.310 0.297 -10.783 1.00 0.00 H new ATOM 0 HG3 PRO A 85 12.737 -0.385 -11.142 1.00 0.00 H new ATOM 0 HD2 PRO A 85 13.931 -0.094 -8.551 1.00 0.00 H new ATOM 0 HD3 PRO A 85 12.409 -0.880 -8.922 1.00 0.00 H new ATOM 963 N GLU A 86 16.698 -2.328 -8.577 1.00 0.00 N ATOM 964 CA GLU A 86 18.093 -2.185 -8.198 1.00 0.00 C ATOM 965 C GLU A 86 18.970 -3.115 -9.041 1.00 0.00 C ATOM 966 O GLU A 86 18.468 -4.045 -9.670 1.00 0.00 O ATOM 967 CB GLU A 86 18.287 -2.454 -6.704 1.00 0.00 C ATOM 968 CG GLU A 86 18.239 -1.152 -5.903 1.00 0.00 C ATOM 969 CD GLU A 86 19.643 -0.724 -5.468 1.00 0.00 C ATOM 970 OE1 GLU A 86 20.323 -1.564 -4.840 1.00 0.00 O ATOM 971 OE2 GLU A 86 20.004 0.433 -5.775 1.00 0.00 O ATOM 0 H GLU A 86 16.038 -2.276 -7.801 1.00 0.00 H new ATOM 0 HA GLU A 86 18.397 -1.156 -8.390 1.00 0.00 H new ATOM 0 HB2 GLU A 86 17.511 -3.133 -6.349 1.00 0.00 H new ATOM 0 HB3 GLU A 86 19.244 -2.950 -6.541 1.00 0.00 H new ATOM 0 HG2 GLU A 86 17.786 -0.366 -6.507 1.00 0.00 H new ATOM 0 HG3 GLU A 86 17.607 -1.284 -5.025 1.00 0.00 H new ATOM 976 N TYR A 87 20.263 -2.830 -9.024 1.00 0.00 N ATOM 977 CA TYR A 87 21.215 -3.629 -9.779 1.00 0.00 C ATOM 978 C TYR A 87 21.408 -5.004 -9.136 1.00 0.00 C ATOM 979 O TYR A 87 21.742 -5.971 -9.818 1.00 0.00 O ATOM 980 CB TYR A 87 22.540 -2.866 -9.729 1.00 0.00 C ATOM 981 CG TYR A 87 23.371 -3.142 -8.475 1.00 0.00 C ATOM 982 CD1 TYR A 87 22.994 -2.596 -7.264 1.00 0.00 C ATOM 983 CD2 TYR A 87 24.496 -3.936 -8.553 1.00 0.00 C ATOM 984 CE1 TYR A 87 23.776 -2.856 -6.083 1.00 0.00 C ATOM 985 CE2 TYR A 87 25.278 -4.196 -7.372 1.00 0.00 C ATOM 986 CZ TYR A 87 24.879 -3.643 -6.195 1.00 0.00 C ATOM 987 OH TYR A 87 25.617 -3.889 -5.080 1.00 0.00 O ATOM 0 H TYR A 87 20.675 -2.058 -8.500 1.00 0.00 H new ATOM 0 HA TYR A 87 20.861 -3.786 -10.798 1.00 0.00 H new ATOM 0 HB2 TYR A 87 23.130 -3.126 -10.608 1.00 0.00 H new ATOM 0 HB3 TYR A 87 22.334 -1.797 -9.788 1.00 0.00 H new ATOM 0 HD1 TYR A 87 22.113 -1.974 -7.203 1.00 0.00 H new ATOM 0 HD2 TYR A 87 24.791 -4.363 -9.500 1.00 0.00 H new ATOM 0 HE1 TYR A 87 23.493 -2.435 -5.130 1.00 0.00 H new ATOM 0 HE2 TYR A 87 26.161 -4.816 -7.420 1.00 0.00 H new ATOM 0 HH TYR A 87 26.374 -4.467 -5.310 1.00 0.00 H new ATOM 996 N PHE A 88 21.189 -5.047 -7.830 1.00 0.00 N ATOM 997 CA PHE A 88 21.335 -6.288 -7.087 1.00 0.00 C ATOM 998 C PHE A 88 20.725 -7.462 -7.855 1.00 0.00 C ATOM 999 O PHE A 88 21.134 -8.607 -7.673 1.00 0.00 O ATOM 1000 CB PHE A 88 20.581 -6.110 -5.768 1.00 0.00 C ATOM 1001 CG PHE A 88 19.058 -6.116 -5.916 1.00 0.00 C ATOM 1002 CD1 PHE A 88 18.462 -5.329 -6.851 1.00 0.00 C ATOM 1003 CD2 PHE A 88 18.300 -6.909 -5.113 1.00 0.00 C ATOM 1004 CE1 PHE A 88 17.049 -5.334 -6.987 1.00 0.00 C ATOM 1005 CE2 PHE A 88 16.887 -6.916 -5.250 1.00 0.00 C ATOM 1006 CZ PHE A 88 16.291 -6.127 -6.184 1.00 0.00 C ATOM 0 H PHE A 88 20.912 -4.243 -7.267 1.00 0.00 H new ATOM 0 HA PHE A 88 22.391 -6.504 -6.926 1.00 0.00 H new ATOM 0 HB2 PHE A 88 20.872 -6.907 -5.084 1.00 0.00 H new ATOM 0 HB3 PHE A 88 20.888 -5.170 -5.310 1.00 0.00 H new ATOM 0 HD1 PHE A 88 19.064 -4.700 -7.490 1.00 0.00 H new ATOM 0 HD2 PHE A 88 18.773 -7.534 -4.370 1.00 0.00 H new ATOM 0 HE1 PHE A 88 16.576 -4.708 -7.729 1.00 0.00 H new ATOM 0 HE2 PHE A 88 16.286 -7.548 -4.613 1.00 0.00 H new ATOM 0 HZ PHE A 88 15.216 -6.130 -6.288 1.00 0.00 H new ATOM 1015 N ASN A 89 19.755 -7.136 -8.699 1.00 0.00 N ATOM 1016 CA ASN A 89 19.085 -8.149 -9.495 1.00 0.00 C ATOM 1017 C ASN A 89 19.548 -8.037 -10.950 1.00 0.00 C ATOM 1018 O ASN A 89 20.526 -7.352 -11.242 1.00 0.00 O ATOM 1019 CB ASN A 89 17.567 -7.959 -9.466 1.00 0.00 C ATOM 1020 CG ASN A 89 17.168 -6.636 -10.123 1.00 0.00 C ATOM 1021 OD1 ASN A 89 17.761 -6.191 -11.092 1.00 0.00 O ATOM 1022 ND2 ASN A 89 16.132 -6.035 -9.546 1.00 0.00 N ATOM 0 H ASN A 89 19.418 -6.185 -8.848 1.00 0.00 H new ATOM 0 HA ASN A 89 19.334 -9.125 -9.077 1.00 0.00 H new ATOM 0 HB2 ASN A 89 17.083 -8.787 -9.984 1.00 0.00 H new ATOM 0 HB3 ASN A 89 17.214 -7.978 -8.435 1.00 0.00 H new ATOM 0 HD21 ASN A 89 15.789 -5.147 -9.912 1.00 0.00 H new ATOM 0 HD22 ASN A 89 15.681 -6.462 -8.737 1.00 0.00 H new ATOM 1028 N GLY A 90 18.821 -8.719 -11.823 1.00 0.00 N ATOM 1029 CA GLY A 90 19.144 -8.704 -13.238 1.00 0.00 C ATOM 1030 C GLY A 90 18.310 -7.658 -13.980 1.00 0.00 C ATOM 1031 O GLY A 90 17.617 -7.981 -14.944 1.00 0.00 O ATOM 0 H GLY A 90 18.009 -9.285 -11.577 1.00 0.00 H new ATOM 0 HA2 GLY A 90 20.204 -8.489 -13.370 1.00 0.00 H new ATOM 0 HA3 GLY A 90 18.962 -9.690 -13.667 1.00 0.00 H new ATOM 1035 N ILE A 91 18.404 -6.426 -13.502 1.00 0.00 N ATOM 1036 CA ILE A 91 17.667 -5.330 -14.109 1.00 0.00 C ATOM 1037 C ILE A 91 18.176 -4.003 -13.540 1.00 0.00 C ATOM 1038 O ILE A 91 18.501 -3.914 -12.357 1.00 0.00 O ATOM 1039 CB ILE A 91 16.161 -5.536 -13.935 1.00 0.00 C ATOM 1040 CG1 ILE A 91 15.418 -5.283 -15.247 1.00 0.00 C ATOM 1041 CG2 ILE A 91 15.618 -4.674 -12.792 1.00 0.00 C ATOM 1042 CD1 ILE A 91 15.808 -3.931 -15.847 1.00 0.00 C ATOM 0 H ILE A 91 18.979 -6.162 -12.702 1.00 0.00 H new ATOM 0 HA ILE A 91 17.840 -5.304 -15.185 1.00 0.00 H new ATOM 0 HB ILE A 91 15.988 -6.577 -13.663 1.00 0.00 H new ATOM 0 HG12 ILE A 91 15.645 -6.079 -15.957 1.00 0.00 H new ATOM 0 HG13 ILE A 91 14.343 -5.310 -15.071 1.00 0.00 H new ATOM 0 HG21 ILE A 91 14.545 -4.839 -12.690 1.00 0.00 H new ATOM 0 HG22 ILE A 91 16.118 -4.946 -11.862 1.00 0.00 H new ATOM 0 HG23 ILE A 91 15.804 -3.622 -13.010 1.00 0.00 H new ATOM 0 HD11 ILE A 91 15.265 -3.777 -16.779 1.00 0.00 H new ATOM 0 HD12 ILE A 91 15.557 -3.136 -15.145 1.00 0.00 H new ATOM 0 HD13 ILE A 91 16.880 -3.916 -16.045 1.00 0.00 H new ATOM 1053 N LYS A 92 18.228 -3.005 -14.410 1.00 0.00 N ATOM 1054 CA LYS A 92 18.692 -1.687 -14.010 1.00 0.00 C ATOM 1055 C LYS A 92 17.545 -0.930 -13.339 1.00 0.00 C ATOM 1056 O LYS A 92 16.381 -1.129 -13.681 1.00 0.00 O ATOM 1057 CB LYS A 92 19.302 -0.949 -15.203 1.00 0.00 C ATOM 1058 CG LYS A 92 20.792 -0.683 -14.981 1.00 0.00 C ATOM 1059 CD LYS A 92 21.514 -0.462 -16.311 1.00 0.00 C ATOM 1060 CE LYS A 92 23.017 -0.272 -16.094 1.00 0.00 C ATOM 1061 NZ LYS A 92 23.588 0.594 -17.150 1.00 0.00 N ATOM 0 H LYS A 92 17.957 -3.082 -15.390 1.00 0.00 H new ATOM 0 HA LYS A 92 19.492 -1.771 -13.275 1.00 0.00 H new ATOM 0 HB2 LYS A 92 19.166 -1.540 -16.109 1.00 0.00 H new ATOM 0 HB3 LYS A 92 18.780 -0.005 -15.357 1.00 0.00 H new ATOM 0 HG2 LYS A 92 20.918 0.193 -14.345 1.00 0.00 H new ATOM 0 HG3 LYS A 92 21.241 -1.526 -14.455 1.00 0.00 H new ATOM 0 HD2 LYS A 92 21.343 -1.315 -16.968 1.00 0.00 H new ATOM 0 HD3 LYS A 92 21.102 0.414 -16.812 1.00 0.00 H new ATOM 0 HE2 LYS A 92 23.196 0.172 -15.115 1.00 0.00 H new ATOM 0 HE3 LYS A 92 23.517 -1.241 -16.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 24.608 0.713 -16.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 23.434 0.155 -18.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 23.123 1.524 -17.125 1.00 0.00 H new ATOM 1071 N TYR A 93 17.914 -0.078 -12.394 1.00 0.00 N ATOM 1072 CA TYR A 93 16.929 0.710 -11.671 1.00 0.00 C ATOM 1073 C TYR A 93 16.995 2.182 -12.085 1.00 0.00 C ATOM 1074 O TYR A 93 18.067 2.693 -12.406 1.00 0.00 O ATOM 1075 CB TYR A 93 17.299 0.592 -10.191 1.00 0.00 C ATOM 1076 CG TYR A 93 18.617 1.275 -9.822 1.00 0.00 C ATOM 1077 CD1 TYR A 93 19.809 0.590 -9.949 1.00 0.00 C ATOM 1078 CD2 TYR A 93 18.617 2.576 -9.363 1.00 0.00 C ATOM 1079 CE1 TYR A 93 21.050 1.232 -9.603 1.00 0.00 C ATOM 1080 CE2 TYR A 93 19.858 3.219 -9.016 1.00 0.00 C ATOM 1081 CZ TYR A 93 21.013 2.515 -9.152 1.00 0.00 C ATOM 1082 OH TYR A 93 22.185 3.122 -8.825 1.00 0.00 O ATOM 0 H TYR A 93 18.881 0.084 -12.112 1.00 0.00 H new ATOM 0 HA TYR A 93 15.921 0.351 -11.880 1.00 0.00 H new ATOM 0 HB2 TYR A 93 16.498 1.024 -9.591 1.00 0.00 H new ATOM 0 HB3 TYR A 93 17.362 -0.463 -9.926 1.00 0.00 H new ATOM 0 HD1 TYR A 93 19.810 -0.428 -10.308 1.00 0.00 H new ATOM 0 HD2 TYR A 93 17.685 3.113 -9.264 1.00 0.00 H new ATOM 0 HE1 TYR A 93 21.989 0.707 -9.699 1.00 0.00 H new ATOM 0 HE2 TYR A 93 19.871 4.237 -8.656 1.00 0.00 H new ATOM 0 HH TYR A 93 22.006 4.036 -8.520 1.00 0.00 H new ATOM 1091 N ASN A 94 15.835 2.821 -12.064 1.00 0.00 N ATOM 1092 CA ASN A 94 15.747 4.224 -12.433 1.00 0.00 C ATOM 1093 C ASN A 94 15.224 5.028 -11.241 1.00 0.00 C ATOM 1094 O ASN A 94 15.683 6.141 -10.989 1.00 0.00 O ATOM 1095 CB ASN A 94 14.780 4.427 -13.601 1.00 0.00 C ATOM 1096 CG ASN A 94 15.249 3.662 -14.840 1.00 0.00 C ATOM 1097 OD1 ASN A 94 15.801 4.220 -15.774 1.00 0.00 O ATOM 1098 ND2 ASN A 94 14.998 2.356 -14.797 1.00 0.00 N ATOM 0 H ASN A 94 14.948 2.394 -11.797 1.00 0.00 H new ATOM 0 HA ASN A 94 16.742 4.559 -12.727 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.784 4.089 -13.316 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.702 5.489 -13.833 1.00 0.00 H new ATOM 0 HD21 ASN A 94 15.272 1.758 -15.577 1.00 0.00 H new ATOM 0 HD22 ASN A 94 14.532 1.953 -13.984 1.00 0.00 H new ATOM 1104 N THR A 95 14.271 4.434 -10.539 1.00 0.00 N ATOM 1105 CA THR A 95 13.679 5.081 -9.380 1.00 0.00 C ATOM 1106 C THR A 95 14.130 4.386 -8.094 1.00 0.00 C ATOM 1107 O THR A 95 15.060 3.580 -8.112 1.00 0.00 O ATOM 1108 CB THR A 95 12.162 5.091 -9.566 1.00 0.00 C ATOM 1109 OG1 THR A 95 11.845 3.746 -9.915 1.00 0.00 O ATOM 1110 CG2 THR A 95 11.726 5.904 -10.787 1.00 0.00 C ATOM 0 H THR A 95 13.893 3.510 -10.750 1.00 0.00 H new ATOM 0 HA THR A 95 14.015 6.114 -9.289 1.00 0.00 H new ATOM 0 HB THR A 95 11.691 5.498 -8.671 1.00 0.00 H new ATOM 0 HG1 THR A 95 10.878 3.663 -10.052 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.640 5.878 -10.872 1.00 0.00 H new ATOM 0 HG22 THR A 95 12.056 6.936 -10.674 1.00 0.00 H new ATOM 0 HG23 THR A 95 12.171 5.477 -11.686 1.00 0.00 H new ATOM 1118 N THR A 96 13.449 4.722 -7.008 1.00 0.00 N ATOM 1119 CA THR A 96 13.767 4.140 -5.715 1.00 0.00 C ATOM 1120 C THR A 96 12.543 3.429 -5.135 1.00 0.00 C ATOM 1121 O THR A 96 12.665 2.355 -4.547 1.00 0.00 O ATOM 1122 CB THR A 96 14.307 5.253 -4.815 1.00 0.00 C ATOM 1123 OG1 THR A 96 14.402 4.645 -3.530 1.00 0.00 O ATOM 1124 CG2 THR A 96 13.299 6.387 -4.618 1.00 0.00 C ATOM 0 H THR A 96 12.678 5.390 -6.997 1.00 0.00 H new ATOM 0 HA THR A 96 14.537 3.373 -5.805 1.00 0.00 H new ATOM 0 HB THR A 96 15.225 5.654 -5.245 1.00 0.00 H new ATOM 0 HG1 THR A 96 14.746 5.297 -2.884 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.732 7.150 -3.972 1.00 0.00 H new ATOM 0 HG22 THR A 96 13.053 6.827 -5.584 1.00 0.00 H new ATOM 0 HG23 THR A 96 12.393 5.993 -4.157 1.00 0.00 H new ATOM 1132 N ARG A 97 11.391 4.056 -5.321 1.00 0.00 N ATOM 1133 CA ARG A 97 10.146 3.496 -4.823 1.00 0.00 C ATOM 1134 C ARG A 97 9.930 2.092 -5.391 1.00 0.00 C ATOM 1135 O ARG A 97 9.753 1.928 -6.597 1.00 0.00 O ATOM 1136 CB ARG A 97 8.955 4.380 -5.199 1.00 0.00 C ATOM 1137 CG ARG A 97 9.025 5.729 -4.480 1.00 0.00 C ATOM 1138 CD ARG A 97 7.685 6.070 -3.825 1.00 0.00 C ATOM 1139 NE ARG A 97 7.812 7.310 -3.027 1.00 0.00 N ATOM 1140 CZ ARG A 97 7.806 8.544 -3.550 1.00 0.00 C ATOM 1141 NH1 ARG A 97 7.679 8.710 -4.873 1.00 0.00 N ATOM 1142 NH2 ARG A 97 7.929 9.611 -2.749 1.00 0.00 N ATOM 0 H ARG A 97 11.293 4.946 -5.809 1.00 0.00 H new ATOM 0 HA ARG A 97 10.217 3.445 -3.737 1.00 0.00 H new ATOM 0 HB2 ARG A 97 8.941 4.539 -6.277 1.00 0.00 H new ATOM 0 HB3 ARG A 97 8.025 3.873 -4.940 1.00 0.00 H new ATOM 0 HG2 ARG A 97 9.808 5.701 -3.722 1.00 0.00 H new ATOM 0 HG3 ARG A 97 9.296 6.510 -5.190 1.00 0.00 H new ATOM 0 HD2 ARG A 97 6.919 6.197 -4.590 1.00 0.00 H new ATOM 0 HD3 ARG A 97 7.364 5.248 -3.186 1.00 0.00 H new ATOM 0 HE ARG A 97 7.910 7.220 -2.016 1.00 0.00 H new ATOM 0 HH11 ARG A 97 7.587 7.897 -5.482 1.00 0.00 H new ATOM 0 HH12 ARG A 97 7.674 9.649 -5.271 1.00 0.00 H new ATOM 0 HH21 ARG A 97 8.027 9.484 -1.742 1.00 0.00 H new ATOM 0 HH22 ARG A 97 7.925 10.550 -3.147 1.00 0.00 H new ATOM 1153 N ASN A 98 9.952 1.116 -4.496 1.00 0.00 N ATOM 1154 CA ASN A 98 9.761 -0.269 -4.893 1.00 0.00 C ATOM 1155 C ASN A 98 8.477 -0.805 -4.258 1.00 0.00 C ATOM 1156 O ASN A 98 8.302 -0.728 -3.042 1.00 0.00 O ATOM 1157 CB ASN A 98 10.923 -1.143 -4.419 1.00 0.00 C ATOM 1158 CG ASN A 98 11.503 -0.619 -3.105 1.00 0.00 C ATOM 1159 OD1 ASN A 98 12.404 0.204 -3.078 1.00 0.00 O ATOM 1160 ND2 ASN A 98 10.939 -1.139 -2.019 1.00 0.00 N ATOM 0 H ASN A 98 10.099 1.257 -3.497 1.00 0.00 H new ATOM 0 HA ASN A 98 9.705 -0.303 -5.981 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.580 -2.169 -4.286 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.702 -1.164 -5.182 1.00 0.00 H new ATOM 0 HD21 ASN A 98 11.256 -0.853 -1.093 1.00 0.00 H new ATOM 0 HD22 ASN A 98 10.189 -1.824 -2.112 1.00 0.00 H new ATOM 1166 N ALA A 99 7.609 -1.335 -5.108 1.00 0.00 N ATOM 1167 CA ALA A 99 6.346 -1.883 -4.644 1.00 0.00 C ATOM 1168 C ALA A 99 5.477 -2.239 -5.852 1.00 0.00 C ATOM 1169 O ALA A 99 5.014 -1.355 -6.571 1.00 0.00 O ATOM 1170 CB ALA A 99 5.666 -0.880 -3.711 1.00 0.00 C ATOM 0 H ALA A 99 7.756 -1.396 -6.115 1.00 0.00 H new ATOM 0 HA ALA A 99 6.510 -2.798 -4.074 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.718 -1.291 -3.363 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.312 -0.683 -2.856 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.482 0.050 -4.249 1.00 0.00 H new ATOM 1176 N TYR A 100 5.280 -3.537 -6.037 1.00 0.00 N ATOM 1177 CA TYR A 100 4.473 -4.020 -7.143 1.00 0.00 C ATOM 1178 C TYR A 100 3.072 -4.412 -6.672 1.00 0.00 C ATOM 1179 O TYR A 100 2.913 -4.987 -5.596 1.00 0.00 O ATOM 1180 CB TYR A 100 5.187 -5.266 -7.672 1.00 0.00 C ATOM 1181 CG TYR A 100 4.277 -6.488 -7.823 1.00 0.00 C ATOM 1182 CD1 TYR A 100 3.169 -6.425 -8.644 1.00 0.00 C ATOM 1183 CD2 TYR A 100 4.564 -7.651 -7.138 1.00 0.00 C ATOM 1184 CE1 TYR A 100 2.314 -7.575 -8.786 1.00 0.00 C ATOM 1185 CE2 TYR A 100 3.708 -8.800 -7.280 1.00 0.00 C ATOM 1186 CZ TYR A 100 2.625 -8.706 -8.097 1.00 0.00 C ATOM 1187 OH TYR A 100 1.816 -9.791 -8.231 1.00 0.00 O ATOM 0 H TYR A 100 5.666 -4.268 -5.439 1.00 0.00 H new ATOM 0 HA TYR A 100 4.362 -3.246 -7.903 1.00 0.00 H new ATOM 0 HB2 TYR A 100 5.631 -5.034 -8.640 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.006 -5.517 -6.998 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.944 -5.514 -9.179 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.431 -7.699 -6.495 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.445 -7.540 -9.426 1.00 0.00 H new ATOM 0 HE2 TYR A 100 3.921 -9.716 -6.749 1.00 0.00 H new ATOM 0 HH TYR A 100 2.161 -10.526 -7.682 1.00 0.00 H new ATOM 1196 N ARG A 101 2.090 -4.084 -7.499 1.00 0.00 N ATOM 1197 CA ARG A 101 0.707 -4.393 -7.180 1.00 0.00 C ATOM 1198 C ARG A 101 -0.088 -4.654 -8.461 1.00 0.00 C ATOM 1199 O ARG A 101 -0.142 -3.803 -9.347 1.00 0.00 O ATOM 1200 CB ARG A 101 0.050 -3.248 -6.406 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.308 -3.683 -4.982 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.749 -3.300 -4.639 1.00 0.00 C ATOM 1203 NE ARG A 101 -1.761 -2.086 -3.793 1.00 0.00 N ATOM 1204 CZ ARG A 101 -1.609 -2.096 -2.461 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -1.432 -3.257 -1.816 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -1.634 -0.946 -1.775 1.00 0.00 N ATOM 0 H ARG A 101 2.225 -3.607 -8.390 1.00 0.00 H new ATOM 0 HA ARG A 101 0.703 -5.287 -6.557 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.726 -2.394 -6.370 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.850 -2.921 -6.927 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.181 -4.761 -4.884 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.375 -3.216 -4.272 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -2.314 -3.122 -5.554 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.238 -4.122 -4.117 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.893 -1.185 -4.252 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.413 -4.133 -2.338 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -1.316 -3.265 -0.803 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -1.769 -0.062 -2.266 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -1.518 -0.954 -0.762 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.686 -5.835 -8.517 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.476 -6.220 -9.675 1.00 0.00 C ATOM 1219 C GLU A 102 -2.957 -5.931 -9.427 1.00 0.00 C ATOM 1220 O GLU A 102 -3.406 -5.909 -8.281 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.255 -7.693 -10.025 1.00 0.00 C ATOM 1222 CG GLU A 102 -1.420 -8.580 -8.789 1.00 0.00 C ATOM 1223 CD GLU A 102 -2.059 -9.921 -9.158 1.00 0.00 C ATOM 1224 OE1 GLU A 102 -1.365 -10.713 -9.832 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -3.224 -10.123 -8.758 1.00 0.00 O ATOM 0 H GLU A 102 -0.640 -6.538 -7.779 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.148 -5.626 -10.528 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.965 -7.998 -10.794 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.257 -7.826 -10.442 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -0.448 -8.751 -8.327 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.038 -8.070 -8.050 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.677 -5.716 -10.518 1.00 0.00 N ATOM 1231 CA CYS A 103 -5.099 -5.430 -10.433 1.00 0.00 C ATOM 1232 C CYS A 103 -5.864 -6.616 -11.025 1.00 0.00 C ATOM 1233 O CYS A 103 -5.660 -6.974 -12.183 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.454 -4.116 -11.131 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.068 -2.798 -10.020 1.00 0.00 S ATOM 0 H CYS A 103 -3.302 -5.734 -11.466 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.385 -5.299 -9.389 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.571 -3.749 -11.654 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.212 -4.316 -11.888 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.729 -7.191 -10.202 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.526 -8.328 -10.631 1.00 0.00 C ATOM 1241 C LEU A 104 -8.441 -7.901 -11.781 1.00 0.00 C ATOM 1242 O LEU A 104 -8.453 -6.733 -12.166 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.275 -8.935 -9.442 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.518 -10.002 -8.646 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -7.917 -9.970 -7.170 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.714 -11.387 -9.264 1.00 0.00 C ATOM 0 H LEU A 104 -6.895 -6.891 -9.241 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.883 -9.121 -11.013 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.550 -8.129 -8.761 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.203 -9.374 -9.808 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.453 -9.775 -8.696 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.365 -10.737 -6.627 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.684 -8.991 -6.751 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.987 -10.159 -7.078 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.166 -12.127 -8.680 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.775 -11.638 -9.265 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -7.341 -11.385 -10.288 1.00 0.00 H new ATOM 1257 N GLU A 105 -9.183 -8.870 -12.294 1.00 0.00 N ATOM 1258 CA GLU A 105 -10.099 -8.610 -13.393 1.00 0.00 C ATOM 1259 C GLU A 105 -11.435 -8.093 -12.857 1.00 0.00 C ATOM 1260 O GLU A 105 -12.360 -7.837 -13.627 1.00 0.00 O ATOM 1261 CB GLU A 105 -10.297 -9.861 -14.249 1.00 0.00 C ATOM 1262 CG GLU A 105 -10.121 -9.543 -15.735 1.00 0.00 C ATOM 1263 CD GLU A 105 -10.322 -10.794 -16.591 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -11.213 -11.593 -16.229 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -9.580 -10.924 -17.590 1.00 0.00 O ATOM 0 H GLU A 105 -9.169 -9.837 -11.970 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.664 -7.841 -14.031 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.581 -10.627 -13.950 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.293 -10.270 -14.077 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.835 -8.775 -16.033 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.125 -9.136 -15.908 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.495 -7.953 -11.540 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.704 -7.471 -10.894 1.00 0.00 C ATOM 1272 C ASN A 106 -12.558 -5.976 -10.600 1.00 0.00 C ATOM 1273 O ASN A 106 -13.470 -5.356 -10.056 1.00 0.00 O ATOM 1274 CB ASN A 106 -12.943 -8.192 -9.567 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.289 -8.918 -9.571 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -15.241 -8.520 -8.920 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -14.316 -10.003 -10.340 1.00 0.00 N ATOM 0 H ASN A 106 -10.726 -8.165 -10.904 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.543 -7.660 -11.564 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.141 -8.908 -9.389 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.916 -7.473 -8.749 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.170 -10.557 -10.411 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -13.483 -10.281 -10.859 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.405 -5.441 -10.975 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.128 -4.031 -10.759 1.00 0.00 C ATOM 1285 C GLY A 107 -10.679 -3.776 -9.319 1.00 0.00 C ATOM 1286 O GLY A 107 -11.007 -2.742 -8.737 1.00 0.00 O ATOM 0 H GLY A 107 -10.652 -5.959 -11.427 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.353 -3.699 -11.450 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.021 -3.444 -10.975 1.00 0.00 H new ATOM 1290 N THR A 108 -9.936 -4.734 -8.786 1.00 0.00 N ATOM 1291 CA THR A 108 -9.437 -4.625 -7.425 1.00 0.00 C ATOM 1292 C THR A 108 -7.907 -4.624 -7.415 1.00 0.00 C ATOM 1293 O THR A 108 -7.277 -4.921 -8.429 1.00 0.00 O ATOM 1294 CB THR A 108 -10.049 -5.763 -6.605 1.00 0.00 C ATOM 1295 OG1 THR A 108 -9.559 -6.945 -7.232 1.00 0.00 O ATOM 1296 CG2 THR A 108 -11.567 -5.854 -6.772 1.00 0.00 C ATOM 0 H THR A 108 -9.667 -5.590 -9.272 1.00 0.00 H new ATOM 0 HA THR A 108 -9.734 -3.680 -6.970 1.00 0.00 H new ATOM 0 HB THR A 108 -9.808 -5.622 -5.551 1.00 0.00 H new ATOM 0 HG1 THR A 108 -9.906 -7.732 -6.762 1.00 0.00 H new ATOM 0 HG21 THR A 108 -11.951 -6.677 -6.169 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.026 -4.921 -6.445 1.00 0.00 H new ATOM 0 HG23 THR A 108 -11.808 -6.029 -7.821 1.00 0.00 H new ATOM 1304 N TRP A 109 -7.355 -4.287 -6.259 1.00 0.00 N ATOM 1305 CA TRP A 109 -5.911 -4.243 -6.104 1.00 0.00 C ATOM 1306 C TRP A 109 -5.446 -5.615 -5.613 1.00 0.00 C ATOM 1307 O TRP A 109 -6.240 -6.551 -5.533 1.00 0.00 O ATOM 1308 CB TRP A 109 -5.493 -3.102 -5.174 1.00 0.00 C ATOM 1309 CG TRP A 109 -5.300 -1.759 -5.883 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -5.934 -0.603 -5.648 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -4.381 -1.481 -6.960 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -5.493 0.397 -6.490 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -4.518 -0.154 -7.313 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -3.463 -2.322 -7.614 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -3.770 0.450 -8.331 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -2.723 -1.704 -8.629 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -2.849 -0.369 -8.997 1.00 0.00 C ATOM 0 H TRP A 109 -7.882 -4.042 -5.421 1.00 0.00 H new ATOM 0 HA TRP A 109 -5.428 -4.032 -7.058 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -6.248 -2.985 -4.397 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.563 -3.375 -4.676 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -6.695 -0.470 -4.894 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -5.822 1.362 -6.506 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -3.339 -3.363 -7.354 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -3.896 1.491 -8.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -2.004 -2.306 -9.164 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -2.240 0.034 -9.792 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.162 -5.691 -5.296 1.00 0.00 N ATOM 1328 CA ALA A 110 -3.583 -6.934 -4.815 1.00 0.00 C ATOM 1329 C ALA A 110 -3.837 -7.061 -3.312 1.00 0.00 C ATOM 1330 O ALA A 110 -4.621 -6.302 -2.744 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.093 -6.969 -5.159 1.00 0.00 C ATOM 0 H ALA A 110 -3.506 -4.912 -5.363 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.051 -7.790 -5.302 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -1.658 -7.901 -4.798 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -1.967 -6.904 -6.240 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -1.590 -6.127 -4.684 1.00 0.00 H new ATOM 1337 N SER A 111 -3.158 -8.027 -2.710 1.00 0.00 N ATOM 1338 CA SER A 111 -3.301 -8.264 -1.283 1.00 0.00 C ATOM 1339 C SER A 111 -2.379 -7.325 -0.502 1.00 0.00 C ATOM 1340 O SER A 111 -2.844 -6.526 0.310 1.00 0.00 O ATOM 1341 CB SER A 111 -2.995 -9.721 -0.933 1.00 0.00 C ATOM 1342 OG SER A 111 -4.153 -10.547 -1.025 1.00 0.00 O ATOM 0 H SER A 111 -2.508 -8.654 -3.184 1.00 0.00 H new ATOM 0 HA SER A 111 -4.335 -8.062 -1.005 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.225 -10.101 -1.604 1.00 0.00 H new ATOM 0 HB3 SER A 111 -2.591 -9.774 0.078 1.00 0.00 H new ATOM 0 HG SER A 111 -3.916 -11.470 -0.796 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.089 -7.453 -0.774 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.097 -6.627 -0.108 1.00 0.00 C ATOM 1349 C ARG A 112 0.943 -6.130 -1.114 1.00 0.00 C ATOM 1350 O ARG A 112 1.478 -6.913 -1.896 1.00 0.00 O ATOM 1351 CB ARG A 112 0.609 -7.404 1.005 1.00 0.00 C ATOM 1352 CG ARG A 112 0.584 -6.622 2.321 1.00 0.00 C ATOM 1353 CD ARG A 112 0.911 -7.534 3.506 1.00 0.00 C ATOM 1354 NE ARG A 112 2.195 -7.125 4.118 1.00 0.00 N ATOM 1355 CZ ARG A 112 2.668 -7.618 5.271 1.00 0.00 C ATOM 1356 NH1 ARG A 112 1.965 -8.542 5.943 1.00 0.00 N ATOM 1357 NH2 ARG A 112 3.842 -7.188 5.753 1.00 0.00 N ATOM 0 H ARG A 112 -0.708 -8.117 -1.447 1.00 0.00 H new ATOM 0 HA ARG A 112 -0.616 -5.776 0.332 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.124 -8.370 1.143 1.00 0.00 H new ATOM 0 HB3 ARG A 112 1.641 -7.604 0.716 1.00 0.00 H new ATOM 0 HG2 ARG A 112 1.304 -5.805 2.277 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.399 -6.173 2.463 1.00 0.00 H new ATOM 0 HD2 ARG A 112 0.113 -7.483 4.246 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.971 -8.570 3.173 1.00 0.00 H new ATOM 0 HE ARG A 112 2.755 -6.424 3.632 1.00 0.00 H new ATOM 0 HH11 ARG A 112 1.071 -8.869 5.576 1.00 0.00 H new ATOM 0 HH12 ARG A 112 2.324 -8.918 6.821 1.00 0.00 H new ATOM 0 HH21 ARG A 112 4.376 -6.485 5.242 1.00 0.00 H new ATOM 0 HH22 ARG A 112 4.201 -7.564 6.631 1.00 0.00 H new ATOM 1368 N VAL A 113 1.199 -4.831 -1.060 1.00 0.00 N ATOM 1369 CA VAL A 113 2.166 -4.220 -1.956 1.00 0.00 C ATOM 1370 C VAL A 113 3.576 -4.445 -1.408 1.00 0.00 C ATOM 1371 O VAL A 113 3.752 -5.124 -0.398 1.00 0.00 O ATOM 1372 CB VAL A 113 1.831 -2.741 -2.158 1.00 0.00 C ATOM 1373 CG1 VAL A 113 2.332 -1.900 -0.982 1.00 0.00 C ATOM 1374 CG2 VAL A 113 2.400 -2.226 -3.481 1.00 0.00 C ATOM 0 H VAL A 113 0.753 -4.184 -0.409 1.00 0.00 H new ATOM 0 HA VAL A 113 2.122 -4.686 -2.940 1.00 0.00 H new ATOM 0 HB VAL A 113 0.746 -2.646 -2.200 1.00 0.00 H new ATOM 0 HG11 VAL A 113 2.081 -0.853 -1.151 1.00 0.00 H new ATOM 0 HG12 VAL A 113 1.859 -2.243 -0.062 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.413 -2.004 -0.895 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.148 -1.172 -3.600 1.00 0.00 H new ATOM 0 HG22 VAL A 113 3.484 -2.342 -3.481 1.00 0.00 H new ATOM 0 HG23 VAL A 113 1.975 -2.796 -4.307 1.00 0.00 H new ATOM 1384 N ASN A 114 4.545 -3.861 -2.098 1.00 0.00 N ATOM 1385 CA ASN A 114 5.935 -3.990 -1.692 1.00 0.00 C ATOM 1386 C ASN A 114 6.499 -5.305 -2.232 1.00 0.00 C ATOM 1387 O ASN A 114 7.415 -5.301 -3.054 1.00 0.00 O ATOM 1388 CB ASN A 114 6.064 -4.009 -0.168 1.00 0.00 C ATOM 1389 CG ASN A 114 7.333 -3.284 0.283 1.00 0.00 C ATOM 1390 OD1 ASN A 114 8.414 -3.847 0.337 1.00 0.00 O ATOM 1391 ND2 ASN A 114 7.142 -2.008 0.603 1.00 0.00 N ATOM 0 H ASN A 114 4.395 -3.298 -2.935 1.00 0.00 H new ATOM 0 HA ASN A 114 6.483 -3.136 -2.089 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.191 -3.535 0.280 1.00 0.00 H new ATOM 0 HB3 ASN A 114 6.084 -5.040 0.186 1.00 0.00 H new ATOM 0 HD21 ASN A 114 7.927 -1.438 0.917 1.00 0.00 H new ATOM 0 HD22 ASN A 114 6.210 -1.599 0.535 1.00 0.00 H new ATOM 1397 N TYR A 115 5.931 -6.399 -1.747 1.00 0.00 N ATOM 1398 CA TYR A 115 6.366 -7.720 -2.170 1.00 0.00 C ATOM 1399 C TYR A 115 7.866 -7.905 -1.931 1.00 0.00 C ATOM 1400 O TYR A 115 8.684 -7.204 -2.524 1.00 0.00 O ATOM 1401 CB TYR A 115 6.089 -7.793 -3.674 1.00 0.00 C ATOM 1402 CG TYR A 115 4.611 -7.978 -4.025 1.00 0.00 C ATOM 1403 CD1 TYR A 115 3.745 -6.905 -3.952 1.00 0.00 C ATOM 1404 CD2 TYR A 115 4.144 -9.216 -4.416 1.00 0.00 C ATOM 1405 CE1 TYR A 115 2.355 -7.078 -4.283 1.00 0.00 C ATOM 1406 CE2 TYR A 115 2.753 -9.390 -4.748 1.00 0.00 C ATOM 1407 CZ TYR A 115 1.928 -8.312 -4.665 1.00 0.00 C ATOM 1408 OH TYR A 115 0.614 -8.476 -4.978 1.00 0.00 O ATOM 0 H TYR A 115 5.173 -6.398 -1.065 1.00 0.00 H new ATOM 0 HA TYR A 115 5.842 -8.495 -1.610 1.00 0.00 H new ATOM 0 HB2 TYR A 115 6.452 -6.880 -4.145 1.00 0.00 H new ATOM 0 HB3 TYR A 115 6.659 -8.619 -4.099 1.00 0.00 H new ATOM 0 HD1 TYR A 115 4.111 -5.936 -3.646 1.00 0.00 H new ATOM 0 HD2 TYR A 115 4.822 -10.055 -4.473 1.00 0.00 H new ATOM 0 HE1 TYR A 115 1.667 -6.247 -4.229 1.00 0.00 H new ATOM 0 HE2 TYR A 115 2.374 -10.354 -5.055 1.00 0.00 H new ATOM 0 HH TYR A 115 0.453 -9.408 -5.234 1.00 0.00 H new ATOM 1417 N SER A 116 8.181 -8.853 -1.061 1.00 0.00 N ATOM 1418 CA SER A 116 9.567 -9.140 -0.735 1.00 0.00 C ATOM 1419 C SER A 116 10.210 -9.956 -1.858 1.00 0.00 C ATOM 1420 O SER A 116 11.379 -10.329 -1.768 1.00 0.00 O ATOM 1421 CB SER A 116 9.678 -9.887 0.595 1.00 0.00 C ATOM 1422 OG SER A 116 9.149 -11.208 0.511 1.00 0.00 O ATOM 0 H SER A 116 7.499 -9.433 -0.571 1.00 0.00 H new ATOM 0 HA SER A 116 10.097 -8.193 -0.633 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.724 -9.934 0.898 1.00 0.00 H new ATOM 0 HB3 SER A 116 9.146 -9.332 1.368 1.00 0.00 H new ATOM 0 HG SER A 116 9.240 -11.653 1.380 1.00 0.00 H new ATOM 1427 N HIS A 117 9.419 -10.211 -2.889 1.00 0.00 N ATOM 1428 CA HIS A 117 9.896 -10.978 -4.028 1.00 0.00 C ATOM 1429 C HIS A 117 10.468 -10.027 -5.082 1.00 0.00 C ATOM 1430 O HIS A 117 10.507 -10.358 -6.266 1.00 0.00 O ATOM 1431 CB HIS A 117 8.789 -11.877 -4.581 1.00 0.00 C ATOM 1432 CG HIS A 117 8.238 -12.861 -3.576 1.00 0.00 C ATOM 1433 ND1 HIS A 117 9.049 -13.628 -2.758 1.00 0.00 N ATOM 1434 CD2 HIS A 117 6.953 -13.194 -3.266 1.00 0.00 C ATOM 1435 CE1 HIS A 117 8.275 -14.386 -1.994 1.00 0.00 C ATOM 1436 NE2 HIS A 117 6.977 -14.115 -2.311 1.00 0.00 N ATOM 0 H HIS A 117 8.450 -9.900 -2.960 1.00 0.00 H new ATOM 0 HA HIS A 117 10.700 -11.643 -3.712 1.00 0.00 H new ATOM 0 HB2 HIS A 117 7.975 -11.251 -4.945 1.00 0.00 H new ATOM 0 HB3 HIS A 117 9.176 -12.427 -5.438 1.00 0.00 H new ATOM 0 HD2 HIS A 117 6.066 -12.779 -3.721 1.00 0.00 H new ATOM 0 HE1 HIS A 117 8.613 -15.094 -1.251 1.00 0.00 H new ATOM 0 HE2 HIS A 117 6.159 -14.549 -1.884 1.00 0.00 H new ATOM 1443 N CYS A 118 10.899 -8.865 -4.612 1.00 0.00 N ATOM 1444 CA CYS A 118 11.468 -7.864 -5.499 1.00 0.00 C ATOM 1445 C CYS A 118 12.801 -8.397 -6.032 1.00 0.00 C ATOM 1446 O CYS A 118 13.863 -7.900 -5.662 1.00 0.00 O ATOM 1447 CB CYS A 118 11.632 -6.515 -4.799 1.00 0.00 C ATOM 1448 SG CYS A 118 12.779 -5.353 -5.627 1.00 0.00 S ATOM 0 H CYS A 118 10.866 -8.595 -3.629 1.00 0.00 H new ATOM 0 HA CYS A 118 10.789 -7.685 -6.333 1.00 0.00 H new ATOM 0 HB2 CYS A 118 10.653 -6.042 -4.719 1.00 0.00 H new ATOM 0 HB3 CYS A 118 11.985 -6.690 -3.783 1.00 0.00 H new ATOM 1452 N GLU A 119 12.699 -9.399 -6.893 1.00 0.00 N ATOM 1453 CA GLU A 119 13.882 -10.004 -7.480 1.00 0.00 C ATOM 1454 C GLU A 119 14.810 -10.529 -6.382 1.00 0.00 C ATOM 1455 O GLU A 119 15.654 -9.794 -5.873 1.00 0.00 O ATOM 1456 CB GLU A 119 14.613 -9.011 -8.386 1.00 0.00 C ATOM 1457 CG GLU A 119 13.741 -8.612 -9.577 1.00 0.00 C ATOM 1458 CD GLU A 119 14.271 -9.224 -10.875 1.00 0.00 C ATOM 1459 OE1 GLU A 119 14.016 -10.431 -11.079 1.00 0.00 O ATOM 1460 OE2 GLU A 119 14.919 -8.472 -11.635 1.00 0.00 O ATOM 0 H GLU A 119 11.815 -9.807 -7.198 1.00 0.00 H new ATOM 0 HA GLU A 119 13.568 -10.846 -8.097 1.00 0.00 H new ATOM 0 HB2 GLU A 119 14.883 -8.123 -7.815 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.542 -9.455 -8.743 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.716 -8.941 -9.408 1.00 0.00 H new ATOM 0 HG3 GLU A 119 13.716 -7.526 -9.666 1.00 0.00 H new ATOM 1465 N PRO A 120 14.617 -11.832 -6.042 1.00 0.00 N ATOM 1466 CA PRO A 120 15.426 -12.465 -5.014 1.00 0.00 C ATOM 1467 C PRO A 120 16.831 -12.773 -5.536 1.00 0.00 C ATOM 1468 O PRO A 120 16.986 -13.337 -6.618 1.00 0.00 O ATOM 1469 CB PRO A 120 14.653 -13.711 -4.616 1.00 0.00 C ATOM 1470 CG PRO A 120 13.680 -13.979 -5.753 1.00 0.00 C ATOM 1471 CD PRO A 120 13.627 -12.734 -6.623 1.00 0.00 C ATOM 0 HA PRO A 120 15.588 -11.821 -4.149 1.00 0.00 H new ATOM 0 HB2 PRO A 120 15.325 -14.557 -4.469 1.00 0.00 H new ATOM 0 HB3 PRO A 120 14.123 -13.558 -3.676 1.00 0.00 H new ATOM 0 HG2 PRO A 120 14.004 -14.840 -6.338 1.00 0.00 H new ATOM 0 HG3 PRO A 120 12.690 -14.214 -5.361 1.00 0.00 H new ATOM 0 HD2 PRO A 120 13.864 -12.966 -7.661 1.00 0.00 H new ATOM 0 HD3 PRO A 120 12.632 -12.288 -6.615 1.00 0.00 H new ATOM 1476 N ILE A 121 17.820 -12.391 -4.741 1.00 0.00 N ATOM 1477 CA ILE A 121 19.207 -12.620 -5.108 1.00 0.00 C ATOM 1478 C ILE A 121 19.413 -14.106 -5.405 1.00 0.00 C ATOM 1479 O ILE A 121 19.698 -14.890 -4.500 1.00 0.00 O ATOM 1480 CB ILE A 121 20.145 -12.071 -4.030 1.00 0.00 C ATOM 1481 CG1 ILE A 121 19.851 -10.597 -3.747 1.00 0.00 C ATOM 1482 CG2 ILE A 121 21.609 -12.302 -4.408 1.00 0.00 C ATOM 1483 CD1 ILE A 121 19.931 -9.766 -5.029 1.00 0.00 C ATOM 0 H ILE A 121 17.688 -11.924 -3.844 1.00 0.00 H new ATOM 0 HA ILE A 121 19.455 -12.076 -6.019 1.00 0.00 H new ATOM 0 HB ILE A 121 19.961 -12.619 -3.106 1.00 0.00 H new ATOM 0 HG12 ILE A 121 18.859 -10.498 -3.307 1.00 0.00 H new ATOM 0 HG13 ILE A 121 20.563 -10.214 -3.016 1.00 0.00 H new ATOM 0 HG21 ILE A 121 22.254 -11.903 -3.625 1.00 0.00 H new ATOM 0 HG22 ILE A 121 21.792 -13.371 -4.519 1.00 0.00 H new ATOM 0 HG23 ILE A 121 21.826 -11.797 -5.350 1.00 0.00 H new ATOM 0 HD11 ILE A 121 19.718 -8.722 -4.800 1.00 0.00 H new ATOM 0 HD12 ILE A 121 20.932 -9.847 -5.453 1.00 0.00 H new ATOM 0 HD13 ILE A 121 19.201 -10.136 -5.749 1.00 0.00 H new ATOM 1494 N LEU A 122 19.260 -14.451 -6.675 1.00 0.00 N ATOM 1495 CA LEU A 122 19.425 -15.830 -7.102 1.00 0.00 C ATOM 1496 C LEU A 122 19.309 -15.906 -8.625 1.00 0.00 C ATOM 1497 O LEU A 122 18.657 -16.802 -9.158 1.00 0.00 O ATOM 1498 CB LEU A 122 18.442 -16.740 -6.364 1.00 0.00 C ATOM 1499 CG LEU A 122 16.961 -16.521 -6.676 1.00 0.00 C ATOM 1500 CD1 LEU A 122 16.503 -17.424 -7.824 1.00 0.00 C ATOM 1501 CD2 LEU A 122 16.103 -16.708 -5.423 1.00 0.00 C ATOM 0 H LEU A 122 19.023 -13.799 -7.423 1.00 0.00 H new ATOM 0 HA LEU A 122 20.419 -16.193 -6.840 1.00 0.00 H new ATOM 0 HB2 LEU A 122 18.692 -17.775 -6.596 1.00 0.00 H new ATOM 0 HB3 LEU A 122 18.590 -16.608 -5.292 1.00 0.00 H new ATOM 0 HG LEU A 122 16.830 -15.490 -7.005 1.00 0.00 H new ATOM 0 HD11 LEU A 122 15.446 -17.248 -8.026 1.00 0.00 H new ATOM 0 HD12 LEU A 122 17.085 -17.200 -8.718 1.00 0.00 H new ATOM 0 HD13 LEU A 122 16.651 -18.468 -7.547 1.00 0.00 H new ATOM 0 HD21 LEU A 122 15.054 -16.547 -5.673 1.00 0.00 H new ATOM 0 HD22 LEU A 122 16.233 -17.720 -5.041 1.00 0.00 H new ATOM 0 HD23 LEU A 122 16.409 -15.990 -4.662 1.00 0.00 H new ATOM 1512 N ASP A 123 19.951 -14.951 -9.284 1.00 0.00 N ATOM 1513 CA ASP A 123 19.927 -14.898 -10.736 1.00 0.00 C ATOM 1514 C ASP A 123 21.207 -15.531 -11.285 1.00 0.00 C ATOM 1515 O ASP A 123 21.979 -16.128 -10.538 1.00 0.00 O ATOM 1516 CB ASP A 123 19.863 -13.452 -11.233 1.00 0.00 C ATOM 1517 CG ASP A 123 19.051 -13.245 -12.513 1.00 0.00 C ATOM 1518 OD1 ASP A 123 18.629 -14.270 -13.090 1.00 0.00 O ATOM 1519 OD2 ASP A 123 18.872 -12.065 -12.887 1.00 0.00 O ATOM 0 H ASP A 123 20.490 -14.209 -8.839 1.00 0.00 H new ATOM 0 HA ASP A 123 19.044 -15.436 -11.080 1.00 0.00 H new ATOM 0 HB2 ASP A 123 19.436 -12.831 -10.445 1.00 0.00 H new ATOM 0 HB3 ASP A 123 20.879 -13.097 -11.404 1.00 0.00 H new ATOM 1523 N ASP A 124 21.390 -15.380 -12.589 1.00 0.00 N ATOM 1524 CA ASP A 124 22.563 -15.930 -13.248 1.00 0.00 C ATOM 1525 C ASP A 124 22.579 -17.449 -13.068 1.00 0.00 C ATOM 1526 O ASP A 124 21.979 -17.972 -12.131 1.00 0.00 O ATOM 1527 CB ASP A 124 23.851 -15.369 -12.641 1.00 0.00 C ATOM 1528 CG ASP A 124 23.928 -13.841 -12.589 1.00 0.00 C ATOM 1529 OD1 ASP A 124 23.441 -13.215 -13.555 1.00 0.00 O ATOM 1530 OD2 ASP A 124 24.474 -13.334 -11.586 1.00 0.00 O ATOM 0 H ASP A 124 20.746 -14.885 -13.206 1.00 0.00 H new ATOM 0 HA ASP A 124 22.514 -15.660 -14.303 1.00 0.00 H new ATOM 0 HB2 ASP A 124 23.957 -15.758 -11.628 1.00 0.00 H new ATOM 0 HB3 ASP A 124 24.699 -15.741 -13.216 1.00 0.00 H new ATOM 1534 N LYS A 125 23.272 -18.114 -13.981 1.00 0.00 N ATOM 1535 CA LYS A 125 23.374 -19.563 -13.934 1.00 0.00 C ATOM 1536 C LYS A 125 23.713 -20.000 -12.508 1.00 0.00 C ATOM 1537 O LYS A 125 24.166 -19.193 -11.698 1.00 0.00 O ATOM 1538 CB LYS A 125 24.368 -20.064 -14.983 1.00 0.00 C ATOM 1539 CG LYS A 125 23.697 -21.036 -15.954 1.00 0.00 C ATOM 1540 CD LYS A 125 24.690 -22.092 -16.447 1.00 0.00 C ATOM 1541 CE LYS A 125 25.100 -21.823 -17.897 1.00 0.00 C ATOM 1542 NZ LYS A 125 26.551 -22.055 -18.076 1.00 0.00 N ATOM 0 H LYS A 125 23.768 -17.676 -14.757 1.00 0.00 H new ATOM 0 HA LYS A 125 22.418 -20.021 -14.189 1.00 0.00 H new ATOM 0 HB2 LYS A 125 24.777 -19.218 -15.535 1.00 0.00 H new ATOM 0 HB3 LYS A 125 25.205 -20.557 -14.489 1.00 0.00 H new ATOM 0 HG2 LYS A 125 22.856 -21.524 -15.462 1.00 0.00 H new ATOM 0 HG3 LYS A 125 23.294 -20.486 -16.804 1.00 0.00 H new ATOM 0 HD2 LYS A 125 25.574 -22.091 -15.809 1.00 0.00 H new ATOM 0 HD3 LYS A 125 24.242 -23.083 -16.370 1.00 0.00 H new ATOM 0 HE2 LYS A 125 24.536 -22.472 -18.567 1.00 0.00 H new ATOM 0 HE3 LYS A 125 24.854 -20.796 -18.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 26.813 -21.868 -19.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 27.084 -21.418 -17.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 26.777 -23.042 -17.839 1.00 0.00 H new ATOM 1552 N GLN A 126 23.479 -21.277 -12.243 1.00 0.00 N ATOM 1553 CA GLN A 126 23.754 -21.832 -10.928 1.00 0.00 C ATOM 1554 C GLN A 126 24.647 -23.068 -11.049 1.00 0.00 C ATOM 1555 O GLN A 126 24.990 -23.484 -12.155 1.00 0.00 O ATOM 1556 CB GLN A 126 22.455 -22.165 -10.192 1.00 0.00 C ATOM 1557 CG GLN A 126 22.207 -21.181 -9.046 1.00 0.00 C ATOM 1558 CD GLN A 126 21.659 -21.901 -7.813 1.00 0.00 C ATOM 1559 OE1 GLN A 126 22.390 -22.328 -6.936 1.00 0.00 O ATOM 1560 NE2 GLN A 126 20.334 -22.014 -7.797 1.00 0.00 N ATOM 0 H GLN A 126 23.102 -21.944 -12.917 1.00 0.00 H new ATOM 0 HA GLN A 126 24.284 -21.081 -10.342 1.00 0.00 H new ATOM 0 HB2 GLN A 126 21.619 -22.134 -10.890 1.00 0.00 H new ATOM 0 HB3 GLN A 126 22.505 -23.181 -9.800 1.00 0.00 H new ATOM 0 HG2 GLN A 126 23.137 -20.673 -8.791 1.00 0.00 H new ATOM 0 HG3 GLN A 126 21.502 -20.414 -9.367 1.00 0.00 H new ATOM 0 HE21 GLN A 126 19.780 -21.633 -8.565 1.00 0.00 H new ATOM 0 HE22 GLN A 126 19.871 -22.481 -7.017 1.00 0.00 H new ATOM 1567 N ARG A 127 24.997 -23.621 -9.898 1.00 0.00 N ATOM 1568 CA ARG A 127 25.844 -24.801 -9.861 1.00 0.00 C ATOM 1569 C ARG A 127 27.220 -24.486 -10.452 1.00 0.00 C ATOM 1570 O ARG A 127 27.323 -23.777 -11.451 1.00 0.00 O ATOM 1571 CB ARG A 127 25.214 -25.956 -10.642 1.00 0.00 C ATOM 1572 CG ARG A 127 25.102 -27.209 -9.773 1.00 0.00 C ATOM 1573 CD ARG A 127 26.212 -28.209 -10.107 1.00 0.00 C ATOM 1574 NE ARG A 127 25.975 -29.484 -9.393 1.00 0.00 N ATOM 1575 CZ ARG A 127 24.975 -30.328 -9.676 1.00 0.00 C ATOM 1576 NH1 ARG A 127 24.111 -30.040 -10.658 1.00 0.00 N ATOM 1577 NH2 ARG A 127 24.837 -31.464 -8.975 1.00 0.00 N ATOM 0 H ARG A 127 24.709 -23.274 -8.983 1.00 0.00 H new ATOM 0 HA ARG A 127 25.952 -25.099 -8.818 1.00 0.00 H new ATOM 0 HB2 ARG A 127 24.225 -25.664 -10.995 1.00 0.00 H new ATOM 0 HB3 ARG A 127 25.816 -26.174 -11.524 1.00 0.00 H new ATOM 0 HG2 ARG A 127 25.161 -26.932 -8.720 1.00 0.00 H new ATOM 0 HG3 ARG A 127 24.129 -27.676 -9.925 1.00 0.00 H new ATOM 0 HD2 ARG A 127 26.243 -28.385 -11.182 1.00 0.00 H new ATOM 0 HD3 ARG A 127 27.181 -27.798 -9.823 1.00 0.00 H new ATOM 0 HE ARG A 127 26.613 -29.735 -8.638 1.00 0.00 H new ATOM 0 HH11 ARG A 127 24.214 -29.177 -11.191 1.00 0.00 H new ATOM 0 HH12 ARG A 127 23.350 -30.684 -10.873 1.00 0.00 H new ATOM 0 HH21 ARG A 127 25.494 -31.684 -8.227 1.00 0.00 H new ATOM 0 HH22 ARG A 127 24.075 -32.107 -9.191 1.00 0.00 H new ATOM 1588 N LYS A 128 28.244 -25.028 -9.808 1.00 0.00 N ATOM 1589 CA LYS A 128 29.609 -24.813 -10.257 1.00 0.00 C ATOM 1590 C LYS A 128 30.181 -26.130 -10.783 1.00 0.00 C ATOM 1591 O LYS A 128 29.595 -27.192 -10.577 1.00 0.00 O ATOM 1592 CB LYS A 128 30.446 -24.181 -9.142 1.00 0.00 C ATOM 1593 CG LYS A 128 30.576 -25.130 -7.949 1.00 0.00 C ATOM 1594 CD LYS A 128 31.964 -25.023 -7.313 1.00 0.00 C ATOM 1595 CE LYS A 128 32.097 -25.978 -6.126 1.00 0.00 C ATOM 1596 NZ LYS A 128 32.917 -27.154 -6.496 1.00 0.00 N ATOM 0 H LYS A 128 28.155 -25.616 -8.979 1.00 0.00 H new ATOM 0 HA LYS A 128 29.631 -24.102 -11.083 1.00 0.00 H new ATOM 0 HB2 LYS A 128 31.437 -23.932 -9.523 1.00 0.00 H new ATOM 0 HB3 LYS A 128 29.984 -23.248 -8.820 1.00 0.00 H new ATOM 0 HG2 LYS A 128 29.813 -24.894 -7.207 1.00 0.00 H new ATOM 0 HG3 LYS A 128 30.399 -26.155 -8.274 1.00 0.00 H new ATOM 0 HD2 LYS A 128 32.727 -25.252 -8.056 1.00 0.00 H new ATOM 0 HD3 LYS A 128 32.139 -23.999 -6.982 1.00 0.00 H new ATOM 0 HE2 LYS A 128 32.554 -25.459 -5.284 1.00 0.00 H new ATOM 0 HE3 LYS A 128 31.109 -26.304 -5.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 33.390 -27.528 -5.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 32.305 -27.889 -6.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 33.633 -26.872 -7.196 1.00 0.00 H new ATOM 1606 N TYR A 129 31.318 -26.018 -11.455 1.00 0.00 N ATOM 1607 CA TYR A 129 31.976 -27.188 -12.014 1.00 0.00 C ATOM 1608 C TYR A 129 32.075 -28.308 -10.977 1.00 0.00 C ATOM 1609 O TYR A 129 31.725 -28.115 -9.814 1.00 0.00 O ATOM 1610 CB TYR A 129 33.386 -26.735 -12.395 1.00 0.00 C ATOM 1611 CG TYR A 129 34.377 -26.734 -11.229 1.00 0.00 C ATOM 1612 CD1 TYR A 129 34.096 -26.013 -10.086 1.00 0.00 C ATOM 1613 CD2 TYR A 129 35.550 -27.454 -11.320 1.00 0.00 C ATOM 1614 CE1 TYR A 129 35.028 -26.012 -8.988 1.00 0.00 C ATOM 1615 CE2 TYR A 129 36.482 -27.453 -10.221 1.00 0.00 C ATOM 1616 CZ TYR A 129 36.175 -26.732 -9.111 1.00 0.00 C ATOM 1617 OH TYR A 129 37.055 -26.731 -8.074 1.00 0.00 O ATOM 0 H TYR A 129 31.800 -25.135 -11.625 1.00 0.00 H new ATOM 0 HA TYR A 129 31.416 -27.574 -12.866 1.00 0.00 H new ATOM 0 HB2 TYR A 129 33.766 -27.388 -13.181 1.00 0.00 H new ATOM 0 HB3 TYR A 129 33.333 -25.730 -12.814 1.00 0.00 H new ATOM 0 HD1 TYR A 129 33.177 -25.450 -10.015 1.00 0.00 H new ATOM 0 HD2 TYR A 129 35.770 -28.018 -12.214 1.00 0.00 H new ATOM 0 HE1 TYR A 129 34.821 -25.452 -8.088 1.00 0.00 H new ATOM 0 HE2 TYR A 129 37.404 -28.013 -10.278 1.00 0.00 H new ATOM 0 HH TYR A 129 37.828 -27.288 -8.301 1.00 0.00 H new ATOM 1626 N ASP A 130 32.555 -29.455 -11.436 1.00 0.00 N ATOM 1627 CA ASP A 130 32.705 -30.606 -10.563 1.00 0.00 C ATOM 1628 C ASP A 130 33.253 -31.784 -11.370 1.00 0.00 C ATOM 1629 O ASP A 130 33.287 -31.738 -12.598 1.00 0.00 O ATOM 1630 CB ASP A 130 31.359 -31.026 -9.968 1.00 0.00 C ATOM 1631 CG ASP A 130 31.433 -31.638 -8.568 1.00 0.00 C ATOM 1632 OD1 ASP A 130 32.542 -31.605 -7.992 1.00 0.00 O ATOM 1633 OD2 ASP A 130 30.379 -32.124 -8.105 1.00 0.00 O ATOM 0 H ASP A 130 32.845 -29.611 -12.401 1.00 0.00 H new ATOM 0 HA ASP A 130 33.385 -30.331 -9.757 1.00 0.00 H new ATOM 0 HB2 ASP A 130 30.707 -30.154 -9.933 1.00 0.00 H new ATOM 0 HB3 ASP A 130 30.891 -31.747 -10.639 1.00 0.00 H new ATOM 1637 N LEU A 131 33.670 -32.813 -10.646 1.00 0.00 N ATOM 1638 CA LEU A 131 34.214 -34.002 -11.279 1.00 0.00 C ATOM 1639 C LEU A 131 35.578 -33.670 -11.889 1.00 0.00 C ATOM 1640 O LEU A 131 36.031 -32.529 -11.820 1.00 0.00 O ATOM 1641 CB LEU A 131 33.216 -34.580 -12.285 1.00 0.00 C ATOM 1642 CG LEU A 131 33.010 -36.095 -12.229 1.00 0.00 C ATOM 1643 CD1 LEU A 131 32.044 -36.477 -11.106 1.00 0.00 C ATOM 1644 CD2 LEU A 131 32.554 -36.636 -13.585 1.00 0.00 C ATOM 0 H LEU A 131 33.642 -32.847 -9.627 1.00 0.00 H new ATOM 0 HA LEU A 131 34.376 -34.786 -10.539 1.00 0.00 H new ATOM 0 HB2 LEU A 131 32.252 -34.096 -12.129 1.00 0.00 H new ATOM 0 HB3 LEU A 131 33.547 -34.315 -13.289 1.00 0.00 H new ATOM 0 HG LEU A 131 33.968 -36.561 -12.001 1.00 0.00 H new ATOM 0 HD11 LEU A 131 31.916 -37.559 -11.089 1.00 0.00 H new ATOM 0 HD12 LEU A 131 32.448 -36.144 -10.150 1.00 0.00 H new ATOM 0 HD13 LEU A 131 31.079 -36.000 -11.278 1.00 0.00 H new ATOM 0 HD21 LEU A 131 32.415 -37.715 -13.518 1.00 0.00 H new ATOM 0 HD22 LEU A 131 31.612 -36.165 -13.866 1.00 0.00 H new ATOM 0 HD23 LEU A 131 33.310 -36.414 -14.338 1.00 0.00 H new ATOM 1655 N HIS A 132 36.193 -34.687 -12.473 1.00 0.00 N ATOM 1656 CA HIS A 132 37.496 -34.517 -13.095 1.00 0.00 C ATOM 1657 C HIS A 132 38.549 -34.258 -12.016 1.00 0.00 C ATOM 1658 O HIS A 132 38.337 -33.446 -11.118 1.00 0.00 O ATOM 1659 CB HIS A 132 37.452 -33.416 -14.157 1.00 0.00 C ATOM 1660 CG HIS A 132 38.729 -32.620 -14.269 1.00 0.00 C ATOM 1661 ND1 HIS A 132 39.160 -31.752 -13.281 1.00 0.00 N ATOM 1662 CD2 HIS A 132 39.664 -32.570 -15.261 1.00 0.00 C ATOM 1663 CE1 HIS A 132 40.304 -31.208 -13.672 1.00 0.00 C ATOM 1664 NE2 HIS A 132 40.614 -31.717 -14.900 1.00 0.00 N ATOM 0 H HIS A 132 35.814 -35.632 -12.529 1.00 0.00 H new ATOM 0 HA HIS A 132 37.777 -35.432 -13.616 1.00 0.00 H new ATOM 0 HB2 HIS A 132 37.231 -33.867 -15.124 1.00 0.00 H new ATOM 0 HB3 HIS A 132 36.631 -32.736 -13.927 1.00 0.00 H new ATOM 0 HD1 HIS A 132 38.679 -31.563 -12.402 1.00 0.00 H new ATOM 0 HD2 HIS A 132 39.636 -33.130 -16.184 1.00 0.00 H new ATOM 0 HE1 HIS A 132 40.888 -30.489 -13.117 1.00 0.00 H new ATOM 1672 N TYR A 133 39.663 -34.966 -12.141 1.00 0.00 N ATOM 1673 CA TYR A 133 40.750 -34.823 -11.187 1.00 0.00 C ATOM 1674 C TYR A 133 41.499 -33.506 -11.404 1.00 0.00 C ATOM 1675 O TYR A 133 42.395 -33.164 -10.633 1.00 0.00 O ATOM 1676 CB TYR A 133 41.704 -35.989 -11.459 1.00 0.00 C ATOM 1677 CG TYR A 133 42.340 -36.578 -10.198 1.00 0.00 C ATOM 1678 CD1 TYR A 133 41.540 -37.003 -9.156 1.00 0.00 C ATOM 1679 CD2 TYR A 133 43.712 -36.687 -10.103 1.00 0.00 C ATOM 1680 CE1 TYR A 133 42.137 -37.559 -7.970 1.00 0.00 C ATOM 1681 CE2 TYR A 133 44.310 -37.242 -8.916 1.00 0.00 C ATOM 1682 CZ TYR A 133 43.493 -37.651 -7.908 1.00 0.00 C ATOM 1683 OH TYR A 133 44.057 -38.175 -6.788 1.00 0.00 O ATOM 0 H TYR A 133 39.836 -35.639 -12.887 1.00 0.00 H new ATOM 0 HA TYR A 133 40.369 -34.823 -10.166 1.00 0.00 H new ATOM 0 HB2 TYR A 133 41.160 -36.776 -11.981 1.00 0.00 H new ATOM 0 HB3 TYR A 133 42.495 -35.650 -12.128 1.00 0.00 H new ATOM 0 HD1 TYR A 133 40.466 -36.918 -9.231 1.00 0.00 H new ATOM 0 HD2 TYR A 133 44.338 -36.356 -10.919 1.00 0.00 H new ATOM 0 HE1 TYR A 133 41.522 -37.895 -7.148 1.00 0.00 H new ATOM 0 HE2 TYR A 133 45.383 -37.331 -8.828 1.00 0.00 H new ATOM 0 HH TYR A 133 45.032 -38.180 -6.884 1.00 0.00 H new TER 1692 TYR A 133