USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1036 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 64 HIS : no HE2:sc= -1.53 K(o=-0.81,f=-2.4!) USER MOD Set 1.2: A 68 ASN : amide:sc= 0.359 K(o=-0.81,f=-1.8) USER MOD Set 1.3: A 122 LYS NZ :NH3+ 145:sc= 0.365 (180deg=0) USER MOD Set 2.1: A 65 THR OG1 : rot -115:sc= -2.07! USER MOD Set 2.2: A 118 SER OG : rot 101:sc= 0.814 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 138:sc= 0.0484 (180deg=0) USER MOD Single : A 2 MET CE :methyl 143:sc= -0.212 (180deg=-1.31) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot -61:sc= -1.88 USER MOD Single : A 14 LYS NZ :NH3+ -146:sc= -3.49! (180deg=-8.11!) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 19 ASN :FLIP amide:sc= -0.01 F(o=-0.98,f=-0.01) USER MOD Single : A 21 ASN : amide:sc= -0.469 X(o=-0.47,f=-0.15) USER MOD Single : A 23 THR OG1 : rot 91:sc= 1.09 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -0.39 K(o=-0.39,f=-3.2!) USER MOD Single : A 34 MET CE :methyl -132:sc= -0.191 (180deg=-1.5!) USER MOD Single : A 38 ASN : amide:sc= -0.0114 X(o=-0.011,f=0) USER MOD Single : A 45 HIS : no HE2:sc= -0.892! C(o=-0.89!,f=-4.5!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -167:sc= -3.59! (180deg=-4.24!) USER MOD Single : A 53 THR OG1 : rot 75:sc= 0.214 USER MOD Single : A 54 MET CE :methyl -133:sc= -2.3 (180deg=-5.6!) USER MOD Single : A 57 SER OG : rot 180:sc= -0.112 USER MOD Single : A 58 SER OG : rot -174:sc= -0.663 USER MOD Single : A 59 MET CE :methyl 170:sc= -16.3! (180deg=-16.8!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 100:sc= -1.44 USER MOD Single : A 72 LYS NZ :NH3+ 157:sc= -3.32! (180deg=-3.76!) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot -74:sc= 0.57 USER MOD Single : A 79 LYS NZ :NH3+ -128:sc= -0.112 (180deg=-2.48!) USER MOD Single : A 81 THR OG1 : rot -171:sc= -2.28! USER MOD Single : A 82 SER OG : rot 103:sc= -0.804! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl -160:sc= -1.82 (180deg=-3.88!) USER MOD Single : A 96 THR OG1 : rot 82:sc= 0.174 USER MOD Single : A 98 MET CE :methyl 179:sc= -6.57! (180deg=-6.58!) USER MOD Single : A 101 LYS NZ :NH3+ -124:sc= -0.456 (180deg=-1.06) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 113 ASN : amide:sc= -1.11 X(o=-1.1,f=-1.4) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 132:sc= 1.01 USER MOD Single : A 126 SER OG : rot 180:sc= -0.236 USER MOD Single : A 127 SER OG : rot 180:sc= -0.0944 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.355 -30.635 -0.263 1.00 0.00 N ATOM 2 CA MET A 1 5.195 -30.305 -1.709 1.00 0.00 C ATOM 3 C MET A 1 5.701 -28.888 -1.989 1.00 0.00 C ATOM 4 O MET A 1 5.046 -28.102 -2.645 1.00 0.00 O ATOM 5 CB MET A 1 3.692 -30.402 -1.973 1.00 0.00 C ATOM 6 CG MET A 1 3.383 -31.721 -2.686 1.00 0.00 C ATOM 7 SD MET A 1 2.458 -32.806 -1.571 1.00 0.00 S ATOM 8 CE MET A 1 3.419 -34.311 -1.868 1.00 0.00 C ATOM 0 H1 MET A 1 4.507 -31.134 0.075 1.00 0.00 H new ATOM 0 H2 MET A 1 6.188 -31.244 -0.136 1.00 0.00 H new ATOM 0 H3 MET A 1 5.481 -29.758 0.281 1.00 0.00 H new ATOM 0 HA MET A 1 5.765 -30.976 -2.351 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.143 -30.347 -1.033 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.364 -29.561 -2.584 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.804 -31.531 -3.590 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.309 -32.205 -2.996 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.014 -35.126 -1.268 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.364 -34.575 -2.924 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.459 -34.139 -1.591 1.00 0.00 H new ATOM 20 N MET A 2 6.865 -28.557 -1.500 1.00 0.00 N ATOM 21 CA MET A 2 7.416 -27.193 -1.740 1.00 0.00 C ATOM 22 C MET A 2 6.412 -26.124 -1.299 1.00 0.00 C ATOM 23 O MET A 2 5.831 -25.431 -2.111 1.00 0.00 O ATOM 24 CB MET A 2 7.646 -27.120 -3.251 1.00 0.00 C ATOM 25 CG MET A 2 8.660 -26.017 -3.559 1.00 0.00 C ATOM 26 SD MET A 2 8.817 -25.824 -5.352 1.00 0.00 S ATOM 27 CE MET A 2 7.705 -24.407 -5.527 1.00 0.00 C ATOM 0 H MET A 2 7.459 -29.173 -0.944 1.00 0.00 H new ATOM 0 HA MET A 2 8.332 -27.016 -1.176 1.00 0.00 H new ATOM 0 HB2 MET A 2 8.011 -28.078 -3.621 1.00 0.00 H new ATOM 0 HB3 MET A 2 6.706 -26.918 -3.764 1.00 0.00 H new ATOM 0 HG2 MET A 2 8.340 -25.078 -3.108 1.00 0.00 H new ATOM 0 HG3 MET A 2 9.628 -26.266 -3.123 1.00 0.00 H new ATOM 0 HE1 MET A 2 8.094 -23.731 -6.288 1.00 0.00 H new ATOM 0 HE2 MET A 2 6.715 -24.755 -5.823 1.00 0.00 H new ATOM 0 HE3 MET A 2 7.635 -23.880 -4.575 1.00 0.00 H new ATOM 37 N GLU A 3 6.205 -25.981 -0.018 1.00 0.00 N ATOM 38 CA GLU A 3 5.242 -24.952 0.471 1.00 0.00 C ATOM 39 C GLU A 3 5.980 -23.825 1.168 1.00 0.00 C ATOM 40 O GLU A 3 5.422 -22.790 1.476 1.00 0.00 O ATOM 41 CB GLU A 3 4.364 -25.671 1.488 1.00 0.00 C ATOM 42 CG GLU A 3 5.251 -26.281 2.576 1.00 0.00 C ATOM 43 CD GLU A 3 5.440 -27.776 2.308 1.00 0.00 C ATOM 44 OE1 GLU A 3 6.314 -28.111 1.525 1.00 0.00 O ATOM 45 OE2 GLU A 3 4.708 -28.558 2.890 1.00 0.00 O ATOM 0 H GLU A 3 6.660 -26.531 0.710 1.00 0.00 H new ATOM 0 HA GLU A 3 4.670 -24.521 -0.351 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.653 -24.973 1.930 1.00 0.00 H new ATOM 0 HB3 GLU A 3 3.782 -26.451 0.997 1.00 0.00 H new ATOM 0 HG2 GLU A 3 6.219 -25.780 2.594 1.00 0.00 H new ATOM 0 HG3 GLU A 3 4.797 -26.132 3.555 1.00 0.00 H new ATOM 52 N GLU A 4 7.223 -24.027 1.444 1.00 0.00 N ATOM 53 CA GLU A 4 7.991 -22.978 2.151 1.00 0.00 C ATOM 54 C GLU A 4 8.221 -21.777 1.235 1.00 0.00 C ATOM 55 O GLU A 4 8.727 -20.751 1.650 1.00 0.00 O ATOM 56 CB GLU A 4 9.309 -23.642 2.539 1.00 0.00 C ATOM 57 CG GLU A 4 9.025 -24.776 3.529 1.00 0.00 C ATOM 58 CD GLU A 4 10.327 -25.508 3.860 1.00 0.00 C ATOM 59 OE1 GLU A 4 11.334 -25.190 3.251 1.00 0.00 O ATOM 60 OE2 GLU A 4 10.293 -26.374 4.719 1.00 0.00 O ATOM 0 H GLU A 4 7.745 -24.872 1.213 1.00 0.00 H new ATOM 0 HA GLU A 4 7.464 -22.597 3.026 1.00 0.00 H new ATOM 0 HB2 GLU A 4 9.809 -24.033 1.653 1.00 0.00 H new ATOM 0 HB3 GLU A 4 9.981 -22.910 2.987 1.00 0.00 H new ATOM 0 HG2 GLU A 4 8.581 -24.374 4.440 1.00 0.00 H new ATOM 0 HG3 GLU A 4 8.303 -25.472 3.102 1.00 0.00 H new ATOM 67 N TYR A 5 7.838 -21.893 -0.002 1.00 0.00 N ATOM 68 CA TYR A 5 8.016 -20.758 -0.950 1.00 0.00 C ATOM 69 C TYR A 5 6.942 -19.707 -0.700 1.00 0.00 C ATOM 70 O TYR A 5 7.136 -18.527 -0.917 1.00 0.00 O ATOM 71 CB TYR A 5 7.864 -21.371 -2.343 1.00 0.00 C ATOM 72 CG TYR A 5 9.229 -21.682 -2.906 1.00 0.00 C ATOM 73 CD1 TYR A 5 10.250 -22.123 -2.056 1.00 0.00 C ATOM 74 CD2 TYR A 5 9.475 -21.526 -4.275 1.00 0.00 C ATOM 75 CE1 TYR A 5 11.518 -22.411 -2.577 1.00 0.00 C ATOM 76 CE2 TYR A 5 10.742 -21.814 -4.795 1.00 0.00 C ATOM 77 CZ TYR A 5 11.763 -22.256 -3.947 1.00 0.00 C ATOM 78 OH TYR A 5 13.012 -22.540 -4.460 1.00 0.00 O ATOM 0 H TYR A 5 7.407 -22.727 -0.401 1.00 0.00 H new ATOM 0 HA TYR A 5 8.981 -20.264 -0.835 1.00 0.00 H new ATOM 0 HB2 TYR A 5 7.265 -22.280 -2.289 1.00 0.00 H new ATOM 0 HB3 TYR A 5 7.336 -20.680 -3.001 1.00 0.00 H new ATOM 0 HD1 TYR A 5 10.060 -22.241 -0.999 1.00 0.00 H new ATOM 0 HD2 TYR A 5 8.687 -21.184 -4.930 1.00 0.00 H new ATOM 0 HE1 TYR A 5 12.306 -22.752 -1.922 1.00 0.00 H new ATOM 0 HE2 TYR A 5 10.932 -21.695 -5.852 1.00 0.00 H new ATOM 0 HH TYR A 5 13.012 -22.381 -5.427 1.00 0.00 H new ATOM 88 N LEU A 6 5.820 -20.138 -0.225 1.00 0.00 N ATOM 89 CA LEU A 6 4.714 -19.185 0.072 1.00 0.00 C ATOM 90 C LEU A 6 4.850 -18.692 1.511 1.00 0.00 C ATOM 91 O LEU A 6 4.429 -17.604 1.851 1.00 0.00 O ATOM 92 CB LEU A 6 3.424 -19.989 -0.117 1.00 0.00 C ATOM 93 CG LEU A 6 3.217 -20.925 1.077 1.00 0.00 C ATOM 94 CD1 LEU A 6 2.243 -20.285 2.070 1.00 0.00 C ATOM 95 CD2 LEU A 6 2.641 -22.255 0.584 1.00 0.00 C ATOM 0 H LEU A 6 5.612 -21.116 -0.025 1.00 0.00 H new ATOM 0 HA LEU A 6 4.725 -18.307 -0.574 1.00 0.00 H new ATOM 0 HB2 LEU A 6 2.574 -19.313 -0.213 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.477 -20.567 -1.039 1.00 0.00 H new ATOM 0 HG LEU A 6 4.173 -21.100 1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.097 -20.953 2.919 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.651 -19.337 2.420 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.286 -20.109 1.579 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.492 -22.924 1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.686 -22.077 0.090 1.00 0.00 H new ATOM 0 HD23 LEU A 6 3.334 -22.712 -0.122 1.00 0.00 H new ATOM 107 N GLY A 7 5.451 -19.485 2.357 1.00 0.00 N ATOM 108 CA GLY A 7 5.632 -19.064 3.773 1.00 0.00 C ATOM 109 C GLY A 7 6.553 -17.845 3.814 1.00 0.00 C ATOM 110 O GLY A 7 6.342 -16.919 4.571 1.00 0.00 O ATOM 0 H GLY A 7 5.824 -20.406 2.127 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.668 -18.823 4.221 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.060 -19.879 4.357 1.00 0.00 H new ATOM 114 N VAL A 8 7.573 -17.835 2.997 1.00 0.00 N ATOM 115 CA VAL A 8 8.505 -16.671 2.984 1.00 0.00 C ATOM 116 C VAL A 8 7.926 -15.553 2.128 1.00 0.00 C ATOM 117 O VAL A 8 8.155 -14.385 2.366 1.00 0.00 O ATOM 118 CB VAL A 8 9.806 -17.204 2.385 1.00 0.00 C ATOM 119 CG1 VAL A 8 10.686 -16.029 1.950 1.00 0.00 C ATOM 120 CG2 VAL A 8 10.545 -18.035 3.437 1.00 0.00 C ATOM 0 H VAL A 8 7.800 -18.581 2.340 1.00 0.00 H new ATOM 0 HA VAL A 8 8.667 -16.255 3.979 1.00 0.00 H new ATOM 0 HB VAL A 8 9.582 -17.828 1.520 1.00 0.00 H new ATOM 0 HG11 VAL A 8 11.614 -16.408 1.523 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.158 -15.436 1.203 1.00 0.00 H new ATOM 0 HG13 VAL A 8 10.913 -15.405 2.814 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.474 -18.417 3.013 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.771 -17.410 4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 8 9.918 -18.871 3.747 1.00 0.00 H new ATOM 130 N PHE A 9 7.161 -15.910 1.147 1.00 0.00 N ATOM 131 CA PHE A 9 6.536 -14.878 0.276 1.00 0.00 C ATOM 132 C PHE A 9 5.625 -13.994 1.131 1.00 0.00 C ATOM 133 O PHE A 9 5.503 -12.806 0.910 1.00 0.00 O ATOM 134 CB PHE A 9 5.729 -15.666 -0.762 1.00 0.00 C ATOM 135 CG PHE A 9 4.634 -14.799 -1.337 1.00 0.00 C ATOM 136 CD1 PHE A 9 4.889 -14.002 -2.459 1.00 0.00 C ATOM 137 CD2 PHE A 9 3.366 -14.792 -0.745 1.00 0.00 C ATOM 138 CE1 PHE A 9 3.873 -13.200 -2.992 1.00 0.00 C ATOM 139 CE2 PHE A 9 2.349 -13.989 -1.278 1.00 0.00 C ATOM 140 CZ PHE A 9 2.603 -13.192 -2.401 1.00 0.00 C ATOM 0 H PHE A 9 6.937 -16.875 0.905 1.00 0.00 H new ATOM 0 HA PHE A 9 7.263 -14.225 -0.208 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.387 -16.011 -1.560 1.00 0.00 H new ATOM 0 HB3 PHE A 9 5.296 -16.553 -0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 9 5.869 -14.006 -2.913 1.00 0.00 H new ATOM 0 HD2 PHE A 9 3.171 -15.405 0.122 1.00 0.00 H new ATOM 0 HE1 PHE A 9 4.068 -12.587 -3.859 1.00 0.00 H new ATOM 0 HE2 PHE A 9 1.370 -13.985 -0.823 1.00 0.00 H new ATOM 0 HZ PHE A 9 1.820 -12.571 -2.811 1.00 0.00 H new ATOM 150 N VAL A 10 4.997 -14.570 2.121 1.00 0.00 N ATOM 151 CA VAL A 10 4.106 -13.771 3.007 1.00 0.00 C ATOM 152 C VAL A 10 4.958 -12.965 3.989 1.00 0.00 C ATOM 153 O VAL A 10 4.773 -11.776 4.156 1.00 0.00 O ATOM 154 CB VAL A 10 3.256 -14.803 3.749 1.00 0.00 C ATOM 155 CG1 VAL A 10 2.413 -14.101 4.816 1.00 0.00 C ATOM 156 CG2 VAL A 10 2.334 -15.510 2.753 1.00 0.00 C ATOM 0 H VAL A 10 5.064 -15.561 2.354 1.00 0.00 H new ATOM 0 HA VAL A 10 3.486 -13.063 2.457 1.00 0.00 H new ATOM 0 HB VAL A 10 3.907 -15.535 4.227 1.00 0.00 H new ATOM 0 HG11 VAL A 10 1.808 -14.838 5.344 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.070 -13.596 5.524 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.760 -13.369 4.341 1.00 0.00 H new ATOM 0 HG21 VAL A 10 1.727 -16.247 3.279 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.683 -14.777 2.276 1.00 0.00 H new ATOM 0 HG23 VAL A 10 2.934 -16.011 1.994 1.00 0.00 H new ATOM 166 N ASP A 11 5.903 -13.602 4.628 1.00 0.00 N ATOM 167 CA ASP A 11 6.775 -12.865 5.584 1.00 0.00 C ATOM 168 C ASP A 11 7.356 -11.643 4.887 1.00 0.00 C ATOM 169 O ASP A 11 7.732 -10.667 5.505 1.00 0.00 O ATOM 170 CB ASP A 11 7.880 -13.851 5.970 1.00 0.00 C ATOM 171 CG ASP A 11 7.610 -14.402 7.372 1.00 0.00 C ATOM 172 OD1 ASP A 11 7.882 -13.694 8.328 1.00 0.00 O ATOM 173 OD2 ASP A 11 7.136 -15.522 7.467 1.00 0.00 O ATOM 0 H ASP A 11 6.107 -14.596 4.529 1.00 0.00 H new ATOM 0 HA ASP A 11 6.237 -12.516 6.465 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.921 -14.668 5.249 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.850 -13.354 5.944 1.00 0.00 H new ATOM 178 N GLU A 12 7.408 -11.696 3.594 1.00 0.00 N ATOM 179 CA GLU A 12 7.937 -10.545 2.812 1.00 0.00 C ATOM 180 C GLU A 12 6.862 -9.462 2.728 1.00 0.00 C ATOM 181 O GLU A 12 7.135 -8.285 2.855 1.00 0.00 O ATOM 182 CB GLU A 12 8.235 -11.111 1.423 1.00 0.00 C ATOM 183 CG GLU A 12 9.652 -11.684 1.398 1.00 0.00 C ATOM 184 CD GLU A 12 10.073 -11.946 -0.050 1.00 0.00 C ATOM 185 OE1 GLU A 12 9.690 -12.976 -0.580 1.00 0.00 O ATOM 186 OE2 GLU A 12 10.769 -11.111 -0.603 1.00 0.00 O ATOM 0 H GLU A 12 7.105 -12.493 3.035 1.00 0.00 H new ATOM 0 HA GLU A 12 8.824 -10.099 3.262 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.513 -11.888 1.173 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.135 -10.329 0.671 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.345 -10.987 1.869 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.691 -12.610 1.972 1.00 0.00 H new ATOM 193 N THR A 13 5.637 -9.862 2.521 1.00 0.00 N ATOM 194 CA THR A 13 4.529 -8.871 2.434 1.00 0.00 C ATOM 195 C THR A 13 4.290 -8.237 3.807 1.00 0.00 C ATOM 196 O THR A 13 4.065 -7.048 3.921 1.00 0.00 O ATOM 197 CB THR A 13 3.309 -9.683 1.994 1.00 0.00 C ATOM 198 OG1 THR A 13 2.859 -10.485 3.077 1.00 0.00 O ATOM 199 CG2 THR A 13 3.694 -10.579 0.815 1.00 0.00 C ATOM 0 H THR A 13 5.356 -10.836 2.408 1.00 0.00 H new ATOM 0 HA THR A 13 4.746 -8.059 1.741 1.00 0.00 H new ATOM 0 HB THR A 13 2.510 -9.007 1.689 1.00 0.00 H new ATOM 0 HG1 THR A 13 3.570 -11.106 3.342 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.826 -11.158 0.500 1.00 0.00 H new ATOM 0 HG22 THR A 13 4.038 -9.961 -0.014 1.00 0.00 H new ATOM 0 HG23 THR A 13 4.492 -11.257 1.118 1.00 0.00 H new ATOM 207 N LYS A 14 4.353 -9.017 4.852 1.00 0.00 N ATOM 208 CA LYS A 14 4.150 -8.459 6.209 1.00 0.00 C ATOM 209 C LYS A 14 5.264 -7.461 6.507 1.00 0.00 C ATOM 210 O LYS A 14 5.038 -6.404 7.061 1.00 0.00 O ATOM 211 CB LYS A 14 4.242 -9.665 7.139 1.00 0.00 C ATOM 212 CG LYS A 14 2.857 -10.288 7.305 1.00 0.00 C ATOM 213 CD LYS A 14 2.339 -10.785 5.953 1.00 0.00 C ATOM 214 CE LYS A 14 1.523 -9.681 5.274 1.00 0.00 C ATOM 215 NZ LYS A 14 0.530 -9.245 6.298 1.00 0.00 N ATOM 0 H LYS A 14 4.537 -10.020 4.819 1.00 0.00 H new ATOM 0 HA LYS A 14 3.201 -7.935 6.323 1.00 0.00 H new ATOM 0 HB2 LYS A 14 4.936 -10.400 6.731 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.634 -9.360 8.109 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.905 -11.116 8.012 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.167 -9.554 7.720 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.175 -11.076 5.317 1.00 0.00 H new ATOM 0 HD3 LYS A 14 1.722 -11.672 6.093 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.161 -8.853 4.966 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.027 -10.052 4.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.358 -8.976 5.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 0.349 -10.026 6.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.906 -8.428 6.821 1.00 0.00 H new ATOM 229 N GLU A 15 6.468 -7.787 6.125 1.00 0.00 N ATOM 230 CA GLU A 15 7.597 -6.855 6.368 1.00 0.00 C ATOM 231 C GLU A 15 7.525 -5.696 5.376 1.00 0.00 C ATOM 232 O GLU A 15 8.188 -4.688 5.521 1.00 0.00 O ATOM 233 CB GLU A 15 8.862 -7.690 6.155 1.00 0.00 C ATOM 234 CG GLU A 15 8.939 -8.778 7.229 1.00 0.00 C ATOM 235 CD GLU A 15 10.160 -9.665 6.977 1.00 0.00 C ATOM 236 OE1 GLU A 15 11.263 -9.203 7.215 1.00 0.00 O ATOM 237 OE2 GLU A 15 9.970 -10.792 6.549 1.00 0.00 O ATOM 0 H GLU A 15 6.716 -8.658 5.656 1.00 0.00 H new ATOM 0 HA GLU A 15 7.578 -6.420 7.367 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.850 -8.142 5.163 1.00 0.00 H new ATOM 0 HB3 GLU A 15 9.745 -7.052 6.204 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.006 -8.323 8.217 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.031 -9.380 7.216 1.00 0.00 H new ATOM 244 N TYR A 16 6.703 -5.835 4.379 1.00 0.00 N ATOM 245 CA TYR A 16 6.545 -4.753 3.369 1.00 0.00 C ATOM 246 C TYR A 16 5.417 -3.819 3.801 1.00 0.00 C ATOM 247 O TYR A 16 5.532 -2.615 3.714 1.00 0.00 O ATOM 248 CB TYR A 16 6.192 -5.470 2.064 1.00 0.00 C ATOM 249 CG TYR A 16 7.459 -5.818 1.320 1.00 0.00 C ATOM 250 CD1 TYR A 16 8.580 -6.274 2.022 1.00 0.00 C ATOM 251 CD2 TYR A 16 7.512 -5.682 -0.073 1.00 0.00 C ATOM 252 CE1 TYR A 16 9.754 -6.596 1.333 1.00 0.00 C ATOM 253 CE2 TYR A 16 8.687 -6.004 -0.763 1.00 0.00 C ATOM 254 CZ TYR A 16 9.808 -6.460 -0.060 1.00 0.00 C ATOM 255 OH TYR A 16 10.965 -6.779 -0.740 1.00 0.00 O ATOM 0 H TYR A 16 6.126 -6.661 4.217 1.00 0.00 H new ATOM 0 HA TYR A 16 7.443 -4.146 3.256 1.00 0.00 H new ATOM 0 HB2 TYR A 16 5.623 -6.375 2.277 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.559 -4.833 1.447 1.00 0.00 H new ATOM 0 HD1 TYR A 16 8.539 -6.377 3.096 1.00 0.00 H new ATOM 0 HD2 TYR A 16 6.647 -5.329 -0.615 1.00 0.00 H new ATOM 0 HE1 TYR A 16 10.619 -6.949 1.875 1.00 0.00 H new ATOM 0 HE2 TYR A 16 8.728 -5.901 -1.837 1.00 0.00 H new ATOM 0 HH TYR A 16 10.833 -6.629 -1.699 1.00 0.00 H new ATOM 265 N LEU A 17 4.333 -4.362 4.289 1.00 0.00 N ATOM 266 CA LEU A 17 3.218 -3.489 4.749 1.00 0.00 C ATOM 267 C LEU A 17 3.738 -2.609 5.876 1.00 0.00 C ATOM 268 O LEU A 17 3.413 -1.444 5.979 1.00 0.00 O ATOM 269 CB LEU A 17 2.135 -4.442 5.255 1.00 0.00 C ATOM 270 CG LEU A 17 1.547 -5.210 4.074 1.00 0.00 C ATOM 271 CD1 LEU A 17 0.500 -6.204 4.579 1.00 0.00 C ATOM 272 CD2 LEU A 17 0.890 -4.227 3.102 1.00 0.00 C ATOM 0 H LEU A 17 4.174 -5.365 4.388 1.00 0.00 H new ATOM 0 HA LEU A 17 2.825 -2.841 3.966 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.556 -5.137 5.982 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.352 -3.882 5.766 1.00 0.00 H new ATOM 0 HG LEU A 17 2.343 -5.751 3.562 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.081 -6.752 3.735 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.968 -6.905 5.270 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.296 -5.665 5.092 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.470 -4.775 2.259 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.095 -3.685 3.614 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.636 -3.520 2.740 1.00 0.00 H new ATOM 284 N GLN A 18 4.579 -3.161 6.703 1.00 0.00 N ATOM 285 CA GLN A 18 5.169 -2.364 7.807 1.00 0.00 C ATOM 286 C GLN A 18 6.118 -1.356 7.193 1.00 0.00 C ATOM 287 O GLN A 18 6.052 -0.169 7.446 1.00 0.00 O ATOM 288 CB GLN A 18 5.883 -3.395 8.682 1.00 0.00 C ATOM 289 CG GLN A 18 7.393 -3.127 8.764 1.00 0.00 C ATOM 290 CD GLN A 18 8.042 -4.136 9.714 1.00 0.00 C ATOM 291 OE1 GLN A 18 8.717 -5.048 9.280 1.00 0.00 O ATOM 292 NE2 GLN A 18 7.863 -4.013 11.001 1.00 0.00 N ATOM 0 H GLN A 18 4.883 -4.134 6.660 1.00 0.00 H new ATOM 0 HA GLN A 18 4.451 -1.801 8.403 1.00 0.00 H new ATOM 0 HB2 GLN A 18 5.456 -3.378 9.685 1.00 0.00 H new ATOM 0 HB3 GLN A 18 5.713 -4.394 8.279 1.00 0.00 H new ATOM 0 HG2 GLN A 18 7.841 -3.205 7.773 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.574 -2.112 9.117 1.00 0.00 H new ATOM 0 HE21 GLN A 18 7.296 -3.248 11.366 1.00 0.00 H new ATOM 0 HE22 GLN A 18 8.290 -4.682 11.642 1.00 0.00 H new ATOM 301 N ASN A 19 6.958 -1.828 6.339 1.00 0.00 N ATOM 302 CA ASN A 19 7.876 -0.911 5.636 1.00 0.00 C ATOM 303 C ASN A 19 7.014 0.061 4.852 1.00 0.00 C ATOM 304 O ASN A 19 7.393 1.178 4.556 1.00 0.00 O ATOM 305 CB ASN A 19 8.698 -1.801 4.700 1.00 0.00 C ATOM 306 CG ASN A 19 10.025 -2.163 5.370 1.00 0.00 C ATOM 307 OD1 ASN A 19 10.108 -2.159 6.673 1.00 0.00 O flip ATOM 308 ND2 ASN A 19 10.997 -2.453 4.701 1.00 0.00 N flip ATOM 0 H ASN A 19 7.052 -2.814 6.094 1.00 0.00 H new ATOM 0 HA ASN A 19 8.535 -0.344 6.293 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.141 -2.707 4.461 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.884 -1.283 3.759 1.00 0.00 H new ATOM 0 HD21 ASN A 19 10.933 -2.456 3.683 1.00 0.00 H new ATOM 0 HD22 ASN A 19 11.877 -2.693 5.157 1.00 0.00 H new ATOM 315 N LEU A 20 5.830 -0.374 4.543 1.00 0.00 N ATOM 316 CA LEU A 20 4.877 0.484 3.800 1.00 0.00 C ATOM 317 C LEU A 20 4.021 1.263 4.788 1.00 0.00 C ATOM 318 O LEU A 20 3.363 2.224 4.437 1.00 0.00 O ATOM 319 CB LEU A 20 4.033 -0.488 2.975 1.00 0.00 C ATOM 320 CG LEU A 20 2.731 0.187 2.539 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.031 1.241 1.472 1.00 0.00 C ATOM 322 CD2 LEU A 20 1.790 -0.870 1.959 1.00 0.00 C ATOM 0 H LEU A 20 5.478 -1.302 4.778 1.00 0.00 H new ATOM 0 HA LEU A 20 5.369 1.218 3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.593 -0.815 2.099 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.811 -1.379 3.563 1.00 0.00 H new ATOM 0 HG LEU A 20 2.263 0.668 3.398 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.102 1.720 1.163 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.708 1.991 1.882 1.00 0.00 H new ATOM 0 HD13 LEU A 20 3.497 0.764 0.610 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.860 -0.396 1.646 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.262 -1.345 1.099 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.576 -1.623 2.718 1.00 0.00 H new ATOM 334 N ASN A 21 4.063 0.890 6.034 1.00 0.00 N ATOM 335 CA ASN A 21 3.303 1.636 7.049 1.00 0.00 C ATOM 336 C ASN A 21 4.250 2.657 7.601 1.00 0.00 C ATOM 337 O ASN A 21 3.885 3.745 7.981 1.00 0.00 O ATOM 338 CB ASN A 21 2.909 0.630 8.122 1.00 0.00 C ATOM 339 CG ASN A 21 1.450 0.213 7.928 1.00 0.00 C ATOM 340 OD1 ASN A 21 0.544 0.935 8.298 1.00 0.00 O ATOM 341 ND2 ASN A 21 1.182 -0.929 7.359 1.00 0.00 N ATOM 0 H ASN A 21 4.596 0.095 6.387 1.00 0.00 H new ATOM 0 HA ASN A 21 2.408 2.125 6.664 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.557 -0.245 8.069 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.044 1.068 9.111 1.00 0.00 H new ATOM 0 HD21 ASN A 21 0.213 -1.217 7.224 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.942 -1.535 7.049 1.00 0.00 H new ATOM 348 N ASP A 22 5.492 2.304 7.608 1.00 0.00 N ATOM 349 CA ASP A 22 6.501 3.246 8.097 1.00 0.00 C ATOM 350 C ASP A 22 6.585 4.370 7.088 1.00 0.00 C ATOM 351 O ASP A 22 6.814 5.519 7.406 1.00 0.00 O ATOM 352 CB ASP A 22 7.811 2.462 8.189 1.00 0.00 C ATOM 353 CG ASP A 22 7.594 1.203 9.030 1.00 0.00 C ATOM 354 OD1 ASP A 22 6.561 1.116 9.674 1.00 0.00 O ATOM 355 OD2 ASP A 22 8.463 0.347 9.015 1.00 0.00 O ATOM 0 H ASP A 22 5.848 1.401 7.295 1.00 0.00 H new ATOM 0 HA ASP A 22 6.270 3.674 9.072 1.00 0.00 H new ATOM 0 HB2 ASP A 22 8.156 2.191 7.191 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.588 3.082 8.637 1.00 0.00 H new ATOM 360 N THR A 23 6.342 4.017 5.870 1.00 0.00 N ATOM 361 CA THR A 23 6.331 5.010 4.775 1.00 0.00 C ATOM 362 C THR A 23 5.012 5.769 4.832 1.00 0.00 C ATOM 363 O THR A 23 4.963 6.976 4.702 1.00 0.00 O ATOM 364 CB THR A 23 6.370 4.163 3.518 1.00 0.00 C ATOM 365 OG1 THR A 23 7.589 3.436 3.471 1.00 0.00 O ATOM 366 CG2 THR A 23 6.248 5.059 2.286 1.00 0.00 C ATOM 0 H THR A 23 6.146 3.059 5.578 1.00 0.00 H new ATOM 0 HA THR A 23 7.149 5.729 4.825 1.00 0.00 H new ATOM 0 HB THR A 23 5.536 3.462 3.529 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.468 2.566 3.905 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.277 4.445 1.386 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.305 5.604 2.324 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.076 5.768 2.268 1.00 0.00 H new ATOM 374 N LEU A 24 3.938 5.053 5.047 1.00 0.00 N ATOM 375 CA LEU A 24 2.612 5.710 5.136 1.00 0.00 C ATOM 376 C LEU A 24 2.542 6.457 6.458 1.00 0.00 C ATOM 377 O LEU A 24 1.843 7.440 6.598 1.00 0.00 O ATOM 378 CB LEU A 24 1.588 4.572 5.098 1.00 0.00 C ATOM 379 CG LEU A 24 1.373 4.116 3.653 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.465 2.885 3.636 1.00 0.00 C ATOM 381 CD2 LEU A 24 0.712 5.241 2.853 1.00 0.00 C ATOM 0 H LEU A 24 3.929 4.040 5.164 1.00 0.00 H new ATOM 0 HA LEU A 24 2.428 6.422 4.332 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.937 3.736 5.705 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.644 4.906 5.528 1.00 0.00 H new ATOM 0 HG LEU A 24 2.336 3.868 3.207 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.312 2.560 2.607 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.932 2.081 4.205 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.496 3.136 4.084 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.560 4.915 1.824 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.250 5.490 3.301 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.355 6.121 2.863 1.00 0.00 H new ATOM 393 N LEU A 25 3.285 6.001 7.432 1.00 0.00 N ATOM 394 CA LEU A 25 3.274 6.702 8.747 1.00 0.00 C ATOM 395 C LEU A 25 4.290 7.826 8.728 1.00 0.00 C ATOM 396 O LEU A 25 4.228 8.761 9.504 1.00 0.00 O ATOM 397 CB LEU A 25 3.637 5.642 9.770 1.00 0.00 C ATOM 398 CG LEU A 25 2.475 4.667 9.853 1.00 0.00 C ATOM 399 CD1 LEU A 25 2.956 3.341 10.438 1.00 0.00 C ATOM 400 CD2 LEU A 25 1.382 5.271 10.734 1.00 0.00 C ATOM 0 H LEU A 25 3.892 5.183 7.375 1.00 0.00 H new ATOM 0 HA LEU A 25 2.309 7.152 8.979 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.551 5.125 9.478 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.825 6.097 10.742 1.00 0.00 H new ATOM 0 HG LEU A 25 2.073 4.481 8.857 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.120 2.644 10.496 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.734 2.922 9.799 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.358 3.509 11.437 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.543 4.578 10.800 1.00 0.00 H new ATOM 0 HD22 LEU A 25 1.780 5.455 11.732 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.043 6.211 10.299 1.00 0.00 H new ATOM 412 N GLU A 26 5.179 7.774 7.795 1.00 0.00 N ATOM 413 CA GLU A 26 6.159 8.860 7.638 1.00 0.00 C ATOM 414 C GLU A 26 5.550 9.798 6.629 1.00 0.00 C ATOM 415 O GLU A 26 5.752 10.996 6.635 1.00 0.00 O ATOM 416 CB GLU A 26 7.442 8.201 7.129 1.00 0.00 C ATOM 417 CG GLU A 26 8.196 7.588 8.311 1.00 0.00 C ATOM 418 CD GLU A 26 9.451 6.877 7.805 1.00 0.00 C ATOM 419 OE1 GLU A 26 10.023 7.346 6.835 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.819 5.875 8.396 1.00 0.00 O ATOM 0 H GLU A 26 5.269 7.012 7.123 1.00 0.00 H new ATOM 0 HA GLU A 26 6.394 9.414 8.547 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.203 7.431 6.396 1.00 0.00 H new ATOM 0 HB3 GLU A 26 8.068 8.937 6.625 1.00 0.00 H new ATOM 0 HG2 GLU A 26 8.469 8.366 9.024 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.554 6.883 8.839 1.00 0.00 H new ATOM 427 N LEU A 27 4.757 9.224 5.775 1.00 0.00 N ATOM 428 CA LEU A 27 4.055 10.008 4.759 1.00 0.00 C ATOM 429 C LEU A 27 3.005 10.877 5.444 1.00 0.00 C ATOM 430 O LEU A 27 2.739 11.991 5.041 1.00 0.00 O ATOM 431 CB LEU A 27 3.389 8.973 3.853 1.00 0.00 C ATOM 432 CG LEU A 27 2.542 9.687 2.804 1.00 0.00 C ATOM 433 CD1 LEU A 27 3.448 10.477 1.860 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.746 8.655 2.003 1.00 0.00 C ATOM 0 H LEU A 27 4.569 8.222 5.747 1.00 0.00 H new ATOM 0 HA LEU A 27 4.715 10.667 4.195 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.146 8.358 3.367 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.766 8.303 4.445 1.00 0.00 H new ATOM 0 HG LEU A 27 1.855 10.372 3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.839 10.985 1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 27 4.013 11.214 2.430 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.139 9.795 1.363 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.141 9.164 1.253 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.434 7.969 1.509 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.096 8.095 2.675 1.00 0.00 H new ATOM 446 N GLU A 28 2.415 10.371 6.492 1.00 0.00 N ATOM 447 CA GLU A 28 1.395 11.160 7.225 1.00 0.00 C ATOM 448 C GLU A 28 2.080 12.352 7.880 1.00 0.00 C ATOM 449 O GLU A 28 1.556 13.448 7.907 1.00 0.00 O ATOM 450 CB GLU A 28 0.846 10.212 8.289 1.00 0.00 C ATOM 451 CG GLU A 28 0.005 9.126 7.620 1.00 0.00 C ATOM 452 CD GLU A 28 -1.478 9.405 7.868 1.00 0.00 C ATOM 453 OE1 GLU A 28 -1.780 10.455 8.411 1.00 0.00 O ATOM 454 OE2 GLU A 28 -2.287 8.565 7.512 1.00 0.00 O ATOM 0 H GLU A 28 2.599 9.442 6.871 1.00 0.00 H new ATOM 0 HA GLU A 28 0.602 11.537 6.580 1.00 0.00 H new ATOM 0 HB2 GLU A 28 1.666 9.760 8.846 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.240 10.765 9.007 1.00 0.00 H new ATOM 0 HG2 GLU A 28 0.207 9.102 6.549 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.273 8.147 8.017 1.00 0.00 H new ATOM 461 N LYS A 29 3.264 12.148 8.390 1.00 0.00 N ATOM 462 CA LYS A 29 3.995 13.276 9.024 1.00 0.00 C ATOM 463 C LYS A 29 4.595 14.148 7.925 1.00 0.00 C ATOM 464 O LYS A 29 4.898 15.311 8.108 1.00 0.00 O ATOM 465 CB LYS A 29 5.059 12.601 9.899 1.00 0.00 C ATOM 466 CG LYS A 29 6.461 12.739 9.296 1.00 0.00 C ATOM 467 CD LYS A 29 7.291 11.532 9.713 1.00 0.00 C ATOM 468 CE LYS A 29 8.348 11.252 8.646 1.00 0.00 C ATOM 469 NZ LYS A 29 9.566 11.974 9.108 1.00 0.00 N ATOM 0 H LYS A 29 3.753 11.253 8.394 1.00 0.00 H new ATOM 0 HA LYS A 29 3.371 13.934 9.629 1.00 0.00 H new ATOM 0 HB2 LYS A 29 5.046 13.045 10.895 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.816 11.545 10.017 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.401 12.800 8.209 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.932 13.659 9.641 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.769 11.720 10.674 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.648 10.661 9.842 1.00 0.00 H new ATOM 0 HE2 LYS A 29 8.537 10.183 8.549 1.00 0.00 H new ATOM 0 HE3 LYS A 29 8.025 11.609 7.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.336 11.828 8.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.359 12.990 9.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.854 11.608 10.038 1.00 0.00 H new ATOM 483 N ASN A 30 4.736 13.570 6.777 1.00 0.00 N ATOM 484 CA ASN A 30 5.282 14.304 5.603 1.00 0.00 C ATOM 485 C ASN A 30 4.638 13.736 4.358 1.00 0.00 C ATOM 486 O ASN A 30 5.211 12.943 3.640 1.00 0.00 O ATOM 487 CB ASN A 30 6.794 14.070 5.619 1.00 0.00 C ATOM 488 CG ASN A 30 7.506 15.347 6.071 1.00 0.00 C ATOM 489 OD1 ASN A 30 6.943 16.422 6.019 1.00 0.00 O ATOM 490 ND2 ASN A 30 8.732 15.272 6.515 1.00 0.00 N ATOM 0 H ASN A 30 4.492 12.597 6.593 1.00 0.00 H new ATOM 0 HA ASN A 30 5.077 15.374 5.628 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.038 13.248 6.292 1.00 0.00 H new ATOM 0 HB3 ASN A 30 7.138 13.782 4.626 1.00 0.00 H new ATOM 0 HD21 ASN A 30 9.217 16.116 6.818 1.00 0.00 H new ATOM 0 HD22 ASN A 30 9.204 14.369 6.558 1.00 0.00 H new ATOM 497 N PRO A 31 3.428 14.155 4.187 1.00 0.00 N ATOM 498 CA PRO A 31 2.604 13.689 3.066 1.00 0.00 C ATOM 499 C PRO A 31 2.825 14.539 1.814 1.00 0.00 C ATOM 500 O PRO A 31 1.972 14.622 0.953 1.00 0.00 O ATOM 501 CB PRO A 31 1.201 13.870 3.612 1.00 0.00 C ATOM 502 CG PRO A 31 1.277 14.956 4.640 1.00 0.00 C ATOM 503 CD PRO A 31 2.713 15.106 5.040 1.00 0.00 C ATOM 0 HA PRO A 31 2.829 12.670 2.752 1.00 0.00 H new ATOM 0 HB2 PRO A 31 0.507 14.139 2.815 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.835 12.943 4.054 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.893 15.893 4.236 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.663 14.707 5.506 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.066 16.125 4.882 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.857 14.879 6.096 1.00 0.00 H new ATOM 511 N GLU A 32 3.955 15.175 1.705 1.00 0.00 N ATOM 512 CA GLU A 32 4.216 16.021 0.504 1.00 0.00 C ATOM 513 C GLU A 32 5.697 15.962 0.134 1.00 0.00 C ATOM 514 O GLU A 32 6.159 16.670 -0.739 1.00 0.00 O ATOM 515 CB GLU A 32 3.808 17.456 0.887 1.00 0.00 C ATOM 516 CG GLU A 32 3.406 17.525 2.364 1.00 0.00 C ATOM 517 CD GLU A 32 3.381 18.984 2.824 1.00 0.00 C ATOM 518 OE1 GLU A 32 4.388 19.653 2.660 1.00 0.00 O ATOM 519 OE2 GLU A 32 2.356 19.408 3.331 1.00 0.00 O ATOM 0 H GLU A 32 4.709 15.148 2.392 1.00 0.00 H new ATOM 0 HA GLU A 32 3.651 15.673 -0.361 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.637 18.138 0.698 1.00 0.00 H new ATOM 0 HB3 GLU A 32 2.977 17.783 0.262 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.425 17.072 2.505 1.00 0.00 H new ATOM 0 HG3 GLU A 32 4.110 16.955 2.970 1.00 0.00 H new ATOM 526 N ASP A 33 6.446 15.119 0.789 1.00 0.00 N ATOM 527 CA ASP A 33 7.897 15.010 0.469 1.00 0.00 C ATOM 528 C ASP A 33 8.084 14.380 -0.910 1.00 0.00 C ATOM 529 O ASP A 33 9.155 14.407 -1.484 1.00 0.00 O ATOM 530 CB ASP A 33 8.487 14.116 1.561 1.00 0.00 C ATOM 531 CG ASP A 33 7.817 12.742 1.517 1.00 0.00 C ATOM 532 OD1 ASP A 33 6.606 12.691 1.651 1.00 0.00 O ATOM 533 OD2 ASP A 33 8.527 11.764 1.351 1.00 0.00 O ATOM 0 H ASP A 33 6.117 14.502 1.531 1.00 0.00 H new ATOM 0 HA ASP A 33 8.388 15.983 0.442 1.00 0.00 H new ATOM 0 HB2 ASP A 33 9.563 14.012 1.418 1.00 0.00 H new ATOM 0 HB3 ASP A 33 8.338 14.573 2.539 1.00 0.00 H new ATOM 538 N MET A 34 7.042 13.805 -1.430 1.00 0.00 N ATOM 539 CA MET A 34 7.102 13.152 -2.767 1.00 0.00 C ATOM 540 C MET A 34 7.991 11.914 -2.727 1.00 0.00 C ATOM 541 O MET A 34 8.127 11.210 -3.709 1.00 0.00 O ATOM 542 CB MET A 34 7.666 14.205 -3.719 1.00 0.00 C ATOM 543 CG MET A 34 6.541 14.727 -4.609 1.00 0.00 C ATOM 544 SD MET A 34 6.848 14.231 -6.324 1.00 0.00 S ATOM 545 CE MET A 34 5.136 14.337 -6.901 1.00 0.00 C ATOM 0 H MET A 34 6.130 13.758 -0.976 1.00 0.00 H new ATOM 0 HA MET A 34 6.119 12.811 -3.091 1.00 0.00 H new ATOM 0 HB2 MET A 34 8.109 15.025 -3.153 1.00 0.00 H new ATOM 0 HB3 MET A 34 8.459 13.774 -4.330 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.583 14.332 -4.271 1.00 0.00 H new ATOM 0 HG3 MET A 34 6.481 15.813 -4.538 1.00 0.00 H new ATOM 0 HE1 MET A 34 4.882 13.433 -7.454 1.00 0.00 H new ATOM 0 HE2 MET A 34 4.469 14.439 -6.045 1.00 0.00 H new ATOM 0 HE3 MET A 34 5.025 15.204 -7.553 1.00 0.00 H new ATOM 555 N GLU A 35 8.565 11.611 -1.601 1.00 0.00 N ATOM 556 CA GLU A 35 9.394 10.394 -1.517 1.00 0.00 C ATOM 557 C GLU A 35 8.569 9.333 -0.814 1.00 0.00 C ATOM 558 O GLU A 35 8.587 8.171 -1.165 1.00 0.00 O ATOM 559 CB GLU A 35 10.630 10.782 -0.708 1.00 0.00 C ATOM 560 CG GLU A 35 11.632 11.469 -1.636 1.00 0.00 C ATOM 561 CD GLU A 35 12.841 11.941 -0.826 1.00 0.00 C ATOM 562 OE1 GLU A 35 12.636 12.458 0.260 1.00 0.00 O ATOM 563 OE2 GLU A 35 13.950 11.779 -1.307 1.00 0.00 O ATOM 0 H GLU A 35 8.494 12.154 -0.741 1.00 0.00 H new ATOM 0 HA GLU A 35 9.701 10.001 -2.486 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.353 11.449 0.108 1.00 0.00 H new ATOM 0 HB3 GLU A 35 11.079 9.897 -0.257 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.952 10.779 -2.417 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.161 12.317 -2.133 1.00 0.00 H new ATOM 570 N LEU A 36 7.792 9.748 0.148 1.00 0.00 N ATOM 571 CA LEU A 36 6.906 8.784 0.841 1.00 0.00 C ATOM 572 C LEU A 36 5.734 8.495 -0.082 1.00 0.00 C ATOM 573 O LEU A 36 5.137 7.437 -0.046 1.00 0.00 O ATOM 574 CB LEU A 36 6.440 9.497 2.107 1.00 0.00 C ATOM 575 CG LEU A 36 7.615 9.626 3.065 1.00 0.00 C ATOM 576 CD1 LEU A 36 7.386 10.806 4.011 1.00 0.00 C ATOM 577 CD2 LEU A 36 7.753 8.338 3.876 1.00 0.00 C ATOM 0 H LEU A 36 7.735 10.711 0.480 1.00 0.00 H new ATOM 0 HA LEU A 36 7.392 7.841 1.091 1.00 0.00 H new ATOM 0 HB2 LEU A 36 6.046 10.483 1.860 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.631 8.938 2.577 1.00 0.00 H new ATOM 0 HG LEU A 36 8.528 9.797 2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 36 8.230 10.893 4.695 1.00 0.00 H new ATOM 0 HD12 LEU A 36 7.292 11.724 3.431 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.472 10.642 4.582 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.594 8.429 4.563 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.838 8.166 4.443 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.925 7.500 3.201 1.00 0.00 H new ATOM 589 N ILE A 37 5.424 9.433 -0.936 1.00 0.00 N ATOM 590 CA ILE A 37 4.314 9.218 -1.897 1.00 0.00 C ATOM 591 C ILE A 37 4.777 8.223 -2.958 1.00 0.00 C ATOM 592 O ILE A 37 4.014 7.413 -3.445 1.00 0.00 O ATOM 593 CB ILE A 37 4.043 10.590 -2.514 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.236 11.437 -1.528 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.247 10.423 -3.810 1.00 0.00 C ATOM 596 CD1 ILE A 37 2.889 12.781 -2.171 1.00 0.00 C ATOM 0 H ILE A 37 5.893 10.336 -1.007 1.00 0.00 H new ATOM 0 HA ILE A 37 3.414 8.816 -1.432 1.00 0.00 H new ATOM 0 HB ILE A 37 4.990 11.083 -2.733 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.324 10.912 -1.244 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.810 11.596 -0.615 1.00 0.00 H new ATOM 0 HG21 ILE A 37 3.055 11.403 -4.248 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.819 9.817 -4.513 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.299 9.930 -3.594 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.314 13.383 -1.468 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.807 13.307 -2.433 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.298 12.612 -3.071 1.00 0.00 H new ATOM 608 N ASN A 38 6.038 8.268 -3.306 1.00 0.00 N ATOM 609 CA ASN A 38 6.561 7.313 -4.319 1.00 0.00 C ATOM 610 C ASN A 38 7.081 6.062 -3.626 1.00 0.00 C ATOM 611 O ASN A 38 6.978 4.963 -4.133 1.00 0.00 O ATOM 612 CB ASN A 38 7.690 8.054 -5.036 1.00 0.00 C ATOM 613 CG ASN A 38 7.605 7.784 -6.538 1.00 0.00 C ATOM 614 OD1 ASN A 38 7.618 8.701 -7.335 1.00 0.00 O ATOM 615 ND2 ASN A 38 7.521 6.552 -6.962 1.00 0.00 N ATOM 0 H ASN A 38 6.723 8.924 -2.932 1.00 0.00 H new ATOM 0 HA ASN A 38 5.793 6.992 -5.023 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.616 9.124 -4.844 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.656 7.727 -4.651 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.466 6.359 -7.962 1.00 0.00 H new ATOM 0 HD22 ASN A 38 7.510 5.782 -6.293 1.00 0.00 H new ATOM 622 N GLU A 39 7.614 6.222 -2.456 1.00 0.00 N ATOM 623 CA GLU A 39 8.119 5.038 -1.707 1.00 0.00 C ATOM 624 C GLU A 39 6.951 4.103 -1.440 1.00 0.00 C ATOM 625 O GLU A 39 7.105 2.913 -1.249 1.00 0.00 O ATOM 626 CB GLU A 39 8.689 5.589 -0.399 1.00 0.00 C ATOM 627 CG GLU A 39 10.085 6.154 -0.654 1.00 0.00 C ATOM 628 CD GLU A 39 10.470 7.101 0.484 1.00 0.00 C ATOM 629 OE1 GLU A 39 9.773 7.107 1.486 1.00 0.00 O ATOM 630 OE2 GLU A 39 11.454 7.807 0.334 1.00 0.00 O ATOM 0 H GLU A 39 7.724 7.118 -1.982 1.00 0.00 H new ATOM 0 HA GLU A 39 8.879 4.479 -2.253 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.036 6.367 -0.004 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.735 4.800 0.352 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.809 5.343 -0.726 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.105 6.685 -1.606 1.00 0.00 H new ATOM 637 N ALA A 40 5.779 4.653 -1.451 1.00 0.00 N ATOM 638 CA ALA A 40 4.557 3.840 -1.227 1.00 0.00 C ATOM 639 C ALA A 40 4.029 3.339 -2.575 1.00 0.00 C ATOM 640 O ALA A 40 3.962 2.151 -2.822 1.00 0.00 O ATOM 641 CB ALA A 40 3.560 4.795 -0.571 1.00 0.00 C ATOM 0 H ALA A 40 5.610 5.647 -1.608 1.00 0.00 H new ATOM 0 HA ALA A 40 4.737 2.964 -0.604 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.627 4.267 -0.373 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.974 5.165 0.367 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.367 5.635 -1.239 1.00 0.00 H new ATOM 647 N PHE A 41 3.665 4.238 -3.453 1.00 0.00 N ATOM 648 CA PHE A 41 3.157 3.808 -4.787 1.00 0.00 C ATOM 649 C PHE A 41 4.034 2.681 -5.346 1.00 0.00 C ATOM 650 O PHE A 41 3.568 1.817 -6.063 1.00 0.00 O ATOM 651 CB PHE A 41 3.256 5.060 -5.664 1.00 0.00 C ATOM 652 CG PHE A 41 3.172 4.674 -7.122 1.00 0.00 C ATOM 653 CD1 PHE A 41 1.928 4.411 -7.708 1.00 0.00 C ATOM 654 CD2 PHE A 41 4.340 4.584 -7.888 1.00 0.00 C ATOM 655 CE1 PHE A 41 1.852 4.057 -9.060 1.00 0.00 C ATOM 656 CE2 PHE A 41 4.263 4.230 -9.240 1.00 0.00 C ATOM 657 CZ PHE A 41 3.020 3.967 -9.826 1.00 0.00 C ATOM 0 H PHE A 41 3.698 5.246 -3.304 1.00 0.00 H new ATOM 0 HA PHE A 41 2.139 3.422 -4.743 1.00 0.00 H new ATOM 0 HB2 PHE A 41 2.452 5.753 -5.415 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.195 5.578 -5.469 1.00 0.00 H new ATOM 0 HD1 PHE A 41 1.027 4.481 -7.117 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.300 4.787 -7.436 1.00 0.00 H new ATOM 0 HE1 PHE A 41 0.893 3.853 -9.512 1.00 0.00 H new ATOM 0 HE2 PHE A 41 5.164 4.160 -9.831 1.00 0.00 H new ATOM 0 HZ PHE A 41 2.962 3.695 -10.869 1.00 0.00 H new ATOM 667 N ARG A 42 5.303 2.681 -5.025 1.00 0.00 N ATOM 668 CA ARG A 42 6.204 1.608 -5.539 1.00 0.00 C ATOM 669 C ARG A 42 6.084 0.352 -4.672 1.00 0.00 C ATOM 670 O ARG A 42 5.975 -0.751 -5.172 1.00 0.00 O ATOM 671 CB ARG A 42 7.618 2.193 -5.459 1.00 0.00 C ATOM 672 CG ARG A 42 8.094 2.232 -4.006 1.00 0.00 C ATOM 673 CD ARG A 42 9.480 2.880 -3.943 1.00 0.00 C ATOM 674 NE ARG A 42 10.025 2.504 -2.609 1.00 0.00 N ATOM 675 CZ ARG A 42 10.058 1.251 -2.245 1.00 0.00 C ATOM 676 NH1 ARG A 42 10.343 0.323 -3.119 1.00 0.00 N ATOM 677 NH2 ARG A 42 9.808 0.927 -1.007 1.00 0.00 N ATOM 0 H ARG A 42 5.753 3.377 -4.430 1.00 0.00 H new ATOM 0 HA ARG A 42 5.950 1.312 -6.557 1.00 0.00 H new ATOM 0 HB2 ARG A 42 8.302 1.591 -6.057 1.00 0.00 H new ATOM 0 HB3 ARG A 42 7.627 3.199 -5.879 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.389 2.796 -3.396 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.133 1.222 -3.597 1.00 0.00 H new ATOM 0 HD2 ARG A 42 10.121 2.518 -4.747 1.00 0.00 H new ATOM 0 HD3 ARG A 42 9.414 3.963 -4.051 1.00 0.00 H new ATOM 0 HE ARG A 42 10.373 3.227 -1.979 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.540 0.577 -4.087 1.00 0.00 H new ATOM 0 HH12 ARG A 42 10.369 -0.656 -2.834 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.587 1.652 -0.325 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.833 -0.052 -0.721 1.00 0.00 H new ATOM 691 N ALA A 43 6.092 0.510 -3.378 1.00 0.00 N ATOM 692 CA ALA A 43 5.967 -0.675 -2.482 1.00 0.00 C ATOM 693 C ALA A 43 4.625 -1.360 -2.724 1.00 0.00 C ATOM 694 O ALA A 43 4.555 -2.556 -2.917 1.00 0.00 O ATOM 695 CB ALA A 43 6.039 -0.109 -1.063 1.00 0.00 C ATOM 0 H ALA A 43 6.180 1.408 -2.901 1.00 0.00 H new ATOM 0 HA ALA A 43 6.744 -1.419 -2.657 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.954 -0.922 -0.342 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.992 0.402 -0.923 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.223 0.597 -0.911 1.00 0.00 H new ATOM 701 N LEU A 44 3.562 -0.606 -2.733 1.00 0.00 N ATOM 702 CA LEU A 44 2.228 -1.213 -2.983 1.00 0.00 C ATOM 703 C LEU A 44 2.205 -1.804 -4.390 1.00 0.00 C ATOM 704 O LEU A 44 1.636 -2.851 -4.628 1.00 0.00 O ATOM 705 CB LEU A 44 1.245 -0.053 -2.859 1.00 0.00 C ATOM 706 CG LEU A 44 1.061 0.296 -1.384 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.684 1.773 -1.250 1.00 0.00 C ATOM 708 CD2 LEU A 44 -0.049 -0.576 -0.794 1.00 0.00 C ATOM 0 H LEU A 44 3.560 0.402 -2.578 1.00 0.00 H new ATOM 0 HA LEU A 44 1.983 -2.018 -2.290 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.616 0.814 -3.406 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.287 -0.324 -3.303 1.00 0.00 H new ATOM 0 HG LEU A 44 1.991 0.114 -0.846 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.553 2.021 -0.197 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.477 2.391 -1.672 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.247 1.961 -1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.184 -0.330 0.259 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.980 -0.393 -1.331 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.224 -1.627 -0.889 1.00 0.00 H new ATOM 720 N HIS A 45 2.845 -1.149 -5.320 1.00 0.00 N ATOM 721 CA HIS A 45 2.891 -1.681 -6.706 1.00 0.00 C ATOM 722 C HIS A 45 3.645 -3.005 -6.691 1.00 0.00 C ATOM 723 O HIS A 45 3.335 -3.923 -7.424 1.00 0.00 O ATOM 724 CB HIS A 45 3.654 -0.627 -7.505 1.00 0.00 C ATOM 725 CG HIS A 45 3.802 -1.083 -8.930 1.00 0.00 C ATOM 726 ND1 HIS A 45 3.263 -2.277 -9.385 1.00 0.00 N ATOM 727 CD2 HIS A 45 4.424 -0.516 -10.013 1.00 0.00 C ATOM 728 CE1 HIS A 45 3.569 -2.388 -10.691 1.00 0.00 C ATOM 729 NE2 HIS A 45 4.276 -1.341 -11.124 1.00 0.00 N ATOM 0 H HIS A 45 3.338 -0.267 -5.177 1.00 0.00 H new ATOM 0 HA HIS A 45 1.906 -1.865 -7.135 1.00 0.00 H new ATOM 0 HB2 HIS A 45 3.123 0.325 -7.470 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.636 -0.461 -7.062 1.00 0.00 H new ATOM 0 HD1 HIS A 45 2.732 -2.949 -8.831 1.00 0.00 H new ATOM 0 HD2 HIS A 45 4.949 0.428 -10.005 1.00 0.00 H new ATOM 0 HE1 HIS A 45 3.278 -3.222 -11.313 1.00 0.00 H new ATOM 737 N THR A 46 4.624 -3.111 -5.835 1.00 0.00 N ATOM 738 CA THR A 46 5.393 -4.377 -5.734 1.00 0.00 C ATOM 739 C THR A 46 4.628 -5.335 -4.813 1.00 0.00 C ATOM 740 O THR A 46 4.574 -6.527 -5.037 1.00 0.00 O ATOM 741 CB THR A 46 6.762 -3.964 -5.153 1.00 0.00 C ATOM 742 OG1 THR A 46 7.775 -4.233 -6.112 1.00 0.00 O ATOM 743 CG2 THR A 46 7.074 -4.732 -3.862 1.00 0.00 C ATOM 0 H THR A 46 4.923 -2.371 -5.200 1.00 0.00 H new ATOM 0 HA THR A 46 5.529 -4.895 -6.684 1.00 0.00 H new ATOM 0 HB THR A 46 6.729 -2.900 -4.920 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.647 -3.971 -5.749 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.045 -4.419 -3.478 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.305 -4.522 -3.119 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.095 -5.802 -4.071 1.00 0.00 H new ATOM 751 N LEU A 47 4.022 -4.802 -3.785 1.00 0.00 N ATOM 752 CA LEU A 47 3.242 -5.651 -2.852 1.00 0.00 C ATOM 753 C LEU A 47 1.998 -6.174 -3.568 1.00 0.00 C ATOM 754 O LEU A 47 1.602 -7.311 -3.405 1.00 0.00 O ATOM 755 CB LEU A 47 2.858 -4.710 -1.710 1.00 0.00 C ATOM 756 CG LEU A 47 3.658 -5.074 -0.461 1.00 0.00 C ATOM 757 CD1 LEU A 47 3.469 -3.988 0.599 1.00 0.00 C ATOM 758 CD2 LEU A 47 3.163 -6.414 0.087 1.00 0.00 C ATOM 0 H LEU A 47 4.037 -3.808 -3.555 1.00 0.00 H new ATOM 0 HA LEU A 47 3.795 -6.518 -2.492 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.056 -3.676 -1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.790 -4.785 -1.506 1.00 0.00 H new ATOM 0 HG LEU A 47 4.715 -5.153 -0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 47 4.040 -4.247 1.491 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.820 -3.033 0.208 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.412 -3.909 0.855 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.733 -6.675 0.979 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.106 -6.335 0.342 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.297 -7.188 -0.669 1.00 0.00 H new ATOM 770 N LYS A 48 1.390 -5.351 -4.378 1.00 0.00 N ATOM 771 CA LYS A 48 0.183 -5.792 -5.124 1.00 0.00 C ATOM 772 C LYS A 48 0.576 -6.873 -6.137 1.00 0.00 C ATOM 773 O LYS A 48 -0.163 -7.803 -6.390 1.00 0.00 O ATOM 774 CB LYS A 48 -0.312 -4.523 -5.825 1.00 0.00 C ATOM 775 CG LYS A 48 -1.164 -4.877 -7.049 1.00 0.00 C ATOM 776 CD LYS A 48 -1.286 -3.641 -7.936 1.00 0.00 C ATOM 777 CE LYS A 48 -0.145 -3.628 -8.953 1.00 0.00 C ATOM 778 NZ LYS A 48 -0.770 -4.030 -10.246 1.00 0.00 N ATOM 0 H LYS A 48 1.680 -4.389 -4.554 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.588 -6.226 -4.487 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.898 -3.922 -5.129 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.539 -3.915 -6.132 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -0.706 -5.696 -7.604 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.151 -5.216 -6.736 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.246 -3.644 -8.451 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.254 -2.738 -7.326 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.307 -2.639 -9.025 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.646 -4.320 -8.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.046 -4.043 -10.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -1.186 -4.978 -10.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -1.515 -3.349 -10.498 1.00 0.00 H new ATOM 792 N GLY A 49 1.737 -6.753 -6.722 1.00 0.00 N ATOM 793 CA GLY A 49 2.178 -7.769 -7.723 1.00 0.00 C ATOM 794 C GLY A 49 2.451 -9.102 -7.024 1.00 0.00 C ATOM 795 O GLY A 49 1.842 -10.108 -7.326 1.00 0.00 O ATOM 0 H GLY A 49 2.399 -5.996 -6.551 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.410 -7.899 -8.486 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.078 -7.424 -8.232 1.00 0.00 H new ATOM 799 N MET A 50 3.365 -9.120 -6.093 1.00 0.00 N ATOM 800 CA MET A 50 3.677 -10.393 -5.379 1.00 0.00 C ATOM 801 C MET A 50 2.388 -11.139 -5.029 1.00 0.00 C ATOM 802 O MET A 50 2.343 -12.352 -5.024 1.00 0.00 O ATOM 803 CB MET A 50 4.394 -9.964 -4.099 1.00 0.00 C ATOM 804 CG MET A 50 5.767 -9.386 -4.443 1.00 0.00 C ATOM 805 SD MET A 50 6.843 -9.461 -2.984 1.00 0.00 S ATOM 806 CE MET A 50 5.585 -9.094 -1.733 1.00 0.00 C ATOM 0 H MET A 50 3.909 -8.310 -5.795 1.00 0.00 H new ATOM 0 HA MET A 50 4.282 -11.064 -5.989 1.00 0.00 H new ATOM 0 HB2 MET A 50 3.798 -9.220 -3.570 1.00 0.00 H new ATOM 0 HB3 MET A 50 4.506 -10.818 -3.430 1.00 0.00 H new ATOM 0 HG2 MET A 50 6.213 -9.946 -5.265 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.664 -8.354 -4.779 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.071 -8.864 -0.785 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.992 -8.238 -2.054 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.934 -9.959 -1.607 1.00 0.00 H new ATOM 816 N ALA A 51 1.342 -10.422 -4.726 1.00 0.00 N ATOM 817 CA ALA A 51 0.062 -11.091 -4.363 1.00 0.00 C ATOM 818 C ALA A 51 -0.788 -11.325 -5.608 1.00 0.00 C ATOM 819 O ALA A 51 -1.780 -12.024 -5.570 1.00 0.00 O ATOM 820 CB ALA A 51 -0.634 -10.116 -3.422 1.00 0.00 C ATOM 0 H ALA A 51 1.318 -9.402 -4.714 1.00 0.00 H new ATOM 0 HA ALA A 51 0.223 -12.066 -3.903 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.590 -10.535 -3.106 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.007 -9.944 -2.548 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.805 -9.171 -3.938 1.00 0.00 H new ATOM 826 N GLY A 52 -0.408 -10.750 -6.712 1.00 0.00 N ATOM 827 CA GLY A 52 -1.199 -10.944 -7.955 1.00 0.00 C ATOM 828 C GLY A 52 -0.768 -12.240 -8.643 1.00 0.00 C ATOM 829 O GLY A 52 -0.624 -12.297 -9.847 1.00 0.00 O ATOM 0 H GLY A 52 0.415 -10.155 -6.807 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.262 -10.983 -7.719 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.052 -10.098 -8.627 1.00 0.00 H new ATOM 833 N THR A 53 -0.565 -13.285 -7.884 1.00 0.00 N ATOM 834 CA THR A 53 -0.147 -14.586 -8.483 1.00 0.00 C ATOM 835 C THR A 53 0.279 -15.542 -7.374 1.00 0.00 C ATOM 836 O THR A 53 0.163 -16.747 -7.480 1.00 0.00 O ATOM 837 CB THR A 53 1.017 -14.238 -9.439 1.00 0.00 C ATOM 838 OG1 THR A 53 0.640 -14.565 -10.768 1.00 0.00 O ATOM 839 CG2 THR A 53 2.294 -15.007 -9.073 1.00 0.00 C ATOM 0 H THR A 53 -0.672 -13.293 -6.870 1.00 0.00 H new ATOM 0 HA THR A 53 -0.948 -15.087 -9.027 1.00 0.00 H new ATOM 0 HB THR A 53 1.225 -13.172 -9.351 1.00 0.00 H new ATOM 0 HG1 THR A 53 0.005 -13.898 -11.101 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.092 -14.738 -9.765 1.00 0.00 H new ATOM 0 HG22 THR A 53 2.594 -14.751 -8.057 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.104 -16.078 -9.136 1.00 0.00 H new ATOM 847 N MET A 54 0.769 -14.993 -6.320 1.00 0.00 N ATOM 848 CA MET A 54 1.221 -15.820 -5.171 1.00 0.00 C ATOM 849 C MET A 54 0.453 -15.430 -3.917 1.00 0.00 C ATOM 850 O MET A 54 0.526 -16.078 -2.893 1.00 0.00 O ATOM 851 CB MET A 54 2.680 -15.457 -5.006 1.00 0.00 C ATOM 852 CG MET A 54 3.540 -16.325 -5.927 1.00 0.00 C ATOM 853 SD MET A 54 4.066 -17.811 -5.039 1.00 0.00 S ATOM 854 CE MET A 54 5.139 -16.986 -3.840 1.00 0.00 C ATOM 0 H MET A 54 0.882 -13.987 -6.194 1.00 0.00 H new ATOM 0 HA MET A 54 1.063 -16.886 -5.333 1.00 0.00 H new ATOM 0 HB2 MET A 54 2.830 -14.403 -5.240 1.00 0.00 H new ATOM 0 HB3 MET A 54 2.984 -15.600 -3.969 1.00 0.00 H new ATOM 0 HG2 MET A 54 2.974 -16.601 -6.817 1.00 0.00 H new ATOM 0 HG3 MET A 54 4.411 -15.763 -6.265 1.00 0.00 H new ATOM 0 HE1 MET A 54 6.091 -17.514 -3.779 1.00 0.00 H new ATOM 0 HE2 MET A 54 5.314 -15.958 -4.156 1.00 0.00 H new ATOM 0 HE3 MET A 54 4.660 -16.988 -2.861 1.00 0.00 H new ATOM 864 N GLY A 55 -0.286 -14.374 -4.002 1.00 0.00 N ATOM 865 CA GLY A 55 -1.079 -13.917 -2.832 1.00 0.00 C ATOM 866 C GLY A 55 -2.493 -13.626 -3.305 1.00 0.00 C ATOM 867 O GLY A 55 -3.305 -13.072 -2.590 1.00 0.00 O ATOM 0 H GLY A 55 -0.379 -13.798 -4.838 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.087 -14.682 -2.056 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -0.632 -13.024 -2.395 1.00 0.00 H new ATOM 871 N PHE A 56 -2.785 -13.992 -4.522 1.00 0.00 N ATOM 872 CA PHE A 56 -4.146 -13.738 -5.074 1.00 0.00 C ATOM 873 C PHE A 56 -4.325 -12.242 -5.328 1.00 0.00 C ATOM 874 O PHE A 56 -4.114 -11.425 -4.454 1.00 0.00 O ATOM 875 CB PHE A 56 -5.123 -14.221 -3.996 1.00 0.00 C ATOM 876 CG PHE A 56 -6.098 -15.204 -4.599 1.00 0.00 C ATOM 877 CD1 PHE A 56 -5.644 -16.442 -5.068 1.00 0.00 C ATOM 878 CD2 PHE A 56 -7.457 -14.877 -4.687 1.00 0.00 C ATOM 879 CE1 PHE A 56 -6.548 -17.354 -5.623 1.00 0.00 C ATOM 880 CE2 PHE A 56 -8.361 -15.789 -5.242 1.00 0.00 C ATOM 881 CZ PHE A 56 -7.907 -17.027 -5.710 1.00 0.00 C ATOM 0 H PHE A 56 -2.139 -14.457 -5.160 1.00 0.00 H new ATOM 0 HA PHE A 56 -4.311 -14.253 -6.020 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -4.575 -14.691 -3.179 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -5.661 -13.373 -3.572 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -4.596 -16.693 -5.001 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -7.807 -13.921 -4.326 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -6.198 -18.310 -5.984 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -9.409 -15.538 -5.309 1.00 0.00 H new ATOM 0 HZ PHE A 56 -8.605 -17.731 -6.139 1.00 0.00 H new ATOM 891 N SER A 57 -4.707 -11.876 -6.518 1.00 0.00 N ATOM 892 CA SER A 57 -4.895 -10.431 -6.826 1.00 0.00 C ATOM 893 C SER A 57 -5.990 -9.828 -5.951 1.00 0.00 C ATOM 894 O SER A 57 -6.187 -8.630 -5.922 1.00 0.00 O ATOM 895 CB SER A 57 -5.295 -10.375 -8.295 1.00 0.00 C ATOM 896 OG SER A 57 -4.312 -11.039 -9.077 1.00 0.00 O ATOM 0 H SER A 57 -4.897 -12.514 -7.291 1.00 0.00 H new ATOM 0 HA SER A 57 -3.988 -9.859 -6.631 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.268 -10.846 -8.437 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.393 -9.338 -8.617 1.00 0.00 H new ATOM 0 HG SER A 57 -4.569 -11.006 -10.022 1.00 0.00 H new ATOM 902 N SER A 58 -6.688 -10.643 -5.220 1.00 0.00 N ATOM 903 CA SER A 58 -7.747 -10.112 -4.330 1.00 0.00 C ATOM 904 C SER A 58 -7.076 -9.220 -3.303 1.00 0.00 C ATOM 905 O SER A 58 -7.492 -8.108 -3.050 1.00 0.00 O ATOM 906 CB SER A 58 -8.363 -11.333 -3.654 1.00 0.00 C ATOM 907 OG SER A 58 -8.948 -12.173 -4.639 1.00 0.00 O ATOM 0 H SER A 58 -6.570 -11.656 -5.201 1.00 0.00 H new ATOM 0 HA SER A 58 -8.508 -9.535 -4.855 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.599 -11.880 -3.101 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.117 -11.021 -2.932 1.00 0.00 H new ATOM 0 HG SER A 58 -9.425 -12.908 -4.200 1.00 0.00 H new ATOM 913 N MET A 59 -6.013 -9.704 -2.732 1.00 0.00 N ATOM 914 CA MET A 59 -5.273 -8.896 -1.742 1.00 0.00 C ATOM 915 C MET A 59 -4.465 -7.830 -2.483 1.00 0.00 C ATOM 916 O MET A 59 -4.186 -6.771 -1.960 1.00 0.00 O ATOM 917 CB MET A 59 -4.350 -9.893 -1.034 1.00 0.00 C ATOM 918 CG MET A 59 -3.651 -9.208 0.143 1.00 0.00 C ATOM 919 SD MET A 59 -1.861 -9.255 -0.111 1.00 0.00 S ATOM 920 CE MET A 59 -1.839 -8.350 -1.675 1.00 0.00 C ATOM 0 H MET A 59 -5.626 -10.630 -2.912 1.00 0.00 H new ATOM 0 HA MET A 59 -5.919 -8.382 -1.031 1.00 0.00 H new ATOM 0 HB2 MET A 59 -4.926 -10.747 -0.679 1.00 0.00 H new ATOM 0 HB3 MET A 59 -3.609 -10.277 -1.735 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.990 -8.176 0.231 1.00 0.00 H new ATOM 0 HG3 MET A 59 -3.910 -9.709 1.076 1.00 0.00 H new ATOM 0 HE1 MET A 59 -0.811 -8.102 -1.938 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.275 -8.969 -2.460 1.00 0.00 H new ATOM 0 HE3 MET A 59 -2.418 -7.432 -1.573 1.00 0.00 H new ATOM 930 N ALA A 60 -4.087 -8.105 -3.705 1.00 0.00 N ATOM 931 CA ALA A 60 -3.295 -7.108 -4.478 1.00 0.00 C ATOM 932 C ALA A 60 -4.171 -5.919 -4.855 1.00 0.00 C ATOM 933 O ALA A 60 -3.713 -4.795 -4.912 1.00 0.00 O ATOM 934 CB ALA A 60 -2.829 -7.847 -5.732 1.00 0.00 C ATOM 0 H ALA A 60 -4.293 -8.974 -4.198 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.455 -6.717 -3.903 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.237 -7.174 -6.352 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.220 -8.704 -5.444 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.697 -8.191 -6.295 1.00 0.00 H new ATOM 940 N LYS A 61 -5.430 -6.146 -5.100 1.00 0.00 N ATOM 941 CA LYS A 61 -6.318 -5.009 -5.453 1.00 0.00 C ATOM 942 C LYS A 61 -6.354 -4.054 -4.275 1.00 0.00 C ATOM 943 O LYS A 61 -6.464 -2.852 -4.425 1.00 0.00 O ATOM 944 CB LYS A 61 -7.693 -5.627 -5.689 1.00 0.00 C ATOM 945 CG LYS A 61 -7.714 -6.336 -7.038 1.00 0.00 C ATOM 946 CD LYS A 61 -8.557 -7.601 -6.912 1.00 0.00 C ATOM 947 CE LYS A 61 -8.184 -8.583 -8.025 1.00 0.00 C ATOM 948 NZ LYS A 61 -9.207 -9.662 -7.943 1.00 0.00 N ATOM 0 H LYS A 61 -5.878 -7.062 -5.071 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.984 -4.456 -6.331 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.926 -6.334 -4.892 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.460 -4.853 -5.663 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -8.129 -5.680 -7.803 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.700 -6.587 -7.349 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -8.395 -8.062 -5.938 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -9.616 -7.351 -6.974 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.199 -8.098 -9.001 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.179 -8.980 -7.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.019 -10.375 -8.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.165 -10.110 -7.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.153 -9.256 -8.090 1.00 0.00 H new ATOM 962 N LEU A 62 -6.236 -4.592 -3.101 1.00 0.00 N ATOM 963 CA LEU A 62 -6.235 -3.741 -1.893 1.00 0.00 C ATOM 964 C LEU A 62 -5.008 -2.845 -1.936 1.00 0.00 C ATOM 965 O LEU A 62 -5.067 -1.670 -1.636 1.00 0.00 O ATOM 966 CB LEU A 62 -6.141 -4.719 -0.726 1.00 0.00 C ATOM 967 CG LEU A 62 -7.459 -5.476 -0.603 1.00 0.00 C ATOM 968 CD1 LEU A 62 -7.247 -6.751 0.216 1.00 0.00 C ATOM 969 CD2 LEU A 62 -8.486 -4.581 0.094 1.00 0.00 C ATOM 0 H LEU A 62 -6.140 -5.592 -2.927 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.116 -3.104 -1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -5.320 -5.417 -0.886 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.928 -4.182 0.198 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.821 -5.746 -1.595 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -8.191 -7.289 0.302 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.512 -7.384 -0.280 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.887 -6.489 1.211 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.432 -5.115 0.186 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.122 -4.314 1.086 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.637 -3.675 -0.493 1.00 0.00 H new ATOM 981 N CYS A 63 -3.895 -3.404 -2.325 1.00 0.00 N ATOM 982 CA CYS A 63 -2.648 -2.598 -2.406 1.00 0.00 C ATOM 983 C CYS A 63 -2.640 -1.791 -3.704 1.00 0.00 C ATOM 984 O CYS A 63 -2.132 -0.689 -3.763 1.00 0.00 O ATOM 985 CB CYS A 63 -1.506 -3.617 -2.395 1.00 0.00 C ATOM 986 SG CYS A 63 -1.134 -4.086 -0.686 1.00 0.00 S ATOM 0 H CYS A 63 -3.797 -4.384 -2.590 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.557 -1.888 -1.584 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.785 -4.498 -2.973 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -0.621 -3.192 -2.868 1.00 0.00 H new ATOM 0 HG CYS A 63 -1.695 -5.227 -0.417 1.00 0.00 H new ATOM 992 N HIS A 64 -3.213 -2.331 -4.744 1.00 0.00 N ATOM 993 CA HIS A 64 -3.254 -1.603 -6.036 1.00 0.00 C ATOM 994 C HIS A 64 -3.916 -0.244 -5.839 1.00 0.00 C ATOM 995 O HIS A 64 -3.621 0.705 -6.536 1.00 0.00 O ATOM 996 CB HIS A 64 -4.104 -2.484 -6.953 1.00 0.00 C ATOM 997 CG HIS A 64 -4.427 -1.737 -8.219 1.00 0.00 C ATOM 998 ND1 HIS A 64 -3.630 -0.708 -8.696 1.00 0.00 N ATOM 999 CD2 HIS A 64 -5.458 -1.860 -9.119 1.00 0.00 C ATOM 1000 CE1 HIS A 64 -4.188 -0.257 -9.835 1.00 0.00 C ATOM 1001 NE2 HIS A 64 -5.304 -0.925 -10.139 1.00 0.00 N ATOM 0 H HIS A 64 -3.656 -3.250 -4.751 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.262 -1.422 -6.449 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.568 -3.403 -7.189 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -5.024 -2.773 -6.445 1.00 0.00 H new ATOM 0 HD1 HIS A 64 -2.776 -0.357 -8.263 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -6.265 -2.574 -9.046 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -3.783 0.547 -10.431 1.00 0.00 H new ATOM 1009 N THR A 65 -4.814 -0.138 -4.897 1.00 0.00 N ATOM 1010 CA THR A 65 -5.484 1.170 -4.682 1.00 0.00 C ATOM 1011 C THR A 65 -4.631 2.078 -3.788 1.00 0.00 C ATOM 1012 O THR A 65 -4.394 3.223 -4.113 1.00 0.00 O ATOM 1013 CB THR A 65 -6.846 0.839 -4.044 1.00 0.00 C ATOM 1014 OG1 THR A 65 -7.869 1.485 -4.786 1.00 0.00 O ATOM 1015 CG2 THR A 65 -6.911 1.307 -2.585 1.00 0.00 C ATOM 0 H THR A 65 -5.108 -0.892 -4.276 1.00 0.00 H new ATOM 0 HA THR A 65 -5.618 1.720 -5.613 1.00 0.00 H new ATOM 0 HB THR A 65 -6.980 -0.243 -4.060 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.307 2.157 -4.223 1.00 0.00 H new ATOM 0 HG21 THR A 65 -7.886 1.057 -2.166 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.130 0.811 -2.009 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.763 2.386 -2.542 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.162 1.585 -2.670 1.00 0.00 N ATOM 1024 CA LEU A 66 -3.326 2.464 -1.796 1.00 0.00 C ATOM 1025 C LEU A 66 -2.276 3.137 -2.677 1.00 0.00 C ATOM 1026 O LEU A 66 -1.966 4.301 -2.529 1.00 0.00 O ATOM 1027 CB LEU A 66 -2.645 1.562 -0.751 1.00 0.00 C ATOM 1028 CG LEU A 66 -3.584 0.449 -0.266 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -2.989 -0.205 0.985 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -4.963 1.020 0.082 1.00 0.00 C ATOM 0 H LEU A 66 -4.316 0.636 -2.330 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.920 3.227 -1.294 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.747 1.119 -1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.326 2.166 0.099 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.694 -0.286 -1.063 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.653 -0.996 1.333 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.014 -0.629 0.745 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.876 0.544 1.769 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.614 0.216 0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.860 1.764 0.872 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.397 1.487 -0.802 1.00 0.00 H new ATOM 1042 N GLU A 67 -1.754 2.399 -3.619 1.00 0.00 N ATOM 1043 CA GLU A 67 -0.741 2.959 -4.555 1.00 0.00 C ATOM 1044 C GLU A 67 -1.443 3.889 -5.544 1.00 0.00 C ATOM 1045 O GLU A 67 -0.997 4.986 -5.807 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.146 1.714 -5.239 1.00 0.00 C ATOM 1047 CG GLU A 67 -0.129 1.859 -6.767 1.00 0.00 C ATOM 1048 CD GLU A 67 0.237 0.516 -7.400 1.00 0.00 C ATOM 1049 OE1 GLU A 67 0.064 -0.495 -6.739 1.00 0.00 O ATOM 1050 OE2 GLU A 67 0.686 0.520 -8.535 1.00 0.00 O ATOM 0 H GLU A 67 -1.990 1.420 -3.781 1.00 0.00 H new ATOM 0 HA GLU A 67 0.037 3.554 -4.077 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.869 1.551 -4.878 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.728 0.834 -4.963 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -1.105 2.187 -7.123 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.591 2.622 -7.063 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.547 3.458 -6.080 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.293 4.315 -7.036 1.00 0.00 C ATOM 1059 C ASN A 68 -3.591 5.657 -6.392 1.00 0.00 C ATOM 1060 O ASN A 68 -3.555 6.691 -7.027 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.594 3.581 -7.274 1.00 0.00 C ATOM 1062 CG ASN A 68 -4.925 3.578 -8.767 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -5.919 4.140 -9.182 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -4.129 2.964 -9.599 1.00 0.00 N ATOM 0 H ASN A 68 -2.966 2.546 -5.896 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.734 4.495 -7.954 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.516 2.557 -6.908 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.399 4.059 -6.715 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.342 2.956 -10.597 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -3.294 2.492 -9.252 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.879 5.652 -5.125 1.00 0.00 N ATOM 1072 CA ILE A 69 -4.165 6.936 -4.445 1.00 0.00 C ATOM 1073 C ILE A 69 -2.858 7.665 -4.332 1.00 0.00 C ATOM 1074 O ILE A 69 -2.724 8.848 -4.562 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.677 6.579 -3.054 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -5.753 5.496 -3.168 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -5.228 7.833 -2.361 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -7.144 6.115 -3.238 1.00 0.00 C ATOM 0 H ILE A 69 -3.928 4.821 -4.536 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.893 7.551 -4.973 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.857 6.191 -2.449 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -5.574 4.893 -4.058 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.692 4.826 -2.311 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.592 7.570 -1.368 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.436 8.577 -2.272 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -6.048 8.244 -2.950 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.890 5.325 -3.319 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -7.329 6.698 -2.336 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.209 6.766 -4.110 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.882 6.906 -4.016 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.514 7.444 -3.914 1.00 0.00 C ATOM 1092 C LEU A 70 -0.053 7.785 -5.318 1.00 0.00 C ATOM 1093 O LEU A 70 0.933 8.465 -5.521 1.00 0.00 O ATOM 1094 CB LEU A 70 0.319 6.328 -3.284 1.00 0.00 C ATOM 1095 CG LEU A 70 -0.175 6.096 -1.855 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.281 4.725 -1.358 1.00 0.00 C ATOM 1097 CD2 LEU A 70 0.386 7.187 -0.941 1.00 0.00 C ATOM 0 H LEU A 70 -1.967 5.909 -3.817 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.432 8.347 -3.309 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.228 5.413 -3.869 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.374 6.600 -3.280 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.264 6.132 -1.842 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -0.076 4.570 -0.340 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -0.125 3.949 -2.007 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.370 4.677 -1.372 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.035 7.024 0.078 1.00 0.00 H new ATOM 0 HD22 LEU A 70 1.475 7.153 -0.960 1.00 0.00 H new ATOM 0 HD23 LEU A 70 0.048 8.163 -1.289 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.799 7.345 -6.294 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.441 7.680 -7.690 1.00 0.00 C ATOM 1111 C ASP A 71 -1.020 9.049 -8.009 1.00 0.00 C ATOM 1112 O ASP A 71 -0.331 9.920 -8.500 1.00 0.00 O ATOM 1113 CB ASP A 71 -1.073 6.596 -8.563 1.00 0.00 C ATOM 1114 CG ASP A 71 -0.572 6.746 -9.999 1.00 0.00 C ATOM 1115 OD1 ASP A 71 -0.811 7.791 -10.582 1.00 0.00 O ATOM 1116 OD2 ASP A 71 0.040 5.815 -10.494 1.00 0.00 O ATOM 0 H ASP A 71 -1.635 6.772 -6.181 1.00 0.00 H new ATOM 0 HA ASP A 71 0.635 7.716 -7.859 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.818 5.609 -8.178 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.160 6.678 -8.535 1.00 0.00 H new ATOM 1121 N LYS A 72 -2.271 9.275 -7.695 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.824 10.629 -7.957 1.00 0.00 C ATOM 1123 C LYS A 72 -2.159 11.604 -6.993 1.00 0.00 C ATOM 1124 O LYS A 72 -2.105 12.795 -7.223 1.00 0.00 O ATOM 1125 CB LYS A 72 -4.344 10.570 -7.748 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.739 9.421 -6.820 1.00 0.00 C ATOM 1127 CD LYS A 72 -6.175 9.618 -6.404 1.00 0.00 C ATOM 1128 CE LYS A 72 -6.293 9.593 -4.877 1.00 0.00 C ATOM 1129 NZ LYS A 72 -7.657 9.058 -4.607 1.00 0.00 N ATOM 0 H LYS A 72 -2.914 8.600 -7.281 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.628 10.963 -8.976 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.691 11.514 -7.328 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.840 10.448 -8.711 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.619 8.464 -7.329 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.090 9.400 -5.945 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.545 10.568 -6.789 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.797 8.835 -6.837 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.525 8.960 -4.432 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.169 10.590 -4.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.686 8.648 -3.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.352 9.829 -4.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.886 8.323 -5.306 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.610 11.083 -5.934 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.890 11.941 -4.960 1.00 0.00 C ATOM 1145 C ALA A 73 0.357 12.494 -5.639 1.00 0.00 C ATOM 1146 O ALA A 73 0.706 13.648 -5.492 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.494 11.008 -3.818 1.00 0.00 C ATOM 0 H ALA A 73 -1.630 10.090 -5.701 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.490 12.777 -4.602 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.044 11.573 -3.057 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.390 10.570 -3.379 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.147 10.214 -4.202 1.00 0.00 H new ATOM 1153 N ARG A 74 1.024 11.669 -6.400 1.00 0.00 N ATOM 1154 CA ARG A 74 2.242 12.138 -7.111 1.00 0.00 C ATOM 1155 C ARG A 74 1.838 12.709 -8.468 1.00 0.00 C ATOM 1156 O ARG A 74 2.581 13.436 -9.096 1.00 0.00 O ATOM 1157 CB ARG A 74 3.119 10.895 -7.281 1.00 0.00 C ATOM 1158 CG ARG A 74 2.425 9.897 -8.209 1.00 0.00 C ATOM 1159 CD ARG A 74 3.460 9.256 -9.135 1.00 0.00 C ATOM 1160 NE ARG A 74 2.664 8.640 -10.233 1.00 0.00 N ATOM 1161 CZ ARG A 74 3.222 7.785 -11.050 1.00 0.00 C ATOM 1162 NH1 ARG A 74 4.471 7.444 -10.891 1.00 0.00 N ATOM 1163 NH2 ARG A 74 2.527 7.273 -12.028 1.00 0.00 N ATOM 0 H ARG A 74 0.777 10.692 -6.558 1.00 0.00 H new ATOM 0 HA ARG A 74 2.773 12.921 -6.569 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.088 11.176 -7.693 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.306 10.435 -6.311 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.921 9.129 -7.623 1.00 0.00 H new ATOM 0 HG3 ARG A 74 1.659 10.403 -8.797 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.158 9.999 -9.522 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.051 8.507 -8.608 1.00 0.00 H new ATOM 0 HE ARG A 74 1.681 8.886 -10.348 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.016 7.845 -10.127 1.00 0.00 H new ATOM 0 HH12 ARG A 74 4.903 6.777 -11.530 1.00 0.00 H new ATOM 0 HH21 ARG A 74 1.551 7.540 -12.154 1.00 0.00 H new ATOM 0 HH22 ARG A 74 2.960 6.606 -12.667 1.00 0.00 H new ATOM 1177 N ASN A 75 0.653 12.391 -8.916 1.00 0.00 N ATOM 1178 CA ASN A 75 0.185 12.923 -10.227 1.00 0.00 C ATOM 1179 C ASN A 75 -0.412 14.319 -10.030 1.00 0.00 C ATOM 1180 O ASN A 75 -0.897 14.935 -10.959 1.00 0.00 O ATOM 1181 CB ASN A 75 -0.885 11.939 -10.705 1.00 0.00 C ATOM 1182 CG ASN A 75 -0.845 11.845 -12.231 1.00 0.00 C ATOM 1183 OD1 ASN A 75 -1.604 12.506 -12.913 1.00 0.00 O ATOM 1184 ND2 ASN A 75 0.016 11.046 -12.801 1.00 0.00 N ATOM 0 H ASN A 75 -0.010 11.786 -8.431 1.00 0.00 H new ATOM 0 HA ASN A 75 0.993 13.015 -10.953 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.714 10.957 -10.265 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -1.871 12.268 -10.376 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.052 10.977 -13.818 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.653 10.491 -12.229 1.00 0.00 H new ATOM 1191 N SER A 76 -0.369 14.821 -8.821 1.00 0.00 N ATOM 1192 CA SER A 76 -0.917 16.181 -8.533 1.00 0.00 C ATOM 1193 C SER A 76 -2.447 16.165 -8.510 1.00 0.00 C ATOM 1194 O SER A 76 -3.085 17.139 -8.855 1.00 0.00 O ATOM 1195 CB SER A 76 -0.405 17.078 -9.663 1.00 0.00 C ATOM 1196 OG SER A 76 -1.423 17.219 -10.645 1.00 0.00 O ATOM 0 H SER A 76 0.027 14.341 -8.013 1.00 0.00 H new ATOM 0 HA SER A 76 -0.598 16.539 -7.554 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.125 18.055 -9.269 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.490 16.646 -10.110 1.00 0.00 H new ATOM 0 HG SER A 76 -1.503 16.386 -11.155 1.00 0.00 H new ATOM 1202 N GLU A 77 -3.053 15.080 -8.097 1.00 0.00 N ATOM 1203 CA GLU A 77 -4.541 15.052 -8.054 1.00 0.00 C ATOM 1204 C GLU A 77 -5.006 14.970 -6.606 1.00 0.00 C ATOM 1205 O GLU A 77 -6.069 15.441 -6.252 1.00 0.00 O ATOM 1206 CB GLU A 77 -4.994 13.809 -8.841 1.00 0.00 C ATOM 1207 CG GLU A 77 -3.860 13.287 -9.729 1.00 0.00 C ATOM 1208 CD GLU A 77 -4.444 12.503 -10.905 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -4.812 13.129 -11.885 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -4.512 11.289 -10.808 1.00 0.00 O ATOM 0 H GLU A 77 -2.587 14.225 -7.792 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.969 15.953 -8.493 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.309 13.029 -8.148 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -5.859 14.057 -9.456 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.261 14.120 -10.097 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -3.195 12.648 -9.148 1.00 0.00 H new ATOM 1217 N ILE A 78 -4.212 14.379 -5.768 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.602 14.266 -4.331 1.00 0.00 C ATOM 1219 C ILE A 78 -3.383 14.357 -3.409 1.00 0.00 C ATOM 1220 O ILE A 78 -2.262 14.518 -3.844 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.239 12.887 -4.203 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.255 11.828 -4.693 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.515 12.832 -5.043 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -3.845 10.930 -3.522 1.00 0.00 C ATOM 0 H ILE A 78 -3.310 13.968 -6.009 1.00 0.00 H new ATOM 0 HA ILE A 78 -5.274 15.074 -4.041 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.488 12.696 -3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.711 11.230 -5.481 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.375 12.306 -5.124 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.969 11.845 -4.950 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.216 13.589 -4.690 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.271 13.023 -6.088 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.142 10.174 -3.872 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.372 11.535 -2.748 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.729 10.442 -3.111 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.616 14.244 -2.130 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.510 14.302 -1.139 1.00 0.00 C ATOM 1238 C LYS A 79 -2.966 13.605 0.140 1.00 0.00 C ATOM 1239 O LYS A 79 -4.148 13.489 0.397 1.00 0.00 O ATOM 1240 CB LYS A 79 -2.270 15.789 -0.895 1.00 0.00 C ATOM 1241 CG LYS A 79 -3.588 16.455 -0.504 1.00 0.00 C ATOM 1242 CD LYS A 79 -3.409 17.187 0.823 1.00 0.00 C ATOM 1243 CE LYS A 79 -3.985 16.339 1.960 1.00 0.00 C ATOM 1244 NZ LYS A 79 -3.312 16.835 3.192 1.00 0.00 N ATOM 0 H LYS A 79 -4.543 14.112 -1.726 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.599 13.810 -1.479 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -1.532 15.925 -0.105 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.865 16.256 -1.793 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -3.899 17.155 -1.279 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -4.375 15.706 -0.416 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -2.352 17.383 1.002 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -3.911 18.154 0.787 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.067 16.453 2.028 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.786 15.279 1.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -2.899 16.033 3.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -2.559 17.503 2.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.007 17.316 3.798 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.060 13.125 0.941 1.00 0.00 N ATOM 1259 CA ILE A 80 -2.490 12.432 2.180 1.00 0.00 C ATOM 1260 C ILE A 80 -3.192 13.403 3.114 1.00 0.00 C ATOM 1261 O ILE A 80 -2.582 14.149 3.854 1.00 0.00 O ATOM 1262 CB ILE A 80 -1.214 11.897 2.797 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -0.898 10.544 2.168 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -1.374 11.738 4.314 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.925 10.668 0.642 1.00 0.00 C ATOM 0 H ILE A 80 -1.052 13.182 0.793 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.202 11.631 1.981 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.401 12.598 2.611 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.082 10.198 2.498 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.625 9.801 2.495 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.447 11.353 4.739 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.602 12.706 4.759 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.186 11.042 4.523 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.699 9.700 0.194 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.914 10.994 0.321 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -0.181 11.398 0.323 1.00 0.00 H new ATOM 1277 N THR A 81 -4.475 13.360 3.088 1.00 0.00 N ATOM 1278 CA THR A 81 -5.286 14.235 3.977 1.00 0.00 C ATOM 1279 C THR A 81 -5.388 13.593 5.359 1.00 0.00 C ATOM 1280 O THR A 81 -6.151 14.025 6.200 1.00 0.00 O ATOM 1281 CB THR A 81 -6.669 14.276 3.328 1.00 0.00 C ATOM 1282 OG1 THR A 81 -7.329 13.038 3.554 1.00 0.00 O ATOM 1283 CG2 THR A 81 -6.530 14.513 1.825 1.00 0.00 C ATOM 0 H THR A 81 -5.018 12.747 2.480 1.00 0.00 H new ATOM 0 HA THR A 81 -4.854 15.229 4.096 1.00 0.00 H new ATOM 0 HB THR A 81 -7.250 15.088 3.765 1.00 0.00 H new ATOM 0 HG1 THR A 81 -8.153 13.005 3.024 1.00 0.00 H new ATOM 0 HG21 THR A 81 -7.519 14.541 1.368 1.00 0.00 H new ATOM 0 HG22 THR A 81 -6.023 15.462 1.652 1.00 0.00 H new ATOM 0 HG23 THR A 81 -5.948 13.705 1.381 1.00 0.00 H new ATOM 1291 N SER A 82 -4.652 12.526 5.579 1.00 0.00 N ATOM 1292 CA SER A 82 -4.721 11.798 6.882 1.00 0.00 C ATOM 1293 C SER A 82 -5.992 10.943 6.909 1.00 0.00 C ATOM 1294 O SER A 82 -6.186 10.119 7.780 1.00 0.00 O ATOM 1295 CB SER A 82 -4.755 12.868 7.969 1.00 0.00 C ATOM 1296 OG SER A 82 -4.059 14.023 7.515 1.00 0.00 O ATOM 0 H SER A 82 -4.001 12.128 4.902 1.00 0.00 H new ATOM 0 HA SER A 82 -3.871 11.133 7.032 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.787 13.123 8.212 1.00 0.00 H new ATOM 0 HB3 SER A 82 -4.297 12.489 8.883 1.00 0.00 H new ATOM 0 HG SER A 82 -4.705 14.710 7.248 1.00 0.00 H new ATOM 1302 N ASP A 83 -6.845 11.122 5.934 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.090 10.324 5.851 1.00 0.00 C ATOM 1304 C ASP A 83 -7.978 9.394 4.650 1.00 0.00 C ATOM 1305 O ASP A 83 -8.397 8.254 4.692 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.206 11.341 5.636 1.00 0.00 C ATOM 1307 CG ASP A 83 -9.299 12.267 6.850 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -9.306 11.758 7.959 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -9.361 13.468 6.650 1.00 0.00 O ATOM 0 H ASP A 83 -6.723 11.801 5.182 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.275 9.719 6.739 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.012 11.924 4.736 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -10.155 10.827 5.484 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.378 9.860 3.583 1.00 0.00 N ATOM 1315 CA LEU A 84 -7.210 8.971 2.405 1.00 0.00 C ATOM 1316 C LEU A 84 -6.350 7.798 2.848 1.00 0.00 C ATOM 1317 O LEU A 84 -6.415 6.709 2.313 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.490 9.809 1.343 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.198 11.157 1.157 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.858 11.720 -0.224 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.716 10.975 1.266 1.00 0.00 C ATOM 0 H LEU A 84 -7.004 10.804 3.481 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.150 8.590 2.006 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.454 9.973 1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.468 9.268 0.397 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.863 11.845 1.933 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.360 12.678 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.780 11.860 -0.305 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -7.192 11.024 -0.993 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.208 11.938 1.132 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -9.056 10.284 0.495 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.965 10.574 2.248 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.555 8.029 3.854 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.686 6.958 4.395 1.00 0.00 C ATOM 1335 C LEU A 85 -5.488 6.091 5.366 1.00 0.00 C ATOM 1336 O LEU A 85 -5.497 4.882 5.274 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.590 7.705 5.146 1.00 0.00 C ATOM 1338 CG LEU A 85 -2.695 8.450 4.160 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -1.487 9.002 4.910 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -2.218 7.492 3.067 1.00 0.00 C ATOM 0 H LEU A 85 -5.472 8.928 4.328 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.288 6.302 3.621 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -4.035 8.409 5.849 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.995 7.003 5.731 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.255 9.265 3.702 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.840 9.537 4.214 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.824 9.685 5.690 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.933 8.180 5.362 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -1.579 8.029 2.366 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.654 6.676 3.519 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.080 7.087 2.536 1.00 0.00 H new ATOM 1352 N ASP A 86 -6.163 6.705 6.300 1.00 0.00 N ATOM 1353 CA ASP A 86 -6.969 5.918 7.282 1.00 0.00 C ATOM 1354 C ASP A 86 -7.753 4.828 6.557 1.00 0.00 C ATOM 1355 O ASP A 86 -7.978 3.756 7.083 1.00 0.00 O ATOM 1356 CB ASP A 86 -7.922 6.926 7.928 1.00 0.00 C ATOM 1357 CG ASP A 86 -7.147 7.810 8.905 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -5.928 7.766 8.875 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -7.784 8.518 9.667 1.00 0.00 O ATOM 0 H ASP A 86 -6.192 7.717 6.427 1.00 0.00 H new ATOM 0 HA ASP A 86 -6.343 5.425 8.026 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.393 7.540 7.160 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.722 6.402 8.452 1.00 0.00 H new ATOM 1364 N LYS A 87 -8.154 5.084 5.347 1.00 0.00 N ATOM 1365 CA LYS A 87 -8.900 4.048 4.586 1.00 0.00 C ATOM 1366 C LYS A 87 -7.891 3.172 3.855 1.00 0.00 C ATOM 1367 O LYS A 87 -7.932 1.959 3.931 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.776 4.820 3.603 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.528 5.928 4.349 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.159 5.352 5.619 1.00 0.00 C ATOM 1371 CE LYS A 87 -12.463 6.096 5.924 1.00 0.00 C ATOM 1372 NZ LYS A 87 -13.546 5.166 5.498 1.00 0.00 N ATOM 0 H LYS A 87 -7.999 5.963 4.853 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.509 3.401 5.217 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -9.161 5.251 2.813 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -10.484 4.145 3.123 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.844 6.737 4.605 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.300 6.354 3.708 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.357 4.288 5.489 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.468 5.448 6.457 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.542 6.335 6.985 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.516 7.039 5.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.471 5.606 5.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.449 4.962 4.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.475 4.280 6.038 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.961 3.782 3.176 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.920 2.988 2.475 1.00 0.00 C ATOM 1388 C ILE A 88 -5.205 2.121 3.511 1.00 0.00 C ATOM 1389 O ILE A 88 -4.696 1.058 3.216 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.981 4.033 1.870 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -5.572 4.522 0.553 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -3.603 3.423 1.626 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -5.036 5.921 0.244 1.00 0.00 C ATOM 0 H ILE A 88 -6.878 4.794 3.077 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.309 2.323 1.704 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.872 4.870 2.560 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.312 3.835 -0.252 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -6.660 4.543 0.615 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.943 4.176 1.195 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.187 3.074 2.571 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -3.694 2.583 0.937 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -5.458 6.272 -0.698 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.318 6.604 1.045 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.950 5.885 0.164 1.00 0.00 H new ATOM 1405 N PHE A 89 -5.201 2.570 4.736 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.565 1.785 5.829 1.00 0.00 C ATOM 1407 C PHE A 89 -5.553 0.731 6.297 1.00 0.00 C ATOM 1408 O PHE A 89 -5.192 -0.347 6.723 1.00 0.00 O ATOM 1409 CB PHE A 89 -4.269 2.800 6.938 1.00 0.00 C ATOM 1410 CG PHE A 89 -4.099 2.080 8.256 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -5.223 1.761 9.029 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -2.821 1.735 8.707 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -5.067 1.096 10.251 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -2.665 1.070 9.930 1.00 0.00 C ATOM 1415 CZ PHE A 89 -3.788 0.751 10.701 1.00 0.00 C ATOM 0 H PHE A 89 -5.615 3.455 5.028 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.653 1.274 5.522 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.365 3.360 6.700 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.082 3.522 7.010 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.210 2.028 8.682 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.954 1.981 8.112 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.934 0.849 10.846 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.678 0.804 10.278 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.668 0.238 11.644 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.805 1.035 6.174 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.851 0.056 6.558 1.00 0.00 C ATOM 1427 C ALA A 90 -7.816 -1.063 5.528 1.00 0.00 C ATOM 1428 O ALA A 90 -8.166 -2.195 5.796 1.00 0.00 O ATOM 1429 CB ALA A 90 -9.174 0.820 6.494 1.00 0.00 C ATOM 0 H ALA A 90 -7.154 1.926 5.821 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.712 -0.374 7.550 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.992 0.154 6.767 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.143 1.660 7.188 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.331 1.191 5.481 1.00 0.00 H new ATOM 1435 N GLY A 91 -7.353 -0.742 4.349 1.00 0.00 N ATOM 1436 CA GLY A 91 -7.240 -1.767 3.288 1.00 0.00 C ATOM 1437 C GLY A 91 -6.100 -2.699 3.678 1.00 0.00 C ATOM 1438 O GLY A 91 -6.236 -3.905 3.681 1.00 0.00 O ATOM 0 H GLY A 91 -7.048 0.194 4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.173 -2.322 3.189 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.042 -1.301 2.323 1.00 0.00 H new ATOM 1442 N VAL A 92 -4.982 -2.134 4.052 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.838 -2.969 4.493 1.00 0.00 C ATOM 1444 C VAL A 92 -4.272 -3.745 5.736 1.00 0.00 C ATOM 1445 O VAL A 92 -3.761 -4.803 6.044 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.730 -1.971 4.827 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.717 -2.613 5.781 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -2.018 -1.557 3.538 1.00 0.00 C ATOM 0 H VAL A 92 -4.816 -1.128 4.069 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.502 -3.689 3.746 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.168 -1.096 5.306 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.931 -1.895 6.014 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.221 -2.910 6.701 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.278 -3.491 5.308 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.227 -0.845 3.772 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.585 -2.437 3.063 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.734 -1.093 2.860 1.00 0.00 H new ATOM 1458 N ASP A 93 -5.241 -3.216 6.437 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.759 -3.899 7.653 1.00 0.00 C ATOM 1460 C ASP A 93 -6.539 -5.137 7.226 1.00 0.00 C ATOM 1461 O ASP A 93 -6.409 -6.199 7.800 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.681 -2.876 8.321 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.054 -2.402 9.634 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -6.287 -3.044 10.645 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -5.353 -1.403 9.606 1.00 0.00 O ATOM 0 H ASP A 93 -5.698 -2.332 6.214 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.971 -4.223 8.333 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.842 -2.028 7.656 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.657 -3.321 8.512 1.00 0.00 H new ATOM 1470 N MET A 94 -7.322 -5.016 6.188 1.00 0.00 N ATOM 1471 CA MET A 94 -8.074 -6.197 5.693 1.00 0.00 C ATOM 1472 C MET A 94 -7.068 -7.111 5.011 1.00 0.00 C ATOM 1473 O MET A 94 -7.180 -8.321 5.024 1.00 0.00 O ATOM 1474 CB MET A 94 -9.089 -5.648 4.688 1.00 0.00 C ATOM 1475 CG MET A 94 -10.204 -4.909 5.434 1.00 0.00 C ATOM 1476 SD MET A 94 -11.657 -4.767 4.363 1.00 0.00 S ATOM 1477 CE MET A 94 -10.792 -4.200 2.877 1.00 0.00 C ATOM 0 H MET A 94 -7.471 -4.153 5.665 1.00 0.00 H new ATOM 0 HA MET A 94 -8.586 -6.758 6.475 1.00 0.00 H new ATOM 0 HB2 MET A 94 -8.595 -4.972 3.990 1.00 0.00 H new ATOM 0 HB3 MET A 94 -9.510 -6.463 4.099 1.00 0.00 H new ATOM 0 HG2 MET A 94 -10.463 -5.446 6.347 1.00 0.00 H new ATOM 0 HG3 MET A 94 -9.861 -3.918 5.733 1.00 0.00 H new ATOM 0 HE1 MET A 94 -11.501 -3.715 2.206 1.00 0.00 H new ATOM 0 HE2 MET A 94 -10.014 -3.490 3.158 1.00 0.00 H new ATOM 0 HE3 MET A 94 -10.340 -5.053 2.371 1.00 0.00 H new ATOM 1487 N ILE A 95 -6.059 -6.516 4.443 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.990 -7.298 3.779 1.00 0.00 C ATOM 1489 C ILE A 95 -4.277 -8.150 4.834 1.00 0.00 C ATOM 1490 O ILE A 95 -3.860 -9.262 4.575 1.00 0.00 O ATOM 1491 CB ILE A 95 -4.062 -6.219 3.210 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -4.536 -5.822 1.811 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -2.626 -6.730 3.137 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -3.754 -4.595 1.338 1.00 0.00 C ATOM 0 H ILE A 95 -5.931 -5.505 4.412 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.343 -7.980 3.006 1.00 0.00 H new ATOM 0 HB ILE A 95 -4.091 -5.351 3.869 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -4.390 -6.650 1.117 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -5.604 -5.603 1.825 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -1.982 -5.950 2.731 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -2.284 -6.998 4.137 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.584 -7.607 2.492 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.091 -4.311 0.341 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.923 -3.768 2.027 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.690 -4.831 1.308 1.00 0.00 H new ATOM 1506 N THR A 96 -4.145 -7.631 6.025 1.00 0.00 N ATOM 1507 CA THR A 96 -3.473 -8.401 7.107 1.00 0.00 C ATOM 1508 C THR A 96 -4.417 -9.485 7.626 1.00 0.00 C ATOM 1509 O THR A 96 -4.022 -10.611 7.852 1.00 0.00 O ATOM 1510 CB THR A 96 -3.177 -7.372 8.203 1.00 0.00 C ATOM 1511 OG1 THR A 96 -2.034 -6.610 7.839 1.00 0.00 O ATOM 1512 CG2 THR A 96 -2.912 -8.088 9.528 1.00 0.00 C ATOM 0 H THR A 96 -4.475 -6.704 6.294 1.00 0.00 H new ATOM 0 HA THR A 96 -2.565 -8.898 6.767 1.00 0.00 H new ATOM 0 HB THR A 96 -4.036 -6.711 8.318 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.299 -5.900 7.218 1.00 0.00 H new ATOM 0 HG21 THR A 96 -2.702 -7.352 10.304 1.00 0.00 H new ATOM 0 HG22 THR A 96 -3.789 -8.671 9.809 1.00 0.00 H new ATOM 0 HG23 THR A 96 -2.055 -8.753 9.417 1.00 0.00 H new ATOM 1520 N ARG A 97 -5.665 -9.154 7.815 1.00 0.00 N ATOM 1521 CA ARG A 97 -6.631 -10.169 8.314 1.00 0.00 C ATOM 1522 C ARG A 97 -6.762 -11.300 7.299 1.00 0.00 C ATOM 1523 O ARG A 97 -6.742 -12.463 7.646 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.953 -9.414 8.462 1.00 0.00 C ATOM 1525 CG ARG A 97 -8.007 -8.697 9.819 1.00 0.00 C ATOM 1526 CD ARG A 97 -6.622 -8.160 10.193 1.00 0.00 C ATOM 1527 NE ARG A 97 -6.865 -7.208 11.312 1.00 0.00 N ATOM 1528 CZ ARG A 97 -6.838 -7.631 12.545 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -7.814 -8.367 13.004 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -5.836 -7.319 13.323 1.00 0.00 N ATOM 0 H ARG A 97 -6.055 -8.227 7.646 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.318 -10.621 9.255 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -8.058 -8.689 7.655 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.788 -10.109 8.376 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.723 -7.876 9.776 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.357 -9.386 10.588 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -5.956 -8.967 10.499 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -6.151 -7.661 9.346 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.053 -6.225 11.114 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -8.597 -8.611 12.398 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -7.793 -8.698 13.969 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -5.073 -6.744 12.966 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -5.817 -7.651 14.287 1.00 0.00 H new ATOM 1544 N MET A 98 -6.877 -10.971 6.041 1.00 0.00 N ATOM 1545 CA MET A 98 -6.984 -12.040 5.013 1.00 0.00 C ATOM 1546 C MET A 98 -5.643 -12.758 4.922 1.00 0.00 C ATOM 1547 O MET A 98 -5.557 -13.906 4.534 1.00 0.00 O ATOM 1548 CB MET A 98 -7.313 -11.314 3.705 1.00 0.00 C ATOM 1549 CG MET A 98 -6.090 -10.539 3.211 1.00 0.00 C ATOM 1550 SD MET A 98 -6.333 -10.079 1.477 1.00 0.00 S ATOM 1551 CE MET A 98 -8.074 -9.609 1.604 1.00 0.00 C ATOM 0 H MET A 98 -6.901 -10.016 5.685 1.00 0.00 H new ATOM 0 HA MET A 98 -7.745 -12.785 5.243 1.00 0.00 H new ATOM 0 HB2 MET A 98 -7.626 -12.034 2.949 1.00 0.00 H new ATOM 0 HB3 MET A 98 -8.148 -10.631 3.860 1.00 0.00 H new ATOM 0 HG2 MET A 98 -5.941 -9.646 3.819 1.00 0.00 H new ATOM 0 HG3 MET A 98 -5.192 -11.149 3.315 1.00 0.00 H new ATOM 0 HE1 MET A 98 -8.431 -9.269 0.632 1.00 0.00 H new ATOM 0 HE2 MET A 98 -8.661 -10.470 1.925 1.00 0.00 H new ATOM 0 HE3 MET A 98 -8.182 -8.805 2.332 1.00 0.00 H new ATOM 1561 N VAL A 99 -4.591 -12.082 5.296 1.00 0.00 N ATOM 1562 CA VAL A 99 -3.247 -12.703 5.257 1.00 0.00 C ATOM 1563 C VAL A 99 -3.014 -13.491 6.552 1.00 0.00 C ATOM 1564 O VAL A 99 -2.485 -14.585 6.534 1.00 0.00 O ATOM 1565 CB VAL A 99 -2.273 -11.522 5.133 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.912 -11.887 5.737 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -2.088 -11.171 3.655 1.00 0.00 C ATOM 0 H VAL A 99 -4.611 -11.118 5.629 1.00 0.00 H new ATOM 0 HA VAL A 99 -3.121 -13.406 4.434 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.684 -10.668 5.672 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.233 -11.040 5.642 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -1.037 -12.135 6.791 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.498 -12.746 5.208 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -1.397 -10.333 3.564 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.685 -12.033 3.124 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -3.050 -10.896 3.223 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.423 -12.959 7.677 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.237 -13.711 8.949 1.00 0.00 C ATOM 1579 C ASP A 100 -4.071 -14.979 8.866 1.00 0.00 C ATOM 1580 O ASP A 100 -3.703 -16.023 9.366 1.00 0.00 O ATOM 1581 CB ASP A 100 -3.753 -12.787 10.053 1.00 0.00 C ATOM 1582 CG ASP A 100 -4.013 -13.603 11.321 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -3.071 -13.820 12.066 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -5.149 -13.996 11.526 1.00 0.00 O ATOM 0 H ASP A 100 -3.872 -12.048 7.767 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.202 -13.993 9.140 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -3.024 -12.003 10.256 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.670 -12.294 9.730 1.00 0.00 H new ATOM 1589 N LYS A 101 -5.182 -14.891 8.197 1.00 0.00 N ATOM 1590 CA LYS A 101 -6.043 -16.081 8.024 1.00 0.00 C ATOM 1591 C LYS A 101 -5.454 -16.936 6.898 1.00 0.00 C ATOM 1592 O LYS A 101 -5.716 -18.114 6.790 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.419 -15.509 7.660 1.00 0.00 C ATOM 1594 CG LYS A 101 -7.602 -15.528 6.148 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.018 -16.924 5.720 1.00 0.00 C ATOM 1596 CE LYS A 101 -9.444 -16.881 5.164 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.117 -18.086 5.726 1.00 0.00 N ATOM 0 H LYS A 101 -5.531 -14.038 7.760 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.115 -16.719 8.905 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.204 -16.094 8.138 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.509 -14.489 8.034 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -8.358 -14.802 5.851 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -6.674 -15.243 5.652 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -7.332 -17.304 4.963 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -7.967 -17.607 6.568 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.957 -15.967 5.464 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.443 -16.902 4.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -10.497 -18.665 4.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -9.430 -18.645 6.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.894 -17.790 6.350 1.00 0.00 H new ATOM 1611 N ILE A 102 -4.639 -16.338 6.071 1.00 0.00 N ATOM 1612 CA ILE A 102 -3.999 -17.096 4.964 1.00 0.00 C ATOM 1613 C ILE A 102 -2.905 -17.960 5.577 1.00 0.00 C ATOM 1614 O ILE A 102 -2.845 -19.156 5.371 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.444 -16.012 4.032 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -4.392 -15.849 2.848 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.050 -16.376 3.517 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.176 -14.482 2.197 1.00 0.00 C ATOM 0 H ILE A 102 -4.389 -15.350 6.117 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.664 -17.760 4.412 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.364 -15.081 4.593 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.218 -16.641 2.119 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.425 -15.944 3.182 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -1.687 -15.586 2.860 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.368 -16.488 4.360 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -2.100 -17.314 2.964 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.855 -14.370 1.352 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.372 -13.696 2.927 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.146 -14.404 1.848 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.067 -17.363 6.375 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.014 -18.151 7.054 1.00 0.00 C ATOM 1632 C VAL A 103 -1.717 -19.181 7.933 1.00 0.00 C ATOM 1633 O VAL A 103 -1.214 -20.255 8.196 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.249 -17.137 7.904 1.00 0.00 C ATOM 1635 CG1 VAL A 103 0.562 -17.872 8.972 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.696 -16.329 7.011 1.00 0.00 C ATOM 0 H VAL A 103 -2.069 -16.365 6.584 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.339 -18.674 6.377 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.957 -16.463 8.386 1.00 0.00 H new ATOM 0 HG11 VAL A 103 1.107 -17.148 9.577 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.111 -18.445 9.610 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.269 -18.548 8.491 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.241 -15.606 7.618 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.403 -17.002 6.526 1.00 0.00 H new ATOM 0 HG23 VAL A 103 0.118 -15.802 6.252 1.00 0.00 H new ATOM 1646 N SER A 104 -2.904 -18.845 8.371 1.00 0.00 N ATOM 1647 CA SER A 104 -3.692 -19.776 9.222 1.00 0.00 C ATOM 1648 C SER A 104 -4.401 -20.803 8.351 1.00 0.00 C ATOM 1649 O SER A 104 -4.188 -21.995 8.462 1.00 0.00 O ATOM 1650 CB SER A 104 -4.712 -18.891 9.936 1.00 0.00 C ATOM 1651 OG SER A 104 -5.638 -19.711 10.637 1.00 0.00 O ATOM 0 H SER A 104 -3.362 -17.956 8.171 1.00 0.00 H new ATOM 0 HA SER A 104 -3.066 -20.326 9.924 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.206 -18.220 10.630 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.237 -18.266 9.214 1.00 0.00 H new ATOM 0 HG SER A 104 -6.293 -19.145 11.097 1.00 0.00 H new ATOM 1657 N GLU A 105 -5.239 -20.337 7.485 1.00 0.00 N ATOM 1658 CA GLU A 105 -5.984 -21.262 6.582 1.00 0.00 C ATOM 1659 C GLU A 105 -5.375 -21.225 5.181 1.00 0.00 C ATOM 1660 O GLU A 105 -5.223 -22.238 4.526 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.416 -20.724 6.547 1.00 0.00 C ATOM 1662 CG GLU A 105 -7.847 -20.310 7.955 1.00 0.00 C ATOM 1663 CD GLU A 105 -9.333 -20.620 8.147 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -10.117 -20.207 7.309 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -9.661 -21.265 9.129 1.00 0.00 O ATOM 0 H GLU A 105 -5.448 -19.347 7.356 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.945 -22.295 6.929 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.477 -19.870 5.872 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.092 -21.486 6.159 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.255 -20.842 8.699 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.665 -19.246 8.104 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.034 -20.058 4.718 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.442 -19.932 3.356 1.00 0.00 C ATOM 1674 C GLY A 106 -5.465 -19.287 2.419 1.00 0.00 C ATOM 1675 O GLY A 106 -5.412 -19.455 1.216 1.00 0.00 O ATOM 0 H GLY A 106 -5.140 -19.180 5.226 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -3.536 -19.328 3.395 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.155 -20.914 2.979 1.00 0.00 H new ATOM 1679 N SER A 107 -6.398 -18.549 2.962 1.00 0.00 N ATOM 1680 CA SER A 107 -7.429 -17.893 2.096 1.00 0.00 C ATOM 1681 C SER A 107 -7.468 -16.389 2.338 1.00 0.00 C ATOM 1682 O SER A 107 -7.612 -15.923 3.445 1.00 0.00 O ATOM 1683 CB SER A 107 -8.756 -18.524 2.491 1.00 0.00 C ATOM 1684 OG SER A 107 -8.848 -19.823 1.920 1.00 0.00 O ATOM 0 H SER A 107 -6.493 -18.371 3.962 1.00 0.00 H new ATOM 0 HA SER A 107 -7.207 -18.035 1.038 1.00 0.00 H new ATOM 0 HB2 SER A 107 -8.834 -18.585 3.577 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.583 -17.904 2.147 1.00 0.00 H new ATOM 0 HG SER A 107 -9.701 -20.232 2.174 1.00 0.00 H new ATOM 1690 N ASP A 108 -7.356 -15.622 1.304 1.00 0.00 N ATOM 1691 CA ASP A 108 -7.403 -14.150 1.482 1.00 0.00 C ATOM 1692 C ASP A 108 -8.858 -13.699 1.531 1.00 0.00 C ATOM 1693 O ASP A 108 -9.155 -12.521 1.534 1.00 0.00 O ATOM 1694 CB ASP A 108 -6.697 -13.573 0.255 1.00 0.00 C ATOM 1695 CG ASP A 108 -7.349 -14.125 -1.015 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -7.177 -15.304 -1.280 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -8.007 -13.360 -1.699 1.00 0.00 O ATOM 0 H ASP A 108 -7.234 -15.945 0.344 1.00 0.00 H new ATOM 0 HA ASP A 108 -6.925 -13.820 2.404 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.759 -12.485 0.265 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.639 -13.832 0.276 1.00 0.00 H new ATOM 1702 N ASP A 109 -9.773 -14.631 1.569 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.211 -14.242 1.616 1.00 0.00 C ATOM 1704 C ASP A 109 -11.645 -13.980 3.066 1.00 0.00 C ATOM 1705 O ASP A 109 -11.620 -14.858 3.905 1.00 0.00 O ATOM 1706 CB ASP A 109 -11.972 -15.425 0.996 1.00 0.00 C ATOM 1707 CG ASP A 109 -12.302 -16.475 2.063 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -13.259 -16.269 2.791 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -11.595 -17.466 2.131 1.00 0.00 O ATOM 0 H ASP A 109 -9.589 -15.634 1.570 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.412 -13.320 1.070 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -12.892 -15.069 0.532 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -11.371 -15.877 0.207 1.00 0.00 H new ATOM 1714 N ILE A 110 -12.044 -12.772 3.364 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.484 -12.452 4.753 1.00 0.00 C ATOM 1716 C ILE A 110 -13.722 -11.552 4.714 1.00 0.00 C ATOM 1717 O ILE A 110 -14.033 -10.864 5.666 1.00 0.00 O ATOM 1718 CB ILE A 110 -11.306 -11.711 5.394 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -10.757 -10.679 4.409 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -10.200 -12.704 5.759 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -10.090 -9.543 5.185 1.00 0.00 C ATOM 0 H ILE A 110 -12.084 -11.994 2.706 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.751 -13.347 5.315 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.649 -11.209 6.299 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.037 -11.147 3.738 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.563 -10.287 3.789 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -9.366 -12.169 6.214 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -10.589 -13.438 6.465 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.856 -13.213 4.858 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.698 -8.806 4.485 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.823 -9.069 5.838 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -9.273 -9.943 5.786 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.429 -11.551 3.615 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.644 -10.695 3.509 1.00 0.00 C ATOM 1735 C GLY A 111 -15.227 -9.240 3.280 1.00 0.00 C ATOM 1736 O GLY A 111 -16.052 -8.350 3.219 1.00 0.00 O ATOM 0 H GLY A 111 -14.217 -12.107 2.786 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.272 -11.038 2.687 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.238 -10.775 4.419 1.00 0.00 H new ATOM 1740 N GLU A 112 -13.951 -8.989 3.159 1.00 0.00 N ATOM 1741 CA GLU A 112 -13.482 -7.589 2.940 1.00 0.00 C ATOM 1742 C GLU A 112 -13.951 -7.068 1.579 1.00 0.00 C ATOM 1743 O GLU A 112 -14.761 -7.681 0.912 1.00 0.00 O ATOM 1744 CB GLU A 112 -11.959 -7.672 2.981 1.00 0.00 C ATOM 1745 CG GLU A 112 -11.490 -8.677 1.935 1.00 0.00 C ATOM 1746 CD GLU A 112 -10.903 -7.932 0.734 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -11.102 -6.732 0.650 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -10.265 -8.576 -0.082 1.00 0.00 O ATOM 0 H GLU A 112 -13.213 -9.692 3.202 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.878 -6.905 3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.523 -6.693 2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.625 -7.977 3.973 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -10.741 -9.342 2.365 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -12.325 -9.301 1.616 1.00 0.00 H new ATOM 1755 N ASN A 113 -13.447 -5.937 1.164 1.00 0.00 N ATOM 1756 CA ASN A 113 -13.860 -5.367 -0.152 1.00 0.00 C ATOM 1757 C ASN A 113 -12.700 -4.594 -0.782 1.00 0.00 C ATOM 1758 O ASN A 113 -11.893 -3.997 -0.095 1.00 0.00 O ATOM 1759 CB ASN A 113 -15.023 -4.429 0.175 1.00 0.00 C ATOM 1760 CG ASN A 113 -16.245 -5.256 0.578 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -16.506 -5.444 1.750 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -17.011 -5.764 -0.349 1.00 0.00 N ATOM 0 H ASN A 113 -12.765 -5.381 1.681 1.00 0.00 H new ATOM 0 HA ASN A 113 -14.147 -6.138 -0.867 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -14.744 -3.754 0.984 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -15.259 -3.809 -0.690 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -17.827 -6.318 -0.089 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -16.793 -5.607 -1.333 1.00 0.00 H new ATOM 1769 N ILE A 114 -12.610 -4.597 -2.085 1.00 0.00 N ATOM 1770 CA ILE A 114 -11.501 -3.858 -2.759 1.00 0.00 C ATOM 1771 C ILE A 114 -12.034 -3.153 -3.999 1.00 0.00 C ATOM 1772 O ILE A 114 -12.132 -1.947 -4.037 1.00 0.00 O ATOM 1773 CB ILE A 114 -10.461 -4.909 -3.159 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.427 -6.037 -2.129 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -9.082 -4.261 -3.240 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -11.500 -7.057 -2.492 1.00 0.00 C ATOM 0 H ILE A 114 -13.255 -5.078 -2.712 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.066 -3.104 -2.103 1.00 0.00 H new ATOM 0 HB ILE A 114 -10.733 -5.320 -4.131 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -9.445 -6.509 -2.117 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -10.603 -5.642 -1.129 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -8.344 -5.011 -3.525 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -9.097 -3.465 -3.985 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -8.819 -3.843 -2.268 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -11.490 -7.870 -1.766 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -12.478 -6.575 -2.483 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.301 -7.456 -3.487 1.00 0.00 H new ATOM 1788 N ASP A 115 -12.388 -3.896 -5.016 1.00 0.00 N ATOM 1789 CA ASP A 115 -12.923 -3.250 -6.246 1.00 0.00 C ATOM 1790 C ASP A 115 -13.866 -2.127 -5.846 1.00 0.00 C ATOM 1791 O ASP A 115 -13.838 -1.039 -6.383 1.00 0.00 O ATOM 1792 CB ASP A 115 -13.673 -4.356 -6.990 1.00 0.00 C ATOM 1793 CG ASP A 115 -14.631 -5.058 -6.027 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -14.160 -5.578 -5.030 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -15.819 -5.063 -6.302 1.00 0.00 O ATOM 0 H ASP A 115 -12.330 -4.914 -5.046 1.00 0.00 H new ATOM 0 HA ASP A 115 -12.143 -2.816 -6.872 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -14.227 -3.934 -7.828 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -12.966 -5.074 -7.405 1.00 0.00 H new ATOM 1800 N VAL A 116 -14.680 -2.395 -4.882 1.00 0.00 N ATOM 1801 CA VAL A 116 -15.630 -1.364 -4.387 1.00 0.00 C ATOM 1802 C VAL A 116 -15.025 -0.600 -3.215 1.00 0.00 C ATOM 1803 O VAL A 116 -15.206 0.591 -3.077 1.00 0.00 O ATOM 1804 CB VAL A 116 -16.880 -2.133 -3.960 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -17.753 -1.243 -3.071 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -17.672 -2.539 -5.206 1.00 0.00 C ATOM 0 H VAL A 116 -14.734 -3.295 -4.404 1.00 0.00 H new ATOM 0 HA VAL A 116 -15.863 -0.622 -5.151 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.587 -3.023 -3.403 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.644 -1.793 -2.768 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -17.189 -0.949 -2.186 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -18.048 -0.352 -3.626 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.565 -3.088 -4.907 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -17.963 -1.646 -5.759 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.052 -3.172 -5.841 1.00 0.00 H new ATOM 1816 N PHE A 117 -14.307 -1.276 -2.376 1.00 0.00 N ATOM 1817 CA PHE A 117 -13.683 -0.586 -1.211 1.00 0.00 C ATOM 1818 C PHE A 117 -12.650 0.414 -1.710 1.00 0.00 C ATOM 1819 O PHE A 117 -12.474 1.476 -1.148 1.00 0.00 O ATOM 1820 CB PHE A 117 -13.017 -1.693 -0.393 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.539 -1.126 0.923 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -13.469 -0.718 1.886 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -11.168 -1.009 1.179 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -13.028 -0.190 3.105 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -10.726 -0.482 2.399 1.00 0.00 C ATOM 1826 CZ PHE A 117 -11.657 -0.074 3.362 1.00 0.00 C ATOM 0 H PHE A 117 -14.121 -2.277 -2.441 1.00 0.00 H new ATOM 0 HA PHE A 117 -14.408 -0.034 -0.613 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.723 -2.505 -0.217 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -12.178 -2.114 -0.946 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -14.527 -0.811 1.689 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.451 -1.325 0.436 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -13.745 0.128 3.847 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.668 -0.390 2.597 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.317 0.331 4.304 1.00 0.00 H new ATOM 1836 N SER A 118 -11.979 0.089 -2.775 1.00 0.00 N ATOM 1837 CA SER A 118 -10.975 1.021 -3.324 1.00 0.00 C ATOM 1838 C SER A 118 -11.671 2.027 -4.222 1.00 0.00 C ATOM 1839 O SER A 118 -11.402 3.198 -4.183 1.00 0.00 O ATOM 1840 CB SER A 118 -10.011 0.142 -4.117 1.00 0.00 C ATOM 1841 OG SER A 118 -9.920 0.621 -5.453 1.00 0.00 O ATOM 0 H SER A 118 -12.086 -0.786 -3.287 1.00 0.00 H new ATOM 0 HA SER A 118 -10.448 1.587 -2.556 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.027 0.150 -3.649 1.00 0.00 H new ATOM 0 HB3 SER A 118 -10.358 -0.891 -4.113 1.00 0.00 H new ATOM 0 HG SER A 118 -9.099 1.146 -5.557 1.00 0.00 H new ATOM 1847 N ASP A 119 -12.586 1.574 -5.011 1.00 0.00 N ATOM 1848 CA ASP A 119 -13.319 2.511 -5.906 1.00 0.00 C ATOM 1849 C ASP A 119 -14.112 3.492 -5.066 1.00 0.00 C ATOM 1850 O ASP A 119 -14.547 4.522 -5.532 1.00 0.00 O ATOM 1851 CB ASP A 119 -14.240 1.644 -6.764 1.00 0.00 C ATOM 1852 CG ASP A 119 -13.429 0.997 -7.887 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -12.269 1.348 -8.031 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -13.980 0.161 -8.582 1.00 0.00 O ATOM 0 H ASP A 119 -12.865 0.595 -5.081 1.00 0.00 H new ATOM 0 HA ASP A 119 -12.647 3.094 -6.536 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -14.709 0.875 -6.150 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.042 2.251 -7.183 1.00 0.00 H new ATOM 1859 N THR A 120 -14.264 3.191 -3.821 1.00 0.00 N ATOM 1860 CA THR A 120 -14.984 4.112 -2.914 1.00 0.00 C ATOM 1861 C THR A 120 -13.964 5.108 -2.385 1.00 0.00 C ATOM 1862 O THR A 120 -14.176 6.305 -2.338 1.00 0.00 O ATOM 1863 CB THR A 120 -15.532 3.200 -1.803 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.921 2.985 -2.014 1.00 0.00 O ATOM 1865 CG2 THR A 120 -15.320 3.827 -0.424 1.00 0.00 C ATOM 0 H THR A 120 -13.917 2.337 -3.384 1.00 0.00 H new ATOM 0 HA THR A 120 -15.793 4.678 -3.376 1.00 0.00 H new ATOM 0 HB THR A 120 -14.995 2.252 -1.837 1.00 0.00 H new ATOM 0 HG1 THR A 120 -17.273 2.403 -1.309 1.00 0.00 H new ATOM 0 HG21 THR A 120 -15.716 3.162 0.343 1.00 0.00 H new ATOM 0 HG22 THR A 120 -14.254 3.982 -0.255 1.00 0.00 H new ATOM 0 HG23 THR A 120 -15.838 4.785 -0.376 1.00 0.00 H new ATOM 1873 N ILE A 121 -12.855 4.583 -1.996 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.753 5.413 -1.454 1.00 0.00 C ATOM 1875 C ILE A 121 -10.976 6.105 -2.580 1.00 0.00 C ATOM 1876 O ILE A 121 -10.491 7.207 -2.416 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.890 4.393 -0.701 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -10.929 4.719 0.785 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.436 4.409 -1.188 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -10.332 6.109 1.012 1.00 0.00 C ATOM 0 H ILE A 121 -12.654 3.584 -2.030 1.00 0.00 H new ATOM 0 HA ILE A 121 -12.096 6.226 -0.814 1.00 0.00 H new ATOM 0 HB ILE A 121 -11.293 3.398 -0.889 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -11.956 4.687 1.149 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -10.368 3.973 1.348 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.857 3.673 -0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -9.405 4.166 -2.250 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -9.010 5.400 -1.030 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -10.358 6.347 2.075 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -9.300 6.123 0.662 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -10.912 6.849 0.461 1.00 0.00 H new ATOM 1892 N LYS A 122 -10.845 5.482 -3.719 1.00 0.00 N ATOM 1893 CA LYS A 122 -10.097 6.132 -4.813 1.00 0.00 C ATOM 1894 C LYS A 122 -11.023 7.130 -5.486 1.00 0.00 C ATOM 1895 O LYS A 122 -10.606 8.159 -5.980 1.00 0.00 O ATOM 1896 CB LYS A 122 -9.683 4.962 -5.700 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.370 5.001 -7.061 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.364 3.583 -7.607 1.00 0.00 C ATOM 1899 CE LYS A 122 -8.913 3.142 -7.810 1.00 0.00 C ATOM 1900 NZ LYS A 122 -8.738 3.056 -9.287 1.00 0.00 N ATOM 0 H LYS A 122 -11.223 4.559 -3.931 1.00 0.00 H new ATOM 0 HA LYS A 122 -9.218 6.705 -4.518 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -8.602 4.979 -5.840 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.925 4.025 -5.199 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.390 5.373 -6.967 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.846 5.676 -7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.870 2.910 -6.915 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.908 3.539 -8.551 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.218 3.858 -7.371 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -8.723 2.180 -7.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.772 3.347 -9.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.897 2.077 -9.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -9.422 3.684 -9.755 1.00 0.00 H new ATOM 1914 N SER A 123 -12.291 6.859 -5.443 1.00 0.00 N ATOM 1915 CA SER A 123 -13.262 7.818 -6.005 1.00 0.00 C ATOM 1916 C SER A 123 -13.563 8.846 -4.928 1.00 0.00 C ATOM 1917 O SER A 123 -14.219 9.842 -5.159 1.00 0.00 O ATOM 1918 CB SER A 123 -14.506 7.005 -6.323 1.00 0.00 C ATOM 1919 OG SER A 123 -14.191 6.010 -7.289 1.00 0.00 O ATOM 0 H SER A 123 -12.695 6.013 -5.042 1.00 0.00 H new ATOM 0 HA SER A 123 -12.899 8.332 -6.895 1.00 0.00 H new ATOM 0 HB2 SER A 123 -14.889 6.537 -5.416 1.00 0.00 H new ATOM 0 HB3 SER A 123 -15.293 7.658 -6.702 1.00 0.00 H new ATOM 0 HG SER A 123 -14.550 5.146 -6.998 1.00 0.00 H new ATOM 1925 N PHE A 124 -13.068 8.606 -3.742 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.305 9.570 -2.631 1.00 0.00 C ATOM 1927 C PHE A 124 -12.515 10.854 -2.880 1.00 0.00 C ATOM 1928 O PHE A 124 -12.610 11.812 -2.138 1.00 0.00 O ATOM 1929 CB PHE A 124 -12.801 8.867 -1.372 1.00 0.00 C ATOM 1930 CG PHE A 124 -13.179 9.681 -0.158 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -14.448 9.536 0.415 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -12.261 10.583 0.394 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -14.800 10.293 1.539 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -12.612 11.339 1.520 1.00 0.00 C ATOM 1935 CZ PHE A 124 -13.882 11.194 2.093 1.00 0.00 C ATOM 0 H PHE A 124 -12.512 7.787 -3.497 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.355 9.849 -2.543 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -13.232 7.868 -1.303 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.719 8.745 -1.419 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -15.156 8.840 -0.010 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -11.282 10.696 -0.048 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -15.780 10.182 1.979 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -11.903 12.034 1.946 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.153 11.776 2.961 1.00 0.00 H new ATOM 1945 N ALA A 125 -11.740 10.878 -3.925 1.00 0.00 N ATOM 1946 CA ALA A 125 -10.940 12.096 -4.239 1.00 0.00 C ATOM 1947 C ALA A 125 -11.873 13.288 -4.449 1.00 0.00 C ATOM 1948 O ALA A 125 -11.571 14.403 -4.070 1.00 0.00 O ATOM 1949 CB ALA A 125 -10.200 11.759 -5.533 1.00 0.00 C ATOM 0 H ALA A 125 -11.624 10.104 -4.579 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.252 12.363 -3.437 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.586 12.608 -5.833 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -9.563 10.889 -5.372 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.923 11.539 -6.319 1.00 0.00 H new ATOM 1955 N SER A 126 -13.006 13.058 -5.050 1.00 0.00 N ATOM 1956 CA SER A 126 -13.965 14.173 -5.286 1.00 0.00 C ATOM 1957 C SER A 126 -15.326 13.613 -5.708 1.00 0.00 C ATOM 1958 O SER A 126 -16.013 14.180 -6.533 1.00 0.00 O ATOM 1959 CB SER A 126 -13.348 14.999 -6.416 1.00 0.00 C ATOM 1960 OG SER A 126 -12.329 14.241 -7.053 1.00 0.00 O ATOM 0 H SER A 126 -13.310 12.145 -5.389 1.00 0.00 H new ATOM 0 HA SER A 126 -14.130 14.773 -4.391 1.00 0.00 H new ATOM 0 HB2 SER A 126 -14.115 15.277 -7.139 1.00 0.00 H new ATOM 0 HB3 SER A 126 -12.933 15.926 -6.019 1.00 0.00 H new ATOM 0 HG SER A 126 -11.934 14.769 -7.778 1.00 0.00 H new ATOM 1966 N SER A 127 -15.718 12.503 -5.146 1.00 0.00 N ATOM 1967 CA SER A 127 -17.033 11.904 -5.512 1.00 0.00 C ATOM 1968 C SER A 127 -17.470 10.895 -4.446 1.00 0.00 C ATOM 1969 O SER A 127 -16.684 10.466 -3.625 1.00 0.00 O ATOM 1970 CB SER A 127 -16.785 11.199 -6.845 1.00 0.00 C ATOM 1971 OG SER A 127 -17.507 9.974 -6.870 1.00 0.00 O ATOM 0 H SER A 127 -15.184 11.984 -4.449 1.00 0.00 H new ATOM 0 HA SER A 127 -17.823 12.652 -5.584 1.00 0.00 H new ATOM 0 HB2 SER A 127 -17.100 11.837 -7.671 1.00 0.00 H new ATOM 0 HB3 SER A 127 -15.720 11.009 -6.977 1.00 0.00 H new ATOM 0 HG SER A 127 -17.351 9.520 -7.724 1.00 0.00 H new ATOM 1977 N GLY A 128 -18.718 10.512 -4.453 1.00 0.00 N ATOM 1978 CA GLY A 128 -19.205 9.531 -3.441 1.00 0.00 C ATOM 1979 C GLY A 128 -20.534 10.012 -2.857 1.00 0.00 C ATOM 1980 O GLY A 128 -21.329 10.636 -3.532 1.00 0.00 O ATOM 0 H GLY A 128 -19.422 10.836 -5.116 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -19.332 8.551 -3.901 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -18.467 9.417 -2.647 1.00 0.00 H new ATOM 1984 N LYS A 129 -20.783 9.730 -1.607 1.00 0.00 N ATOM 1985 CA LYS A 129 -22.064 10.176 -0.985 1.00 0.00 C ATOM 1986 C LYS A 129 -21.829 11.424 -0.132 1.00 0.00 C ATOM 1987 O LYS A 129 -22.702 11.875 0.582 1.00 0.00 O ATOM 1988 CB LYS A 129 -22.511 9.009 -0.105 1.00 0.00 C ATOM 1989 CG LYS A 129 -21.561 8.879 1.088 1.00 0.00 C ATOM 1990 CD LYS A 129 -21.951 7.659 1.923 1.00 0.00 C ATOM 1991 CE LYS A 129 -21.454 6.388 1.231 1.00 0.00 C ATOM 1992 NZ LYS A 129 -22.667 5.541 1.067 1.00 0.00 N ATOM 0 H LYS A 129 -20.157 9.212 -0.990 1.00 0.00 H new ATOM 0 HA LYS A 129 -22.815 10.433 -1.732 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -23.531 9.172 0.244 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -22.516 8.085 -0.683 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -20.533 8.780 0.738 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -21.604 9.780 1.700 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -21.520 7.735 2.921 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -23.033 7.620 2.046 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -20.998 6.615 0.267 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -20.697 5.882 1.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -22.407 4.649 0.599 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -23.076 5.335 2.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -23.367 6.046 0.487 1.00 0.00 H new ATOM 2006 N GLU A 130 -20.653 11.983 -0.205 1.00 0.00 N ATOM 2007 CA GLU A 130 -20.357 13.203 0.596 1.00 0.00 C ATOM 2008 C GLU A 130 -20.159 14.404 -0.333 1.00 0.00 C ATOM 2009 O GLU A 130 -19.358 14.369 -1.245 1.00 0.00 O ATOM 2010 CB GLU A 130 -19.062 12.881 1.344 1.00 0.00 C ATOM 2011 CG GLU A 130 -19.320 12.918 2.851 1.00 0.00 C ATOM 2012 CD GLU A 130 -18.276 13.806 3.530 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -17.111 13.679 3.193 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -18.660 14.599 4.374 1.00 0.00 O ATOM 0 H GLU A 130 -19.884 11.647 -0.785 1.00 0.00 H new ATOM 0 HA GLU A 130 -21.167 13.459 1.279 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -18.696 11.897 1.051 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -18.288 13.601 1.079 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -20.321 13.300 3.049 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -19.277 11.909 3.262 1.00 0.00 H new ATOM 2021 N LYS A 131 -20.883 15.463 -0.108 1.00 0.00 N ATOM 2022 CA LYS A 131 -20.736 16.662 -0.980 1.00 0.00 C ATOM 2023 C LYS A 131 -19.933 17.745 -0.255 1.00 0.00 C ATOM 2024 O LYS A 131 -20.213 18.922 -0.375 1.00 0.00 O ATOM 2025 CB LYS A 131 -22.166 17.135 -1.242 1.00 0.00 C ATOM 2026 CG LYS A 131 -22.338 17.437 -2.732 1.00 0.00 C ATOM 2027 CD LYS A 131 -23.626 18.234 -2.943 1.00 0.00 C ATOM 2028 CE LYS A 131 -24.180 17.953 -4.341 1.00 0.00 C ATOM 2029 NZ LYS A 131 -24.266 19.289 -4.995 1.00 0.00 N ATOM 0 H LYS A 131 -21.570 15.551 0.641 1.00 0.00 H new ATOM 0 HA LYS A 131 -20.205 16.441 -1.906 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -22.877 16.369 -0.931 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -22.379 18.026 -0.652 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -21.483 18.003 -3.101 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -22.375 16.508 -3.301 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -24.363 17.961 -2.187 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -23.429 19.300 -2.826 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -23.526 17.282 -4.898 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -25.158 17.475 -4.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -24.638 19.180 -5.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -24.901 19.904 -4.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -23.319 19.717 -5.036 1.00 0.00 H new ATOM 2043 N LEU A 132 -18.939 17.357 0.497 1.00 0.00 N ATOM 2044 CA LEU A 132 -18.120 18.363 1.229 1.00 0.00 C ATOM 2045 C LEU A 132 -19.027 19.432 1.846 1.00 0.00 C ATOM 2046 O LEU A 132 -19.115 20.541 1.358 1.00 0.00 O ATOM 2047 CB LEU A 132 -17.210 18.981 0.167 1.00 0.00 C ATOM 2048 CG LEU A 132 -16.548 17.868 -0.645 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -17.022 17.942 -2.097 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -15.028 18.037 -0.597 1.00 0.00 C ATOM 0 H LEU A 132 -18.659 16.386 0.636 1.00 0.00 H new ATOM 0 HA LEU A 132 -17.550 17.918 2.045 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -17.788 19.631 -0.490 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -16.450 19.602 0.641 1.00 0.00 H new ATOM 0 HG LEU A 132 -16.821 16.901 -0.223 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -16.549 17.148 -2.675 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -18.105 17.822 -2.133 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -16.750 18.909 -2.520 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -14.555 17.244 -1.176 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -14.756 19.005 -1.018 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -14.688 17.983 0.437 1.00 0.00 H new ATOM 2062 N GLU A 133 -19.701 19.108 2.915 1.00 0.00 N ATOM 2063 CA GLU A 133 -20.601 20.106 3.558 1.00 0.00 C ATOM 2064 C GLU A 133 -19.784 21.100 4.386 1.00 0.00 C ATOM 2065 O GLU A 133 -18.623 20.818 4.635 1.00 0.00 O ATOM 2066 CB GLU A 133 -21.524 19.288 4.461 1.00 0.00 C ATOM 2067 CG GLU A 133 -22.657 18.689 3.626 1.00 0.00 C ATOM 2068 CD GLU A 133 -23.954 19.451 3.906 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -24.463 19.328 5.008 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -24.414 20.144 3.015 1.00 0.00 O ATOM 0 H GLU A 133 -19.667 18.196 3.371 1.00 0.00 H new ATOM 0 HA GLU A 133 -21.160 20.687 2.825 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -20.960 18.494 4.951 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -21.934 19.921 5.248 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -22.411 18.746 2.566 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -22.783 17.634 3.868 1.00 0.00 H new TER 2077 GLU A 133