USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=33 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 65 THR OG1 : rot 100:sc= -2.11! USER MOD Set 1.2: A 68 ASN : amide:sc= -0.061 K(o=-7.7,f=-8.7) USER MOD Set 1.3: A 118 SER OG : rot 124:sc= -3.64! USER MOD Set 1.4: A 122 LYS NZ :NH3+ 166:sc= -1.92 (180deg=-2.15!) USER MOD Set 2.1: A 45 HIS : no HD1:sc= -0.0345 K(o=-0.035,f=-1.5!) USER MOD Set 2.2: A 48 LYS NZ :NH3+ -160:sc= 0 (180deg=0) USER MOD Set 3.1: A 13 THR OG1 : rot 180:sc= -0.0928 USER MOD Set 3.2: A 50 MET CE :methyl 177:sc= -2.78! (180deg=-2.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 131:sc= 0.0935 (180deg=-0.327) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.153 X(o=-0.15,f=-0.011) USER MOD Single : A 19 ASN : amide:sc= -0.327 X(o=-0.33,f=-0.021) USER MOD Single : A 21 ASN : amide:sc= -3.92! C(o=-3.9!,f=-7.4!) USER MOD Single : A 23 THR OG1 : rot -41:sc= 0.78 USER MOD Single : A 29 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.139) USER MOD Single : A 30 ASN : amide:sc= -5.82! C(o=-5.8!,f=-7.8!) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl 174:sc= -3.48! (180deg=-3.66!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0.00473 USER MOD Single : A 59 MET CE :methyl -152:sc= -6.65! (180deg=-9.72!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 80:sc= 0.0508 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 164:sc= -3.12! (180deg=-3.37!) USER MOD Single : A 75 ASN : amide:sc= -0.153 X(o=-0.15,f=-0.0096) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 179:sc= -6.95! (180deg=-7.05!) USER MOD Single : A 81 THR OG1 : rot -46:sc= 0.636 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl -139:sc= -4.71! (180deg=-9.93!) USER MOD Single : A 96 THR OG1 : rot 111:sc= 1.12 USER MOD Single : A 98 MET CE :methyl 155:sc= -1.29 (180deg=-2.25!) USER MOD Single : A 101 LYS NZ :NH3+ 140:sc= -3.14! (180deg=-4.03!) 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= -7.15! C(o=-7.1!,f=-6.6!) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -103:sc= 0.601 USER MOD Single : A 127 SER OG : rot 180:sc= 0.114 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 4.124 -30.617 -2.520 1.00 0.00 N ATOM 2 CA MET A 1 5.312 -30.038 -3.211 1.00 0.00 C ATOM 3 C MET A 1 5.960 -28.960 -2.338 1.00 0.00 C ATOM 4 O MET A 1 5.380 -28.494 -1.377 1.00 0.00 O ATOM 5 CB MET A 1 4.766 -29.422 -4.501 1.00 0.00 C ATOM 6 CG MET A 1 3.805 -28.282 -4.156 1.00 0.00 C ATOM 7 SD MET A 1 3.803 -27.067 -5.496 1.00 0.00 S ATOM 8 CE MET A 1 2.612 -25.920 -4.761 1.00 0.00 C ATOM 0 H1 MET A 1 3.315 -30.629 -3.173 1.00 0.00 H new ATOM 0 H2 MET A 1 4.338 -31.588 -2.216 1.00 0.00 H new ATOM 0 H3 MET A 1 3.889 -30.038 -1.689 1.00 0.00 H new ATOM 0 HA MET A 1 6.076 -30.790 -3.410 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.586 -29.047 -5.113 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.250 -30.181 -5.089 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.799 -28.674 -4.005 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.107 -27.808 -3.222 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.457 -25.076 -5.433 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.664 -26.434 -4.599 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.996 -25.558 -3.807 1.00 0.00 H new ATOM 20 N MET A 2 7.158 -28.560 -2.665 1.00 0.00 N ATOM 21 CA MET A 2 7.837 -27.512 -1.852 1.00 0.00 C ATOM 22 C MET A 2 6.857 -26.378 -1.534 1.00 0.00 C ATOM 23 O MET A 2 6.158 -25.886 -2.398 1.00 0.00 O ATOM 24 CB MET A 2 8.980 -27.008 -2.731 1.00 0.00 C ATOM 25 CG MET A 2 8.451 -26.719 -4.132 1.00 0.00 C ATOM 26 SD MET A 2 9.592 -25.610 -4.994 1.00 0.00 S ATOM 27 CE MET A 2 8.838 -25.738 -6.634 1.00 0.00 C ATOM 0 H MET A 2 7.695 -28.912 -3.458 1.00 0.00 H new ATOM 0 HA MET A 2 8.199 -27.895 -0.898 1.00 0.00 H new ATOM 0 HB2 MET A 2 9.414 -26.105 -2.301 1.00 0.00 H new ATOM 0 HB3 MET A 2 9.774 -27.753 -2.777 1.00 0.00 H new ATOM 0 HG2 MET A 2 8.341 -27.649 -4.689 1.00 0.00 H new ATOM 0 HG3 MET A 2 7.462 -26.265 -4.072 1.00 0.00 H new ATOM 0 HE1 MET A 2 9.394 -25.120 -7.339 1.00 0.00 H new ATOM 0 HE2 MET A 2 8.861 -26.776 -6.965 1.00 0.00 H new ATOM 0 HE3 MET A 2 7.804 -25.395 -6.587 1.00 0.00 H new ATOM 37 N GLU A 3 6.801 -25.963 -0.299 1.00 0.00 N ATOM 38 CA GLU A 3 5.866 -24.863 0.078 1.00 0.00 C ATOM 39 C GLU A 3 6.626 -23.722 0.730 1.00 0.00 C ATOM 40 O GLU A 3 6.058 -22.715 1.105 1.00 0.00 O ATOM 41 CB GLU A 3 4.919 -25.468 1.107 1.00 0.00 C ATOM 42 CG GLU A 3 5.734 -26.083 2.246 1.00 0.00 C ATOM 43 CD GLU A 3 6.059 -27.542 1.917 1.00 0.00 C ATOM 44 OE1 GLU A 3 5.240 -28.180 1.277 1.00 0.00 O ATOM 45 OE2 GLU A 3 7.121 -27.994 2.310 1.00 0.00 O ATOM 0 H GLU A 3 7.362 -26.337 0.466 1.00 0.00 H new ATOM 0 HA GLU A 3 5.347 -24.470 -0.796 1.00 0.00 H new ATOM 0 HB2 GLU A 3 4.249 -24.701 1.497 1.00 0.00 H new ATOM 0 HB3 GLU A 3 4.294 -26.229 0.640 1.00 0.00 H new ATOM 0 HG2 GLU A 3 6.655 -25.519 2.393 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.174 -26.026 3.179 1.00 0.00 H new ATOM 52 N GLU A 4 7.897 -23.876 0.896 1.00 0.00 N ATOM 53 CA GLU A 4 8.671 -22.802 1.556 1.00 0.00 C ATOM 54 C GLU A 4 8.748 -21.565 0.661 1.00 0.00 C ATOM 55 O GLU A 4 9.243 -20.528 1.055 1.00 0.00 O ATOM 56 CB GLU A 4 10.059 -23.393 1.795 1.00 0.00 C ATOM 57 CG GLU A 4 9.932 -24.683 2.607 1.00 0.00 C ATOM 58 CD GLU A 4 9.235 -24.384 3.935 1.00 0.00 C ATOM 59 OE1 GLU A 4 8.016 -24.417 3.964 1.00 0.00 O ATOM 60 OE2 GLU A 4 9.933 -24.124 4.902 1.00 0.00 O ATOM 0 H GLU A 4 8.434 -24.693 0.606 1.00 0.00 H new ATOM 0 HA GLU A 4 8.207 -22.479 2.488 1.00 0.00 H new ATOM 0 HB2 GLU A 4 10.548 -23.597 0.842 1.00 0.00 H new ATOM 0 HB3 GLU A 4 10.684 -22.676 2.327 1.00 0.00 H new ATOM 0 HG2 GLU A 4 9.364 -25.424 2.045 1.00 0.00 H new ATOM 0 HG3 GLU A 4 10.919 -25.109 2.790 1.00 0.00 H new ATOM 67 N TYR A 5 8.252 -21.666 -0.536 1.00 0.00 N ATOM 68 CA TYR A 5 8.286 -20.496 -1.458 1.00 0.00 C ATOM 69 C TYR A 5 7.196 -19.506 -1.070 1.00 0.00 C ATOM 70 O TYR A 5 7.309 -18.312 -1.274 1.00 0.00 O ATOM 71 CB TYR A 5 8.027 -21.072 -2.851 1.00 0.00 C ATOM 72 CG TYR A 5 9.335 -21.501 -3.469 1.00 0.00 C ATOM 73 CD1 TYR A 5 10.190 -22.360 -2.768 1.00 0.00 C ATOM 74 CD2 TYR A 5 9.693 -21.039 -4.739 1.00 0.00 C ATOM 75 CE1 TYR A 5 11.404 -22.759 -3.340 1.00 0.00 C ATOM 76 CE2 TYR A 5 10.907 -21.437 -5.313 1.00 0.00 C ATOM 77 CZ TYR A 5 11.763 -22.297 -4.613 1.00 0.00 C ATOM 78 OH TYR A 5 12.960 -22.690 -5.177 1.00 0.00 O ATOM 0 H TYR A 5 7.823 -22.508 -0.919 1.00 0.00 H new ATOM 0 HA TYR A 5 9.235 -19.961 -1.419 1.00 0.00 H new ATOM 0 HB2 TYR A 5 7.348 -21.922 -2.784 1.00 0.00 H new ATOM 0 HB3 TYR A 5 7.543 -20.326 -3.481 1.00 0.00 H new ATOM 0 HD1 TYR A 5 9.913 -22.715 -1.786 1.00 0.00 H new ATOM 0 HD2 TYR A 5 9.033 -20.375 -5.278 1.00 0.00 H new ATOM 0 HE1 TYR A 5 12.063 -23.423 -2.800 1.00 0.00 H new ATOM 0 HE2 TYR A 5 11.183 -21.081 -6.295 1.00 0.00 H new ATOM 0 HH TYR A 5 13.054 -22.281 -6.062 1.00 0.00 H new ATOM 88 N LEU A 6 6.151 -20.002 -0.495 1.00 0.00 N ATOM 89 CA LEU A 6 5.036 -19.115 -0.063 1.00 0.00 C ATOM 90 C LEU A 6 5.294 -18.635 1.366 1.00 0.00 C ATOM 91 O LEU A 6 4.891 -17.557 1.756 1.00 0.00 O ATOM 92 CB LEU A 6 3.776 -19.985 -0.135 1.00 0.00 C ATOM 93 CG LEU A 6 3.706 -20.905 1.087 1.00 0.00 C ATOM 94 CD1 LEU A 6 2.987 -20.188 2.231 1.00 0.00 C ATOM 95 CD2 LEU A 6 2.938 -22.179 0.727 1.00 0.00 C ATOM 0 H LEU A 6 6.013 -20.994 -0.300 1.00 0.00 H new ATOM 0 HA LEU A 6 4.936 -18.227 -0.687 1.00 0.00 H new ATOM 0 HB2 LEU A 6 2.889 -19.353 -0.176 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.786 -20.580 -1.048 1.00 0.00 H new ATOM 0 HG LEU A 6 4.718 -21.164 1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.939 -20.845 3.099 1.00 0.00 H new ATOM 0 HD12 LEU A 6 3.533 -19.281 2.492 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.976 -19.926 1.918 1.00 0.00 H new ATOM 0 HD21 LEU A 6 2.889 -22.833 1.598 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.928 -21.918 0.412 1.00 0.00 H new ATOM 0 HD23 LEU A 6 3.450 -22.695 -0.086 1.00 0.00 H new ATOM 107 N GLY A 7 5.976 -19.430 2.147 1.00 0.00 N ATOM 108 CA GLY A 7 6.273 -19.020 3.546 1.00 0.00 C ATOM 109 C GLY A 7 7.197 -17.803 3.518 1.00 0.00 C ATOM 110 O GLY A 7 7.117 -16.929 4.357 1.00 0.00 O ATOM 0 H GLY A 7 6.339 -20.344 1.875 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.349 -18.780 4.073 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.745 -19.840 4.087 1.00 0.00 H new ATOM 114 N VAL A 8 8.074 -17.739 2.553 1.00 0.00 N ATOM 115 CA VAL A 8 9.000 -16.576 2.464 1.00 0.00 C ATOM 116 C VAL A 8 8.350 -15.459 1.662 1.00 0.00 C ATOM 117 O VAL A 8 8.661 -14.294 1.817 1.00 0.00 O ATOM 118 CB VAL A 8 10.244 -17.109 1.754 1.00 0.00 C ATOM 119 CG1 VAL A 8 11.085 -15.939 1.242 1.00 0.00 C ATOM 120 CG2 VAL A 8 11.073 -17.938 2.739 1.00 0.00 C ATOM 0 H VAL A 8 8.189 -18.442 1.823 1.00 0.00 H new ATOM 0 HA VAL A 8 9.247 -16.161 3.441 1.00 0.00 H new ATOM 0 HB VAL A 8 9.942 -17.732 0.912 1.00 0.00 H new ATOM 0 HG11 VAL A 8 11.971 -16.322 0.736 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.496 -15.346 0.543 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.388 -15.314 2.082 1.00 0.00 H new ATOM 0 HG21 VAL A 8 11.961 -18.320 2.236 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.373 -17.312 3.579 1.00 0.00 H new ATOM 0 HG23 VAL A 8 10.476 -18.773 3.104 1.00 0.00 H new ATOM 130 N PHE A 9 7.437 -15.811 0.817 1.00 0.00 N ATOM 131 CA PHE A 9 6.733 -14.783 0.002 1.00 0.00 C ATOM 132 C PHE A 9 5.827 -13.947 0.911 1.00 0.00 C ATOM 133 O PHE A 9 5.639 -12.766 0.701 1.00 0.00 O ATOM 134 CB PHE A 9 5.906 -15.575 -1.011 1.00 0.00 C ATOM 135 CG PHE A 9 6.286 -15.152 -2.410 1.00 0.00 C ATOM 136 CD1 PHE A 9 5.738 -13.989 -2.961 1.00 0.00 C ATOM 137 CD2 PHE A 9 7.187 -15.923 -3.156 1.00 0.00 C ATOM 138 CE1 PHE A 9 6.090 -13.595 -4.258 1.00 0.00 C ATOM 139 CE2 PHE A 9 7.540 -15.529 -4.452 1.00 0.00 C ATOM 140 CZ PHE A 9 6.991 -14.365 -5.004 1.00 0.00 C ATOM 0 H PHE A 9 7.141 -16.773 0.650 1.00 0.00 H new ATOM 0 HA PHE A 9 7.418 -14.095 -0.494 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.080 -16.643 -0.883 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.843 -15.402 -0.843 1.00 0.00 H new ATOM 0 HD1 PHE A 9 5.043 -13.395 -2.386 1.00 0.00 H new ATOM 0 HD2 PHE A 9 7.609 -16.822 -2.731 1.00 0.00 H new ATOM 0 HE1 PHE A 9 5.666 -12.697 -4.683 1.00 0.00 H new ATOM 0 HE2 PHE A 9 8.236 -16.123 -5.026 1.00 0.00 H new ATOM 0 HZ PHE A 9 7.262 -14.061 -6.004 1.00 0.00 H new ATOM 150 N VAL A 10 5.277 -14.554 1.929 1.00 0.00 N ATOM 151 CA VAL A 10 4.396 -13.797 2.862 1.00 0.00 C ATOM 152 C VAL A 10 5.253 -13.094 3.915 1.00 0.00 C ATOM 153 O VAL A 10 4.974 -11.980 4.314 1.00 0.00 O ATOM 154 CB VAL A 10 3.498 -14.849 3.514 1.00 0.00 C ATOM 155 CG1 VAL A 10 2.390 -14.153 4.306 1.00 0.00 C ATOM 156 CG2 VAL A 10 2.872 -15.733 2.433 1.00 0.00 C ATOM 0 H VAL A 10 5.400 -15.541 2.154 1.00 0.00 H new ATOM 0 HA VAL A 10 3.809 -13.032 2.354 1.00 0.00 H new ATOM 0 HB VAL A 10 4.095 -15.466 4.186 1.00 0.00 H new ATOM 0 HG11 VAL A 10 1.749 -14.902 4.771 1.00 0.00 H new ATOM 0 HG12 VAL A 10 2.834 -13.525 5.079 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.796 -13.534 3.634 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.233 -16.482 2.901 1.00 0.00 H new ATOM 0 HG22 VAL A 10 2.277 -15.117 1.759 1.00 0.00 H new ATOM 0 HG23 VAL A 10 3.660 -16.231 1.868 1.00 0.00 H new ATOM 166 N ASP A 11 6.303 -13.731 4.362 1.00 0.00 N ATOM 167 CA ASP A 11 7.180 -13.086 5.381 1.00 0.00 C ATOM 168 C ASP A 11 7.735 -11.786 4.815 1.00 0.00 C ATOM 169 O ASP A 11 8.102 -10.879 5.535 1.00 0.00 O ATOM 170 CB ASP A 11 8.299 -14.093 5.647 1.00 0.00 C ATOM 171 CG ASP A 11 8.997 -13.744 6.962 1.00 0.00 C ATOM 172 OD1 ASP A 11 8.312 -13.338 7.885 1.00 0.00 O ATOM 173 OD2 ASP A 11 10.208 -13.890 7.024 1.00 0.00 O ATOM 0 H ASP A 11 6.590 -14.665 4.067 1.00 0.00 H new ATOM 0 HA ASP A 11 6.650 -12.838 6.300 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.890 -15.102 5.697 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.017 -14.080 4.827 1.00 0.00 H new ATOM 178 N GLU A 12 7.768 -11.695 3.524 1.00 0.00 N ATOM 179 CA GLU A 12 8.267 -10.455 2.865 1.00 0.00 C ATOM 180 C GLU A 12 7.093 -9.501 2.658 1.00 0.00 C ATOM 181 O GLU A 12 7.203 -8.306 2.848 1.00 0.00 O ATOM 182 CB GLU A 12 8.831 -10.911 1.519 1.00 0.00 C ATOM 183 CG GLU A 12 10.181 -11.597 1.734 1.00 0.00 C ATOM 184 CD GLU A 12 10.566 -12.370 0.472 1.00 0.00 C ATOM 185 OE1 GLU A 12 9.951 -12.133 -0.555 1.00 0.00 O ATOM 186 OE2 GLU A 12 11.469 -13.186 0.553 1.00 0.00 O ATOM 0 H GLU A 12 7.469 -12.431 2.885 1.00 0.00 H new ATOM 0 HA GLU A 12 9.022 -9.935 3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.136 -11.598 1.036 1.00 0.00 H new ATOM 0 HB3 GLU A 12 8.948 -10.055 0.854 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.945 -10.855 1.966 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.125 -12.275 2.586 1.00 0.00 H new ATOM 193 N THR A 13 5.963 -10.032 2.283 1.00 0.00 N ATOM 194 CA THR A 13 4.765 -9.176 2.076 1.00 0.00 C ATOM 195 C THR A 13 4.414 -8.470 3.390 1.00 0.00 C ATOM 196 O THR A 13 3.920 -7.361 3.399 1.00 0.00 O ATOM 197 CB THR A 13 3.665 -10.162 1.646 1.00 0.00 C ATOM 198 OG1 THR A 13 3.607 -10.209 0.228 1.00 0.00 O ATOM 199 CG2 THR A 13 2.300 -9.733 2.196 1.00 0.00 C ATOM 0 H THR A 13 5.818 -11.027 2.111 1.00 0.00 H new ATOM 0 HA THR A 13 4.908 -8.392 1.332 1.00 0.00 H new ATOM 0 HB THR A 13 3.905 -11.147 2.046 1.00 0.00 H new ATOM 0 HG1 THR A 13 2.908 -10.838 -0.050 1.00 0.00 H new ATOM 0 HG21 THR A 13 1.539 -10.446 1.878 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.339 -9.705 3.285 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.050 -8.742 1.816 1.00 0.00 H new ATOM 207 N LYS A 14 4.675 -9.106 4.498 1.00 0.00 N ATOM 208 CA LYS A 14 4.364 -8.476 5.810 1.00 0.00 C ATOM 209 C LYS A 14 5.448 -7.456 6.167 1.00 0.00 C ATOM 210 O LYS A 14 5.160 -6.336 6.537 1.00 0.00 O ATOM 211 CB LYS A 14 4.358 -9.630 6.812 1.00 0.00 C ATOM 212 CG LYS A 14 2.990 -10.317 6.788 1.00 0.00 C ATOM 213 CD LYS A 14 3.179 -11.834 6.734 1.00 0.00 C ATOM 214 CE LYS A 14 2.783 -12.444 8.081 1.00 0.00 C ATOM 215 NZ LYS A 14 3.998 -13.167 8.548 1.00 0.00 N ATOM 0 H LYS A 14 5.091 -10.036 4.551 1.00 0.00 H new ATOM 0 HA LYS A 14 3.413 -7.943 5.802 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.141 -10.346 6.563 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.573 -9.258 7.814 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.418 -10.043 7.675 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.418 -9.981 5.923 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.570 -12.259 5.937 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.217 -12.074 6.505 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.485 -11.673 8.791 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.937 -13.122 7.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.805 -13.613 9.468 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 4.254 -13.899 7.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 4.785 -12.495 8.648 1.00 0.00 H new ATOM 229 N GLU A 15 6.692 -7.835 6.046 1.00 0.00 N ATOM 230 CA GLU A 15 7.794 -6.888 6.367 1.00 0.00 C ATOM 231 C GLU A 15 7.711 -5.677 5.448 1.00 0.00 C ATOM 232 O GLU A 15 8.310 -4.650 5.692 1.00 0.00 O ATOM 233 CB GLU A 15 9.084 -7.671 6.114 1.00 0.00 C ATOM 234 CG GLU A 15 9.264 -8.727 7.206 1.00 0.00 C ATOM 235 CD GLU A 15 10.500 -9.575 6.901 1.00 0.00 C ATOM 236 OE1 GLU A 15 11.315 -9.135 6.106 1.00 0.00 O ATOM 237 OE2 GLU A 15 10.611 -10.649 7.468 1.00 0.00 O ATOM 0 H GLU A 15 6.991 -8.760 5.738 1.00 0.00 H new ATOM 0 HA GLU A 15 7.744 -6.521 7.392 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.046 -8.148 5.135 1.00 0.00 H new ATOM 0 HB3 GLU A 15 9.937 -6.993 6.105 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.372 -8.245 8.178 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.380 -9.362 7.261 1.00 0.00 H new ATOM 244 N TYR A 16 6.960 -5.798 4.398 1.00 0.00 N ATOM 245 CA TYR A 16 6.807 -4.669 3.447 1.00 0.00 C ATOM 246 C TYR A 16 5.615 -3.807 3.860 1.00 0.00 C ATOM 247 O TYR A 16 5.596 -2.614 3.634 1.00 0.00 O ATOM 248 CB TYR A 16 6.566 -5.319 2.085 1.00 0.00 C ATOM 249 CG TYR A 16 7.864 -5.366 1.314 1.00 0.00 C ATOM 250 CD1 TYR A 16 8.595 -4.191 1.102 1.00 0.00 C ATOM 251 CD2 TYR A 16 8.337 -6.585 0.813 1.00 0.00 C ATOM 252 CE1 TYR A 16 9.798 -4.234 0.390 1.00 0.00 C ATOM 253 CE2 TYR A 16 9.541 -6.628 0.100 1.00 0.00 C ATOM 254 CZ TYR A 16 10.272 -5.453 -0.111 1.00 0.00 C ATOM 255 OH TYR A 16 11.460 -5.496 -0.813 1.00 0.00 O ATOM 0 H TYR A 16 6.439 -6.640 4.154 1.00 0.00 H new ATOM 0 HA TYR A 16 7.681 -4.018 3.426 1.00 0.00 H new ATOM 0 HB2 TYR A 16 6.171 -6.327 2.215 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.819 -4.754 1.527 1.00 0.00 H new ATOM 0 HD1 TYR A 16 8.230 -3.251 1.488 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.773 -7.492 0.977 1.00 0.00 H new ATOM 0 HE1 TYR A 16 10.361 -3.327 0.227 1.00 0.00 H new ATOM 0 HE2 TYR A 16 9.906 -7.568 -0.287 1.00 0.00 H new ATOM 0 HH TYR A 16 11.644 -6.418 -1.089 1.00 0.00 H new ATOM 265 N LEU A 17 4.636 -4.392 4.498 1.00 0.00 N ATOM 266 CA LEU A 17 3.472 -3.586 4.958 1.00 0.00 C ATOM 267 C LEU A 17 3.958 -2.744 6.120 1.00 0.00 C ATOM 268 O LEU A 17 3.624 -1.586 6.270 1.00 0.00 O ATOM 269 CB LEU A 17 2.425 -4.598 5.417 1.00 0.00 C ATOM 270 CG LEU A 17 1.815 -5.286 4.198 1.00 0.00 C ATOM 271 CD1 LEU A 17 0.801 -6.335 4.657 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.112 -4.243 3.327 1.00 0.00 C ATOM 0 H LEU A 17 4.593 -5.387 4.719 1.00 0.00 H new ATOM 0 HA LEU A 17 3.052 -2.932 4.194 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.882 -5.337 6.075 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.647 -4.097 5.993 1.00 0.00 H new ATOM 0 HG LEU A 17 2.602 -5.772 3.622 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.366 -6.826 3.786 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.301 -7.077 5.279 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.012 -5.851 5.233 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.675 -4.731 2.456 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.324 -3.758 3.904 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.835 -3.495 3.000 1.00 0.00 H new ATOM 284 N GLN A 18 4.802 -3.332 6.908 1.00 0.00 N ATOM 285 CA GLN A 18 5.407 -2.607 8.047 1.00 0.00 C ATOM 286 C GLN A 18 6.260 -1.514 7.470 1.00 0.00 C ATOM 287 O GLN A 18 6.124 -0.344 7.768 1.00 0.00 O ATOM 288 CB GLN A 18 6.306 -3.625 8.731 1.00 0.00 C ATOM 289 CG GLN A 18 5.585 -4.956 8.855 1.00 0.00 C ATOM 290 CD GLN A 18 5.545 -5.392 10.320 1.00 0.00 C ATOM 291 OE1 GLN A 18 4.506 -5.773 10.824 1.00 0.00 O ATOM 292 NE2 GLN A 18 6.639 -5.355 11.030 1.00 0.00 N ATOM 0 H GLN A 18 5.103 -4.301 6.809 1.00 0.00 H new ATOM 0 HA GLN A 18 4.674 -2.185 8.735 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.225 -3.752 8.160 1.00 0.00 H new ATOM 0 HB3 GLN A 18 6.592 -3.264 9.719 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.571 -4.868 8.465 1.00 0.00 H new ATOM 0 HG3 GLN A 18 6.093 -5.712 8.255 1.00 0.00 H new ATOM 0 HE21 GLN A 18 7.511 -5.035 10.607 1.00 0.00 H new ATOM 0 HE22 GLN A 18 6.623 -5.646 12.008 1.00 0.00 H new ATOM 301 N ASN A 19 7.132 -1.913 6.611 1.00 0.00 N ATOM 302 CA ASN A 19 8.015 -0.938 5.951 1.00 0.00 C ATOM 303 C ASN A 19 7.149 0.030 5.169 1.00 0.00 C ATOM 304 O ASN A 19 7.503 1.170 4.934 1.00 0.00 O ATOM 305 CB ASN A 19 8.910 -1.761 5.022 1.00 0.00 C ATOM 306 CG ASN A 19 10.302 -1.895 5.642 1.00 0.00 C ATOM 307 OD1 ASN A 19 11.296 -1.889 4.943 1.00 0.00 O ATOM 308 ND2 ASN A 19 10.417 -2.018 6.937 1.00 0.00 N ATOM 0 H ASN A 19 7.274 -2.884 6.334 1.00 0.00 H new ATOM 0 HA ASN A 19 8.620 -0.358 6.647 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.475 -2.748 4.861 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.980 -1.280 4.046 1.00 0.00 H new ATOM 0 HD21 ASN A 19 11.340 -2.109 7.361 1.00 0.00 H new ATOM 0 HD22 ASN A 19 9.583 -2.023 7.525 1.00 0.00 H new ATOM 315 N LEU A 20 5.997 -0.425 4.795 1.00 0.00 N ATOM 316 CA LEU A 20 5.057 0.443 4.052 1.00 0.00 C ATOM 317 C LEU A 20 4.173 1.186 5.041 1.00 0.00 C ATOM 318 O LEU A 20 3.461 2.104 4.688 1.00 0.00 O ATOM 319 CB LEU A 20 4.228 -0.502 3.185 1.00 0.00 C ATOM 320 CG LEU A 20 3.101 0.282 2.514 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.693 1.283 1.520 1.00 0.00 C ATOM 322 CD2 LEU A 20 2.181 -0.688 1.773 1.00 0.00 C ATOM 0 H LEU A 20 5.662 -1.372 4.974 1.00 0.00 H new ATOM 0 HA LEU A 20 5.566 1.190 3.443 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.860 -0.969 2.430 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.814 -1.305 3.796 1.00 0.00 H new ATOM 0 HG LEU A 20 2.531 0.820 3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.888 1.841 1.042 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.350 1.974 2.048 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.263 0.748 0.761 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.376 -0.131 1.293 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.752 -1.225 1.016 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.758 -1.401 2.481 1.00 0.00 H new ATOM 334 N ASN A 21 4.255 0.834 6.293 1.00 0.00 N ATOM 335 CA ASN A 21 3.470 1.561 7.301 1.00 0.00 C ATOM 336 C ASN A 21 4.385 2.619 7.830 1.00 0.00 C ATOM 337 O ASN A 21 4.008 3.728 8.106 1.00 0.00 O ATOM 338 CB ASN A 21 3.061 0.535 8.367 1.00 0.00 C ATOM 339 CG ASN A 21 3.804 0.767 9.692 1.00 0.00 C ATOM 340 OD1 ASN A 21 3.217 1.210 10.660 1.00 0.00 O ATOM 341 ND2 ASN A 21 5.076 0.484 9.778 1.00 0.00 N ATOM 0 H ASN A 21 4.833 0.074 6.652 1.00 0.00 H new ATOM 0 HA ASN A 21 2.561 2.032 6.926 1.00 0.00 H new ATOM 0 HB2 ASN A 21 1.986 0.595 8.537 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.270 -0.471 8.003 1.00 0.00 H new ATOM 0 HD21 ASN A 21 5.574 0.635 10.655 1.00 0.00 H new ATOM 0 HD22 ASN A 21 5.572 0.112 8.968 1.00 0.00 H new ATOM 348 N ASP A 22 5.618 2.277 7.922 1.00 0.00 N ATOM 349 CA ASP A 22 6.581 3.272 8.384 1.00 0.00 C ATOM 350 C ASP A 22 6.580 4.379 7.354 1.00 0.00 C ATOM 351 O ASP A 22 6.765 5.541 7.643 1.00 0.00 O ATOM 352 CB ASP A 22 7.934 2.561 8.469 1.00 0.00 C ATOM 353 CG ASP A 22 8.376 2.471 9.931 1.00 0.00 C ATOM 354 OD1 ASP A 22 8.698 3.502 10.497 1.00 0.00 O ATOM 355 OD2 ASP A 22 8.385 1.371 10.461 1.00 0.00 O ATOM 0 H ASP A 22 5.998 1.357 7.699 1.00 0.00 H new ATOM 0 HA ASP A 22 6.350 3.700 9.359 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.859 1.562 8.039 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.678 3.104 7.886 1.00 0.00 H new ATOM 360 N THR A 23 6.316 3.995 6.150 1.00 0.00 N ATOM 361 CA THR A 23 6.225 4.966 5.037 1.00 0.00 C ATOM 362 C THR A 23 4.921 5.748 5.153 1.00 0.00 C ATOM 363 O THR A 23 4.886 6.956 5.027 1.00 0.00 O ATOM 364 CB THR A 23 6.153 4.087 3.808 1.00 0.00 C ATOM 365 OG1 THR A 23 7.397 3.427 3.613 1.00 0.00 O ATOM 366 CG2 THR A 23 5.816 4.942 2.590 1.00 0.00 C ATOM 0 H THR A 23 6.155 3.024 5.881 1.00 0.00 H new ATOM 0 HA THR A 23 7.051 5.677 5.022 1.00 0.00 H new ATOM 0 HB THR A 23 5.375 3.336 3.944 1.00 0.00 H new ATOM 0 HG1 THR A 23 8.130 4.053 3.788 1.00 0.00 H new ATOM 0 HG21 THR A 23 5.764 4.309 1.704 1.00 0.00 H new ATOM 0 HG22 THR A 23 4.854 5.431 2.744 1.00 0.00 H new ATOM 0 HG23 THR A 23 6.589 5.698 2.451 1.00 0.00 H new ATOM 374 N LEU A 24 3.840 5.049 5.388 1.00 0.00 N ATOM 375 CA LEU A 24 2.527 5.725 5.510 1.00 0.00 C ATOM 376 C LEU A 24 2.460 6.446 6.846 1.00 0.00 C ATOM 377 O LEU A 24 1.841 7.483 6.970 1.00 0.00 O ATOM 378 CB LEU A 24 1.488 4.604 5.446 1.00 0.00 C ATOM 379 CG LEU A 24 1.150 4.297 3.986 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.415 2.959 3.901 1.00 0.00 C ATOM 381 CD2 LEU A 24 0.251 5.403 3.428 1.00 0.00 C ATOM 0 H LEU A 24 3.817 4.035 5.500 1.00 0.00 H new ATOM 0 HA LEU A 24 2.358 6.465 4.728 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.873 3.710 5.936 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.587 4.899 5.984 1.00 0.00 H new ATOM 0 HG LEU A 24 2.071 4.245 3.405 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.175 2.741 2.860 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.051 2.169 4.300 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.505 3.012 4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.009 5.185 2.388 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.669 5.453 4.011 1.00 0.00 H new ATOM 0 HD23 LEU A 24 0.771 6.359 3.487 1.00 0.00 H new ATOM 393 N LEU A 25 3.102 5.916 7.852 1.00 0.00 N ATOM 394 CA LEU A 25 3.057 6.615 9.171 1.00 0.00 C ATOM 395 C LEU A 25 4.065 7.746 9.190 1.00 0.00 C ATOM 396 O LEU A 25 3.956 8.688 9.948 1.00 0.00 O ATOM 397 CB LEU A 25 3.377 5.559 10.223 1.00 0.00 C ATOM 398 CG LEU A 25 2.296 4.478 10.193 1.00 0.00 C ATOM 399 CD1 LEU A 25 2.350 3.666 11.484 1.00 0.00 C ATOM 400 CD2 LEU A 25 0.916 5.128 10.053 1.00 0.00 C ATOM 0 H LEU A 25 3.643 5.052 7.823 1.00 0.00 H new ATOM 0 HA LEU A 25 2.082 7.061 9.366 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.355 5.118 10.028 1.00 0.00 H new ATOM 0 HB3 LEU A 25 3.425 6.016 11.212 1.00 0.00 H new ATOM 0 HG LEU A 25 2.470 3.819 9.342 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.579 2.896 11.462 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.329 3.197 11.578 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.180 4.325 12.336 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.149 4.353 10.032 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.739 5.791 10.900 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.877 5.702 9.128 1.00 0.00 H new ATOM 412 N GLU A 26 5.000 7.694 8.305 1.00 0.00 N ATOM 413 CA GLU A 26 5.972 8.797 8.196 1.00 0.00 C ATOM 414 C GLU A 26 5.422 9.728 7.148 1.00 0.00 C ATOM 415 O GLU A 26 5.707 10.909 7.108 1.00 0.00 O ATOM 416 CB GLU A 26 7.297 8.167 7.762 1.00 0.00 C ATOM 417 CG GLU A 26 7.917 7.413 8.940 1.00 0.00 C ATOM 418 CD GLU A 26 8.910 8.325 9.664 1.00 0.00 C ATOM 419 OE1 GLU A 26 9.330 9.302 9.067 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.235 8.029 10.801 1.00 0.00 O ATOM 0 H GLU A 26 5.136 6.928 7.645 1.00 0.00 H new ATOM 0 HA GLU A 26 6.134 9.350 9.121 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.131 7.485 6.928 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.981 8.940 7.411 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.137 7.088 9.628 1.00 0.00 H new ATOM 0 HG3 GLU A 26 8.423 6.515 8.585 1.00 0.00 H new ATOM 427 N LEU A 27 4.604 9.178 6.303 1.00 0.00 N ATOM 428 CA LEU A 27 3.981 9.980 5.250 1.00 0.00 C ATOM 429 C LEU A 27 2.900 10.858 5.875 1.00 0.00 C ATOM 430 O LEU A 27 2.622 11.947 5.414 1.00 0.00 O ATOM 431 CB LEU A 27 3.383 8.968 4.272 1.00 0.00 C ATOM 432 CG LEU A 27 2.487 9.691 3.269 1.00 0.00 C ATOM 433 CD1 LEU A 27 3.348 10.569 2.360 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.738 8.659 2.423 1.00 0.00 C ATOM 0 H LEU A 27 4.344 8.192 6.306 1.00 0.00 H new ATOM 0 HA LEU A 27 4.682 10.641 4.740 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.179 8.439 3.748 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.807 8.219 4.815 1.00 0.00 H new ATOM 0 HG LEU A 27 1.769 10.315 3.802 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.710 11.086 1.643 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.884 11.302 2.963 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.064 9.946 1.825 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.097 9.172 1.706 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.456 8.037 1.888 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.127 8.032 3.072 1.00 0.00 H new ATOM 446 N GLU A 28 2.310 10.399 6.949 1.00 0.00 N ATOM 447 CA GLU A 28 1.274 11.217 7.628 1.00 0.00 C ATOM 448 C GLU A 28 1.951 12.447 8.220 1.00 0.00 C ATOM 449 O GLU A 28 1.442 13.549 8.154 1.00 0.00 O ATOM 450 CB GLU A 28 0.728 10.330 8.747 1.00 0.00 C ATOM 451 CG GLU A 28 -0.170 9.246 8.154 1.00 0.00 C ATOM 452 CD GLU A 28 -0.250 8.061 9.117 1.00 0.00 C ATOM 453 OE1 GLU A 28 -0.121 8.284 10.310 1.00 0.00 O ATOM 454 OE2 GLU A 28 -0.441 6.952 8.646 1.00 0.00 O ATOM 0 H GLU A 28 2.504 9.495 7.380 1.00 0.00 H new ATOM 0 HA GLU A 28 0.480 11.545 6.957 1.00 0.00 H new ATOM 0 HB2 GLU A 28 1.551 9.873 9.296 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.165 10.933 9.460 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.167 9.646 7.971 1.00 0.00 H new ATOM 0 HG3 GLU A 28 0.224 8.919 7.192 1.00 0.00 H new ATOM 461 N LYS A 29 3.119 12.263 8.780 1.00 0.00 N ATOM 462 CA LYS A 29 3.854 13.421 9.356 1.00 0.00 C ATOM 463 C LYS A 29 4.429 14.241 8.210 1.00 0.00 C ATOM 464 O LYS A 29 4.697 15.421 8.326 1.00 0.00 O ATOM 465 CB LYS A 29 4.936 12.793 10.249 1.00 0.00 C ATOM 466 CG LYS A 29 6.349 13.021 9.692 1.00 0.00 C ATOM 467 CD LYS A 29 7.191 11.798 10.006 1.00 0.00 C ATOM 468 CE LYS A 29 7.421 11.704 11.515 1.00 0.00 C ATOM 469 NZ LYS A 29 8.543 12.643 11.795 1.00 0.00 N ATOM 0 H LYS A 29 3.592 11.363 8.862 1.00 0.00 H new ATOM 0 HA LYS A 29 3.237 14.101 9.943 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.869 13.217 11.251 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.752 11.723 10.342 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.310 13.188 8.616 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.793 13.911 10.137 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.690 10.898 9.648 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.147 11.859 9.486 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.525 11.984 12.069 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.675 10.687 11.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 9.319 12.128 12.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.884 13.052 10.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.210 13.405 12.420 1.00 0.00 H new ATOM 483 N ASN A 30 4.594 13.599 7.101 1.00 0.00 N ATOM 484 CA ASN A 30 5.126 14.280 5.893 1.00 0.00 C ATOM 485 C ASN A 30 4.457 13.673 4.684 1.00 0.00 C ATOM 486 O ASN A 30 5.004 12.836 3.993 1.00 0.00 O ATOM 487 CB ASN A 30 6.634 14.037 5.893 1.00 0.00 C ATOM 488 CG ASN A 30 7.358 15.372 6.073 1.00 0.00 C ATOM 489 OD1 ASN A 30 6.889 16.396 5.620 1.00 0.00 O ATOM 490 ND2 ASN A 30 8.488 15.404 6.721 1.00 0.00 N ATOM 0 H ASN A 30 4.380 12.610 6.973 1.00 0.00 H new ATOM 0 HA ASN A 30 4.931 15.352 5.880 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.904 13.352 6.697 1.00 0.00 H new ATOM 0 HB3 ASN A 30 6.939 13.567 4.958 1.00 0.00 H new ATOM 0 HD21 ASN A 30 8.978 16.289 6.848 1.00 0.00 H new ATOM 0 HD22 ASN A 30 8.882 14.544 7.102 1.00 0.00 H new ATOM 497 N PRO A 31 3.258 14.115 4.512 1.00 0.00 N ATOM 498 CA PRO A 31 2.407 13.629 3.427 1.00 0.00 C ATOM 499 C PRO A 31 2.637 14.425 2.142 1.00 0.00 C ATOM 500 O PRO A 31 1.811 14.431 1.253 1.00 0.00 O ATOM 501 CB PRO A 31 1.017 13.863 3.989 1.00 0.00 C ATOM 502 CG PRO A 31 1.138 14.981 4.976 1.00 0.00 C ATOM 503 CD PRO A 31 2.584 15.121 5.336 1.00 0.00 C ATOM 0 HA PRO A 31 2.596 12.593 3.147 1.00 0.00 H new ATOM 0 HB2 PRO A 31 0.316 14.121 3.195 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.636 12.962 4.469 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.759 15.910 4.549 1.00 0.00 H new ATOM 0 HG3 PRO A 31 0.542 14.772 5.864 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.953 16.124 5.121 1.00 0.00 H new ATOM 0 HD3 PRO A 31 2.749 14.942 6.398 1.00 0.00 H new ATOM 511 N GLU A 32 3.750 15.093 2.034 1.00 0.00 N ATOM 512 CA GLU A 32 4.027 15.885 0.797 1.00 0.00 C ATOM 513 C GLU A 32 5.510 15.789 0.442 1.00 0.00 C ATOM 514 O GLU A 32 5.984 16.430 -0.475 1.00 0.00 O ATOM 515 CB GLU A 32 3.641 17.343 1.108 1.00 0.00 C ATOM 516 CG GLU A 32 3.171 17.482 2.559 1.00 0.00 C ATOM 517 CD GLU A 32 3.153 18.962 2.952 1.00 0.00 C ATOM 518 OE1 GLU A 32 3.210 19.792 2.060 1.00 0.00 O ATOM 519 OE2 GLU A 32 3.078 19.238 4.138 1.00 0.00 O ATOM 0 H GLU A 32 4.481 15.127 2.745 1.00 0.00 H new ATOM 0 HA GLU A 32 3.457 15.508 -0.052 1.00 0.00 H new ATOM 0 HB2 GLU A 32 4.496 17.996 0.934 1.00 0.00 H new ATOM 0 HB3 GLU A 32 2.850 17.667 0.432 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.175 17.053 2.672 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.835 16.927 3.222 1.00 0.00 H new ATOM 526 N ASP A 33 6.243 14.986 1.157 1.00 0.00 N ATOM 527 CA ASP A 33 7.693 14.840 0.857 1.00 0.00 C ATOM 528 C ASP A 33 7.879 14.187 -0.507 1.00 0.00 C ATOM 529 O ASP A 33 8.952 14.192 -1.079 1.00 0.00 O ATOM 530 CB ASP A 33 8.243 13.943 1.965 1.00 0.00 C ATOM 531 CG ASP A 33 8.166 14.681 3.303 1.00 0.00 C ATOM 532 OD1 ASP A 33 7.200 15.398 3.505 1.00 0.00 O ATOM 533 OD2 ASP A 33 9.074 14.519 4.100 1.00 0.00 O ATOM 0 H ASP A 33 5.901 14.424 1.937 1.00 0.00 H new ATOM 0 HA ASP A 33 8.208 15.800 0.824 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.671 13.016 2.015 1.00 0.00 H new ATOM 0 HB3 ASP A 33 9.275 13.669 1.747 1.00 0.00 H new ATOM 538 N MET A 34 6.835 13.605 -1.013 1.00 0.00 N ATOM 539 CA MET A 34 6.905 12.917 -2.327 1.00 0.00 C ATOM 540 C MET A 34 7.943 11.804 -2.262 1.00 0.00 C ATOM 541 O MET A 34 8.310 11.219 -3.261 1.00 0.00 O ATOM 542 CB MET A 34 7.302 13.991 -3.342 1.00 0.00 C ATOM 543 CG MET A 34 6.098 14.889 -3.636 1.00 0.00 C ATOM 544 SD MET A 34 4.844 13.942 -4.537 1.00 0.00 S ATOM 545 CE MET A 34 5.255 14.541 -6.195 1.00 0.00 C ATOM 0 H MET A 34 5.919 13.576 -0.564 1.00 0.00 H new ATOM 0 HA MET A 34 5.958 12.456 -2.607 1.00 0.00 H new ATOM 0 HB2 MET A 34 8.127 14.587 -2.952 1.00 0.00 H new ATOM 0 HB3 MET A 34 7.654 13.524 -4.262 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.680 15.272 -2.705 1.00 0.00 H new ATOM 0 HG3 MET A 34 6.410 15.752 -4.224 1.00 0.00 H new ATOM 0 HE1 MET A 34 4.591 14.077 -6.924 1.00 0.00 H new ATOM 0 HE2 MET A 34 5.134 15.624 -6.231 1.00 0.00 H new ATOM 0 HE3 MET A 34 6.288 14.284 -6.429 1.00 0.00 H new ATOM 555 N GLU A 35 8.391 11.484 -1.082 1.00 0.00 N ATOM 556 CA GLU A 35 9.368 10.386 -0.936 1.00 0.00 C ATOM 557 C GLU A 35 8.640 9.220 -0.301 1.00 0.00 C ATOM 558 O GLU A 35 8.775 8.083 -0.709 1.00 0.00 O ATOM 559 CB GLU A 35 10.467 10.923 -0.020 1.00 0.00 C ATOM 560 CG GLU A 35 9.922 11.105 1.398 1.00 0.00 C ATOM 561 CD GLU A 35 11.026 11.661 2.297 1.00 0.00 C ATOM 562 OE1 GLU A 35 11.970 10.934 2.561 1.00 0.00 O ATOM 563 OE2 GLU A 35 10.912 12.805 2.707 1.00 0.00 O ATOM 0 H GLU A 35 8.118 11.941 -0.212 1.00 0.00 H new ATOM 0 HA GLU A 35 9.802 10.053 -1.879 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.311 10.234 -0.008 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.837 11.875 -0.401 1.00 0.00 H new ATOM 0 HG2 GLU A 35 9.069 11.784 1.388 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.566 10.152 1.788 1.00 0.00 H new ATOM 570 N LEU A 36 7.824 9.508 0.669 1.00 0.00 N ATOM 571 CA LEU A 36 7.034 8.420 1.297 1.00 0.00 C ATOM 572 C LEU A 36 5.904 8.064 0.342 1.00 0.00 C ATOM 573 O LEU A 36 5.376 6.972 0.363 1.00 0.00 O ATOM 574 CB LEU A 36 6.479 8.988 2.606 1.00 0.00 C ATOM 575 CG LEU A 36 7.624 9.481 3.495 1.00 0.00 C ATOM 576 CD1 LEU A 36 7.128 9.611 4.932 1.00 0.00 C ATOM 577 CD2 LEU A 36 8.788 8.485 3.448 1.00 0.00 C ATOM 0 H LEU A 36 7.671 10.441 1.051 1.00 0.00 H new ATOM 0 HA LEU A 36 7.623 7.525 1.498 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.794 9.809 2.393 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.906 8.222 3.129 1.00 0.00 H new ATOM 0 HG LEU A 36 7.967 10.451 3.134 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.941 9.962 5.567 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.305 10.324 4.970 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.783 8.640 5.287 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.599 8.843 4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.449 7.512 3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.145 8.391 2.422 1.00 0.00 H new ATOM 589 N ILE A 37 5.548 8.983 -0.518 1.00 0.00 N ATOM 590 CA ILE A 37 4.474 8.696 -1.498 1.00 0.00 C ATOM 591 C ILE A 37 5.051 7.845 -2.625 1.00 0.00 C ATOM 592 O ILE A 37 4.350 7.094 -3.274 1.00 0.00 O ATOM 593 CB ILE A 37 4.036 10.062 -2.022 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.283 10.812 -0.921 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.119 9.875 -3.231 1.00 0.00 C ATOM 596 CD1 ILE A 37 2.769 12.144 -1.466 1.00 0.00 C ATOM 0 H ILE A 37 5.957 9.915 -0.579 1.00 0.00 H new ATOM 0 HA ILE A 37 3.635 8.151 -1.066 1.00 0.00 H new ATOM 0 HB ILE A 37 4.914 10.636 -2.318 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.449 10.209 -0.561 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.941 10.986 -0.070 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.806 10.850 -3.605 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.655 9.341 -4.015 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.241 9.301 -2.936 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.233 12.676 -0.680 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.611 12.748 -1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.096 11.959 -2.303 1.00 0.00 H new ATOM 608 N ASN A 38 6.334 7.953 -2.861 1.00 0.00 N ATOM 609 CA ASN A 38 6.953 7.143 -3.942 1.00 0.00 C ATOM 610 C ASN A 38 7.439 5.814 -3.386 1.00 0.00 C ATOM 611 O ASN A 38 7.369 4.790 -4.037 1.00 0.00 O ATOM 612 CB ASN A 38 8.119 7.982 -4.466 1.00 0.00 C ATOM 613 CG ASN A 38 7.963 8.192 -5.972 1.00 0.00 C ATOM 614 OD1 ASN A 38 7.843 9.310 -6.433 1.00 0.00 O ATOM 615 ND2 ASN A 38 7.960 7.156 -6.766 1.00 0.00 N ATOM 0 H ASN A 38 6.973 8.565 -2.353 1.00 0.00 H new ATOM 0 HA ASN A 38 6.247 6.910 -4.739 1.00 0.00 H new ATOM 0 HB2 ASN A 38 8.146 8.945 -3.955 1.00 0.00 H new ATOM 0 HB3 ASN A 38 9.064 7.482 -4.254 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.857 7.285 -7.773 1.00 0.00 H new ATOM 0 HD22 ASN A 38 8.061 6.217 -6.380 1.00 0.00 H new ATOM 622 N GLU A 39 7.902 5.816 -2.178 1.00 0.00 N ATOM 623 CA GLU A 39 8.358 4.538 -1.571 1.00 0.00 C ATOM 624 C GLU A 39 7.126 3.718 -1.202 1.00 0.00 C ATOM 625 O GLU A 39 7.178 2.515 -1.031 1.00 0.00 O ATOM 626 CB GLU A 39 9.183 4.929 -0.338 1.00 0.00 C ATOM 627 CG GLU A 39 8.261 5.210 0.850 1.00 0.00 C ATOM 628 CD GLU A 39 9.084 5.770 2.011 1.00 0.00 C ATOM 629 OE1 GLU A 39 9.936 6.606 1.759 1.00 0.00 O ATOM 630 OE2 GLU A 39 8.849 5.353 3.134 1.00 0.00 O ATOM 0 H GLU A 39 7.986 6.640 -1.583 1.00 0.00 H new ATOM 0 HA GLU A 39 8.965 3.930 -2.242 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.877 4.127 -0.087 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.783 5.812 -0.558 1.00 0.00 H new ATOM 0 HG2 GLU A 39 7.486 5.921 0.563 1.00 0.00 H new ATOM 0 HG3 GLU A 39 7.755 4.294 1.157 1.00 0.00 H new ATOM 637 N ALA A 40 6.008 4.379 -1.118 1.00 0.00 N ATOM 638 CA ALA A 40 4.736 3.682 -0.800 1.00 0.00 C ATOM 639 C ALA A 40 4.073 3.241 -2.105 1.00 0.00 C ATOM 640 O ALA A 40 3.733 2.087 -2.279 1.00 0.00 O ATOM 641 CB ALA A 40 3.877 4.723 -0.082 1.00 0.00 C ATOM 0 H ALA A 40 5.922 5.386 -1.258 1.00 0.00 H new ATOM 0 HA ALA A 40 4.879 2.794 -0.184 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.917 4.281 0.186 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.388 5.056 0.822 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.712 5.576 -0.741 1.00 0.00 H new ATOM 647 N PHE A 41 3.900 4.146 -3.037 1.00 0.00 N ATOM 648 CA PHE A 41 3.279 3.753 -4.328 1.00 0.00 C ATOM 649 C PHE A 41 3.966 2.484 -4.846 1.00 0.00 C ATOM 650 O PHE A 41 3.339 1.611 -5.411 1.00 0.00 O ATOM 651 CB PHE A 41 3.533 4.942 -5.261 1.00 0.00 C ATOM 652 CG PHE A 41 3.488 4.489 -6.703 1.00 0.00 C ATOM 653 CD1 PHE A 41 4.574 3.796 -7.251 1.00 0.00 C ATOM 654 CD2 PHE A 41 2.363 4.761 -7.489 1.00 0.00 C ATOM 655 CE1 PHE A 41 4.535 3.375 -8.584 1.00 0.00 C ATOM 656 CE2 PHE A 41 2.323 4.340 -8.824 1.00 0.00 C ATOM 657 CZ PHE A 41 3.409 3.647 -9.372 1.00 0.00 C ATOM 0 H PHE A 41 4.161 5.129 -2.956 1.00 0.00 H new ATOM 0 HA PHE A 41 2.214 3.534 -4.248 1.00 0.00 H new ATOM 0 HB2 PHE A 41 2.783 5.715 -5.091 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.504 5.386 -5.041 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.442 3.586 -6.644 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.525 5.296 -7.066 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.373 2.840 -9.006 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.455 4.550 -9.431 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.379 3.322 -10.402 1.00 0.00 H new ATOM 667 N ARG A 42 5.252 2.381 -4.651 1.00 0.00 N ATOM 668 CA ARG A 42 5.989 1.176 -5.122 1.00 0.00 C ATOM 669 C ARG A 42 5.618 -0.040 -4.273 1.00 0.00 C ATOM 670 O ARG A 42 4.952 -0.947 -4.732 1.00 0.00 O ATOM 671 CB ARG A 42 7.460 1.523 -4.928 1.00 0.00 C ATOM 672 CG ARG A 42 7.926 2.429 -6.064 1.00 0.00 C ATOM 673 CD ARG A 42 9.317 1.989 -6.509 1.00 0.00 C ATOM 674 NE ARG A 42 9.102 1.306 -7.814 1.00 0.00 N ATOM 675 CZ ARG A 42 10.082 0.657 -8.382 1.00 0.00 C ATOM 676 NH1 ARG A 42 11.105 1.309 -8.862 1.00 0.00 N ATOM 677 NH2 ARG A 42 10.038 -0.644 -8.470 1.00 0.00 N ATOM 0 H ARG A 42 5.826 3.083 -4.184 1.00 0.00 H new ATOM 0 HA ARG A 42 5.753 0.926 -6.156 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.603 2.022 -3.969 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.059 0.613 -4.906 1.00 0.00 H new ATOM 0 HG2 ARG A 42 7.228 2.375 -6.900 1.00 0.00 H new ATOM 0 HG3 ARG A 42 7.947 3.467 -5.733 1.00 0.00 H new ATOM 0 HD2 ARG A 42 9.987 2.843 -6.615 1.00 0.00 H new ATOM 0 HD3 ARG A 42 9.771 1.317 -5.781 1.00 0.00 H new ATOM 0 HE ARG A 42 8.188 1.345 -8.265 1.00 0.00 H new ATOM 0 HH11 ARG A 42 11.139 2.326 -8.794 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.871 0.802 -9.306 1.00 0.00 H new ATOM 0 HH21 ARG A 42 9.238 -1.154 -8.095 1.00 0.00 H new ATOM 0 HH22 ARG A 42 10.804 -1.151 -8.914 1.00 0.00 H new ATOM 691 N ALA A 43 6.058 -0.062 -3.039 1.00 0.00 N ATOM 692 CA ALA A 43 5.747 -1.216 -2.140 1.00 0.00 C ATOM 693 C ALA A 43 4.350 -1.767 -2.426 1.00 0.00 C ATOM 694 O ALA A 43 4.168 -2.957 -2.576 1.00 0.00 O ATOM 695 CB ALA A 43 5.817 -0.646 -0.722 1.00 0.00 C ATOM 0 H ALA A 43 6.622 0.674 -2.614 1.00 0.00 H new ATOM 0 HA ALA A 43 6.443 -2.042 -2.286 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.600 -1.435 -0.002 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.816 -0.251 -0.537 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.085 0.155 -0.615 1.00 0.00 H new ATOM 701 N LEU A 44 3.366 -0.917 -2.516 1.00 0.00 N ATOM 702 CA LEU A 44 1.990 -1.408 -2.804 1.00 0.00 C ATOM 703 C LEU A 44 1.940 -1.988 -4.216 1.00 0.00 C ATOM 704 O LEU A 44 1.338 -3.015 -4.457 1.00 0.00 O ATOM 705 CB LEU A 44 1.096 -0.178 -2.683 1.00 0.00 C ATOM 706 CG LEU A 44 1.112 0.315 -1.237 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.693 1.785 -1.193 1.00 0.00 C ATOM 708 CD2 LEU A 44 0.137 -0.522 -0.406 1.00 0.00 C ATOM 0 H LEU A 44 3.454 0.093 -2.403 1.00 0.00 H new ATOM 0 HA LEU A 44 1.671 -2.198 -2.124 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.447 0.608 -3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.078 -0.423 -2.985 1.00 0.00 H new ATOM 0 HG LEU A 44 2.118 0.215 -0.828 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.705 2.136 -0.161 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.388 2.379 -1.786 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.313 1.889 -1.600 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.146 -0.173 0.626 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.869 -0.421 -0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.438 -1.569 -0.437 1.00 0.00 H new ATOM 720 N HIS A 45 2.591 -1.350 -5.149 1.00 0.00 N ATOM 721 CA HIS A 45 2.605 -1.882 -6.538 1.00 0.00 C ATOM 722 C HIS A 45 3.426 -3.167 -6.553 1.00 0.00 C ATOM 723 O HIS A 45 3.202 -4.061 -7.345 1.00 0.00 O ATOM 724 CB HIS A 45 3.279 -0.795 -7.374 1.00 0.00 C ATOM 725 CG HIS A 45 2.683 -0.778 -8.756 1.00 0.00 C ATOM 726 ND1 HIS A 45 1.333 -0.549 -8.977 1.00 0.00 N ATOM 727 CD2 HIS A 45 3.239 -0.957 -9.999 1.00 0.00 C ATOM 728 CE1 HIS A 45 1.124 -0.597 -10.305 1.00 0.00 C ATOM 729 NE2 HIS A 45 2.253 -0.842 -10.975 1.00 0.00 N ATOM 0 H HIS A 45 3.113 -0.485 -5.009 1.00 0.00 H new ATOM 0 HA HIS A 45 1.612 -2.114 -6.924 1.00 0.00 H new ATOM 0 HB2 HIS A 45 3.148 0.177 -6.899 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.352 -0.979 -7.432 1.00 0.00 H new ATOM 0 HD2 HIS A 45 4.283 -1.157 -10.190 1.00 0.00 H new ATOM 0 HE1 HIS A 45 0.161 -0.455 -10.772 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.368 -0.927 -11.985 1.00 0.00 H new ATOM 737 N THR A 46 4.368 -3.263 -5.655 1.00 0.00 N ATOM 738 CA THR A 46 5.209 -4.485 -5.570 1.00 0.00 C ATOM 739 C THR A 46 4.465 -5.537 -4.737 1.00 0.00 C ATOM 740 O THR A 46 4.492 -6.715 -5.033 1.00 0.00 O ATOM 741 CB THR A 46 6.506 -4.008 -4.888 1.00 0.00 C ATOM 742 OG1 THR A 46 7.521 -3.866 -5.871 1.00 0.00 O ATOM 743 CG2 THR A 46 6.970 -5.008 -3.824 1.00 0.00 C ATOM 0 H THR A 46 4.591 -2.539 -4.972 1.00 0.00 H new ATOM 0 HA THR A 46 5.426 -4.948 -6.533 1.00 0.00 H new ATOM 0 HB THR A 46 6.311 -3.053 -4.400 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.349 -3.561 -5.445 1.00 0.00 H new ATOM 0 HG21 THR A 46 7.887 -4.646 -3.359 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.196 -5.116 -3.064 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.157 -5.975 -4.291 1.00 0.00 H new ATOM 751 N LEU A 47 3.787 -5.109 -3.704 1.00 0.00 N ATOM 752 CA LEU A 47 3.026 -6.071 -2.861 1.00 0.00 C ATOM 753 C LEU A 47 1.821 -6.594 -3.646 1.00 0.00 C ATOM 754 O LEU A 47 1.410 -7.727 -3.497 1.00 0.00 O ATOM 755 CB LEU A 47 2.570 -5.256 -1.650 1.00 0.00 C ATOM 756 CG LEU A 47 3.392 -5.660 -0.428 1.00 0.00 C ATOM 757 CD1 LEU A 47 3.043 -4.745 0.748 1.00 0.00 C ATOM 758 CD2 LEU A 47 3.070 -7.110 -0.060 1.00 0.00 C ATOM 0 H LEU A 47 3.729 -4.134 -3.410 1.00 0.00 H new ATOM 0 HA LEU A 47 3.619 -6.936 -2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.692 -4.191 -1.848 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.510 -5.426 -1.461 1.00 0.00 H new ATOM 0 HG LEU A 47 4.454 -5.567 -0.655 1.00 0.00 H new ATOM 0 HD11 LEU A 47 3.630 -5.034 1.620 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.269 -3.712 0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.982 -4.837 0.978 1.00 0.00 H new ATOM 0 HD21 LEU A 47 3.655 -7.403 0.812 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.008 -7.200 0.168 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.317 -7.762 -0.898 1.00 0.00 H new ATOM 770 N LYS A 48 1.263 -5.771 -4.490 1.00 0.00 N ATOM 771 CA LYS A 48 0.094 -6.205 -5.304 1.00 0.00 C ATOM 772 C LYS A 48 0.533 -7.290 -6.294 1.00 0.00 C ATOM 773 O LYS A 48 -0.111 -8.311 -6.445 1.00 0.00 O ATOM 774 CB LYS A 48 -0.348 -4.936 -6.036 1.00 0.00 C ATOM 775 CG LYS A 48 -1.337 -5.282 -7.151 1.00 0.00 C ATOM 776 CD LYS A 48 -1.089 -4.357 -8.340 1.00 0.00 C ATOM 777 CE LYS A 48 -0.061 -4.994 -9.274 1.00 0.00 C ATOM 778 NZ LYS A 48 0.153 -3.987 -10.349 1.00 0.00 N ATOM 0 H LYS A 48 1.569 -4.811 -4.651 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.713 -6.631 -4.708 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.811 -4.245 -5.332 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.521 -4.429 -6.456 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -1.216 -6.323 -7.452 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -2.361 -5.170 -6.794 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -2.021 -4.178 -8.876 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -0.730 -3.388 -7.992 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.868 -5.214 -8.748 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -0.428 -5.936 -9.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.561 -4.453 -11.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.757 -3.553 -10.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.805 -3.251 -10.010 1.00 0.00 H new ATOM 792 N GLY A 49 1.633 -7.074 -6.965 1.00 0.00 N ATOM 793 CA GLY A 49 2.123 -8.087 -7.943 1.00 0.00 C ATOM 794 C GLY A 49 2.452 -9.389 -7.210 1.00 0.00 C ATOM 795 O GLY A 49 2.299 -10.468 -7.744 1.00 0.00 O ATOM 0 H GLY A 49 2.213 -6.240 -6.878 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.365 -8.268 -8.705 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.009 -7.713 -8.457 1.00 0.00 H new ATOM 799 N MET A 50 2.903 -9.296 -5.989 1.00 0.00 N ATOM 800 CA MET A 50 3.237 -10.533 -5.227 1.00 0.00 C ATOM 801 C MET A 50 1.951 -11.205 -4.741 1.00 0.00 C ATOM 802 O MET A 50 1.946 -12.360 -4.360 1.00 0.00 O ATOM 803 CB MET A 50 4.084 -10.056 -4.046 1.00 0.00 C ATOM 804 CG MET A 50 5.490 -9.701 -4.539 1.00 0.00 C ATOM 805 SD MET A 50 6.649 -9.730 -3.148 1.00 0.00 S ATOM 806 CE MET A 50 5.607 -8.848 -1.960 1.00 0.00 C ATOM 0 H MET A 50 3.054 -8.421 -5.488 1.00 0.00 H new ATOM 0 HA MET A 50 3.770 -11.267 -5.831 1.00 0.00 H new ATOM 0 HB2 MET A 50 3.620 -9.187 -3.579 1.00 0.00 H new ATOM 0 HB3 MET A 50 4.139 -10.835 -3.286 1.00 0.00 H new ATOM 0 HG2 MET A 50 5.807 -10.409 -5.304 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.486 -8.714 -5.001 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.115 -8.799 -0.997 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.417 -7.838 -2.322 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.660 -9.376 -1.844 1.00 0.00 H new ATOM 816 N ALA A 51 0.859 -10.490 -4.758 1.00 0.00 N ATOM 817 CA ALA A 51 -0.434 -11.080 -4.305 1.00 0.00 C ATOM 818 C ALA A 51 -1.163 -11.715 -5.489 1.00 0.00 C ATOM 819 O ALA A 51 -2.111 -12.457 -5.323 1.00 0.00 O ATOM 820 CB ALA A 51 -1.236 -9.900 -3.758 1.00 0.00 C ATOM 0 H ALA A 51 0.806 -9.519 -5.067 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.294 -11.861 -3.557 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.205 -10.252 -3.403 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.692 -9.442 -2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.385 -9.164 -4.548 1.00 0.00 H new ATOM 826 N GLY A 52 -0.725 -11.431 -6.682 1.00 0.00 N ATOM 827 CA GLY A 52 -1.390 -12.020 -7.877 1.00 0.00 C ATOM 828 C GLY A 52 -0.762 -13.378 -8.169 1.00 0.00 C ATOM 829 O GLY A 52 -1.419 -14.301 -8.609 1.00 0.00 O ATOM 0 H GLY A 52 0.064 -10.817 -6.882 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.460 -12.129 -7.698 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.276 -11.359 -8.736 1.00 0.00 H new ATOM 833 N THR A 53 0.509 -13.508 -7.914 1.00 0.00 N ATOM 834 CA THR A 53 1.193 -14.805 -8.162 1.00 0.00 C ATOM 835 C THR A 53 0.808 -15.806 -7.070 1.00 0.00 C ATOM 836 O THR A 53 1.065 -16.988 -7.173 1.00 0.00 O ATOM 837 CB THR A 53 2.684 -14.462 -8.111 1.00 0.00 C ATOM 838 OG1 THR A 53 3.113 -14.047 -9.400 1.00 0.00 O ATOM 839 CG2 THR A 53 3.494 -15.682 -7.674 1.00 0.00 C ATOM 0 H THR A 53 1.105 -12.768 -7.543 1.00 0.00 H new ATOM 0 HA THR A 53 0.920 -15.265 -9.112 1.00 0.00 H new ATOM 0 HB THR A 53 2.840 -13.659 -7.391 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.067 -13.825 -9.371 1.00 0.00 H new ATOM 0 HG21 THR A 53 4.552 -15.424 -7.642 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.168 -15.999 -6.684 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.340 -16.494 -8.384 1.00 0.00 H new ATOM 847 N MET A 54 0.193 -15.330 -6.033 1.00 0.00 N ATOM 848 CA MET A 54 -0.223 -16.235 -4.923 1.00 0.00 C ATOM 849 C MET A 54 -1.715 -16.550 -5.034 1.00 0.00 C ATOM 850 O MET A 54 -2.295 -17.178 -4.171 1.00 0.00 O ATOM 851 CB MET A 54 0.066 -15.452 -3.642 1.00 0.00 C ATOM 852 CG MET A 54 0.588 -16.404 -2.564 1.00 0.00 C ATOM 853 SD MET A 54 2.110 -17.194 -3.144 1.00 0.00 S ATOM 854 CE MET A 54 3.086 -15.685 -3.343 1.00 0.00 C ATOM 0 H MET A 54 -0.044 -14.347 -5.900 1.00 0.00 H new ATOM 0 HA MET A 54 0.307 -17.187 -4.945 1.00 0.00 H new ATOM 0 HB2 MET A 54 0.801 -14.672 -3.839 1.00 0.00 H new ATOM 0 HB3 MET A 54 -0.840 -14.956 -3.295 1.00 0.00 H new ATOM 0 HG2 MET A 54 0.779 -15.856 -1.641 1.00 0.00 H new ATOM 0 HG3 MET A 54 -0.163 -17.160 -2.337 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.113 -15.947 -3.597 1.00 0.00 H new ATOM 0 HE2 MET A 54 2.658 -15.078 -4.141 1.00 0.00 H new ATOM 0 HE3 MET A 54 3.076 -15.120 -2.411 1.00 0.00 H new ATOM 864 N GLY A 55 -2.338 -16.115 -6.092 1.00 0.00 N ATOM 865 CA GLY A 55 -3.793 -16.383 -6.265 1.00 0.00 C ATOM 866 C GLY A 55 -4.599 -15.408 -5.407 1.00 0.00 C ATOM 867 O GLY A 55 -5.815 -15.426 -5.405 1.00 0.00 O ATOM 0 H GLY A 55 -1.902 -15.584 -6.846 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.071 -16.276 -7.314 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.021 -17.410 -5.978 1.00 0.00 H new ATOM 871 N PHE A 56 -3.934 -14.555 -4.675 1.00 0.00 N ATOM 872 CA PHE A 56 -4.665 -13.579 -3.819 1.00 0.00 C ATOM 873 C PHE A 56 -4.839 -12.254 -4.566 1.00 0.00 C ATOM 874 O PHE A 56 -4.465 -11.204 -4.081 1.00 0.00 O ATOM 875 CB PHE A 56 -3.776 -13.390 -2.589 1.00 0.00 C ATOM 876 CG PHE A 56 -3.550 -14.724 -1.918 1.00 0.00 C ATOM 877 CD1 PHE A 56 -4.593 -15.651 -1.836 1.00 0.00 C ATOM 878 CD2 PHE A 56 -2.295 -15.033 -1.377 1.00 0.00 C ATOM 879 CE1 PHE A 56 -4.384 -16.889 -1.215 1.00 0.00 C ATOM 880 CE2 PHE A 56 -2.085 -16.270 -0.755 1.00 0.00 C ATOM 881 CZ PHE A 56 -3.130 -17.199 -0.674 1.00 0.00 C ATOM 0 H PHE A 56 -2.917 -14.493 -4.633 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.663 -13.927 -3.550 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -2.822 -12.952 -2.881 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -4.245 -12.696 -1.892 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -5.561 -15.412 -2.252 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.489 -14.317 -1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -5.190 -17.605 -1.153 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.118 -16.508 -0.338 1.00 0.00 H new ATOM 0 HZ PHE A 56 -2.969 -18.153 -0.195 1.00 0.00 H new ATOM 891 N SER A 57 -5.402 -12.292 -5.745 1.00 0.00 N ATOM 892 CA SER A 57 -5.594 -11.029 -6.515 1.00 0.00 C ATOM 893 C SER A 57 -6.643 -10.159 -5.837 1.00 0.00 C ATOM 894 O SER A 57 -6.592 -8.946 -5.878 1.00 0.00 O ATOM 895 CB SER A 57 -6.067 -11.466 -7.896 1.00 0.00 C ATOM 896 OG SER A 57 -4.993 -12.090 -8.586 1.00 0.00 O ATOM 0 H SER A 57 -5.736 -13.139 -6.206 1.00 0.00 H new ATOM 0 HA SER A 57 -4.679 -10.439 -6.573 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.905 -12.157 -7.804 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.425 -10.604 -8.460 1.00 0.00 H new ATOM 0 HG SER A 57 -5.295 -12.374 -9.474 1.00 0.00 H new ATOM 902 N SER A 58 -7.576 -10.779 -5.194 1.00 0.00 N ATOM 903 CA SER A 58 -8.627 -10.013 -4.476 1.00 0.00 C ATOM 904 C SER A 58 -7.943 -9.151 -3.429 1.00 0.00 C ATOM 905 O SER A 58 -8.363 -8.053 -3.124 1.00 0.00 O ATOM 906 CB SER A 58 -9.514 -11.067 -3.818 1.00 0.00 C ATOM 907 OG SER A 58 -9.989 -11.968 -4.810 1.00 0.00 O ATOM 0 H SER A 58 -7.661 -11.793 -5.131 1.00 0.00 H new ATOM 0 HA SER A 58 -9.214 -9.363 -5.125 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.951 -11.609 -3.058 1.00 0.00 H new ATOM 0 HB3 SER A 58 -10.353 -10.589 -3.313 1.00 0.00 H new ATOM 0 HG SER A 58 -10.557 -12.647 -4.390 1.00 0.00 H new ATOM 913 N MET A 59 -6.864 -9.647 -2.895 1.00 0.00 N ATOM 914 CA MET A 59 -6.106 -8.874 -1.884 1.00 0.00 C ATOM 915 C MET A 59 -5.009 -8.085 -2.595 1.00 0.00 C ATOM 916 O MET A 59 -4.515 -7.093 -2.096 1.00 0.00 O ATOM 917 CB MET A 59 -5.519 -9.929 -0.945 1.00 0.00 C ATOM 918 CG MET A 59 -4.732 -9.245 0.179 1.00 0.00 C ATOM 919 SD MET A 59 -3.095 -8.759 -0.424 1.00 0.00 S ATOM 920 CE MET A 59 -2.615 -10.363 -1.106 1.00 0.00 C ATOM 0 H MET A 59 -6.474 -10.562 -3.120 1.00 0.00 H new ATOM 0 HA MET A 59 -6.715 -8.157 -1.333 1.00 0.00 H new ATOM 0 HB2 MET A 59 -6.318 -10.538 -0.523 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.866 -10.601 -1.502 1.00 0.00 H new ATOM 0 HG2 MET A 59 -5.274 -8.368 0.533 1.00 0.00 H new ATOM 0 HG3 MET A 59 -4.631 -9.921 1.028 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.530 -10.460 -1.079 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.065 -11.160 -0.514 1.00 0.00 H new ATOM 0 HE3 MET A 59 -2.960 -10.438 -2.137 1.00 0.00 H new ATOM 930 N ALA A 60 -4.644 -8.509 -3.776 1.00 0.00 N ATOM 931 CA ALA A 60 -3.603 -7.772 -4.540 1.00 0.00 C ATOM 932 C ALA A 60 -4.228 -6.513 -5.129 1.00 0.00 C ATOM 933 O ALA A 60 -3.612 -5.470 -5.193 1.00 0.00 O ATOM 934 CB ALA A 60 -3.159 -8.729 -5.647 1.00 0.00 C ATOM 0 H ALA A 60 -5.023 -9.333 -4.242 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.757 -7.467 -3.924 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.389 -8.252 -6.254 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.758 -9.639 -5.202 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -4.013 -8.979 -6.276 1.00 0.00 H new ATOM 940 N LYS A 61 -5.466 -6.597 -5.537 1.00 0.00 N ATOM 941 CA LYS A 61 -6.135 -5.395 -6.093 1.00 0.00 C ATOM 942 C LYS A 61 -6.222 -4.346 -4.999 1.00 0.00 C ATOM 943 O LYS A 61 -6.122 -3.160 -5.240 1.00 0.00 O ATOM 944 CB LYS A 61 -7.527 -5.864 -6.510 1.00 0.00 C ATOM 945 CG LYS A 61 -7.415 -6.876 -7.648 1.00 0.00 C ATOM 946 CD LYS A 61 -8.524 -7.916 -7.495 1.00 0.00 C ATOM 947 CE LYS A 61 -9.880 -7.246 -7.725 1.00 0.00 C ATOM 948 NZ LYS A 61 -10.884 -8.331 -7.545 1.00 0.00 N ATOM 0 H LYS A 61 -6.036 -7.442 -5.508 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.603 -4.957 -6.938 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -8.038 -6.315 -5.660 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.128 -5.012 -6.827 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.501 -6.372 -8.611 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.439 -7.360 -7.628 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -8.380 -8.726 -8.210 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.488 -8.359 -6.500 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -10.044 -6.435 -7.016 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.942 -6.813 -8.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -11.840 -7.947 -7.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -10.707 -9.086 -8.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.807 -8.719 -6.583 1.00 0.00 H new ATOM 962 N LEU A 62 -6.370 -4.787 -3.788 1.00 0.00 N ATOM 963 CA LEU A 62 -6.422 -3.849 -2.660 1.00 0.00 C ATOM 964 C LEU A 62 -5.118 -3.073 -2.635 1.00 0.00 C ATOM 965 O LEU A 62 -5.092 -1.866 -2.512 1.00 0.00 O ATOM 966 CB LEU A 62 -6.523 -4.772 -1.456 1.00 0.00 C ATOM 967 CG LEU A 62 -6.469 -3.971 -0.166 1.00 0.00 C ATOM 968 CD1 LEU A 62 -5.048 -3.460 0.088 1.00 0.00 C ATOM 969 CD2 LEU A 62 -7.437 -2.789 -0.248 1.00 0.00 C ATOM 0 H LEU A 62 -6.458 -5.771 -3.536 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.237 -3.126 -2.699 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.454 -5.338 -1.501 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.708 -5.496 -1.476 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.760 -4.620 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.027 -2.888 1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.366 -4.306 0.168 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -4.738 -2.821 -0.739 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.394 -2.218 0.680 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.157 -2.146 -1.083 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.451 -3.159 -0.400 1.00 0.00 H new ATOM 981 N CYS A 63 -4.030 -3.778 -2.762 1.00 0.00 N ATOM 982 CA CYS A 63 -2.705 -3.112 -2.756 1.00 0.00 C ATOM 983 C CYS A 63 -2.628 -2.155 -3.937 1.00 0.00 C ATOM 984 O CYS A 63 -2.178 -1.034 -3.818 1.00 0.00 O ATOM 985 CB CYS A 63 -1.685 -4.242 -2.900 1.00 0.00 C ATOM 986 SG CYS A 63 -1.637 -5.207 -1.368 1.00 0.00 S ATOM 0 H CYS A 63 -4.004 -4.792 -2.870 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.523 -2.533 -1.851 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.953 -4.884 -3.739 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -0.699 -3.831 -3.115 1.00 0.00 H new ATOM 0 HG CYS A 63 -2.636 -6.038 -1.347 1.00 0.00 H new ATOM 992 N HIS A 64 -3.086 -2.586 -5.078 1.00 0.00 N ATOM 993 CA HIS A 64 -3.060 -1.694 -6.263 1.00 0.00 C ATOM 994 C HIS A 64 -3.928 -0.472 -5.983 1.00 0.00 C ATOM 995 O HIS A 64 -3.737 0.588 -6.544 1.00 0.00 O ATOM 996 CB HIS A 64 -3.650 -2.526 -7.401 1.00 0.00 C ATOM 997 CG HIS A 64 -3.651 -1.720 -8.670 1.00 0.00 C ATOM 998 ND1 HIS A 64 -4.802 -1.517 -9.414 1.00 0.00 N ATOM 999 CD2 HIS A 64 -2.651 -1.058 -9.339 1.00 0.00 C ATOM 1000 CE1 HIS A 64 -4.471 -0.761 -10.476 1.00 0.00 C ATOM 1001 NE2 HIS A 64 -3.172 -0.454 -10.480 1.00 0.00 N ATOM 0 H HIS A 64 -3.476 -3.515 -5.239 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.059 -1.340 -6.508 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.068 -3.437 -7.538 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.666 -2.832 -7.152 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -1.618 -1.013 -9.027 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -5.171 -0.441 -11.234 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -2.669 0.103 -11.171 1.00 0.00 H new ATOM 1009 N THR A 65 -4.882 -0.620 -5.111 1.00 0.00 N ATOM 1010 CA THR A 65 -5.770 0.521 -4.778 1.00 0.00 C ATOM 1011 C THR A 65 -5.033 1.508 -3.861 1.00 0.00 C ATOM 1012 O THR A 65 -5.071 2.702 -4.070 1.00 0.00 O ATOM 1013 CB THR A 65 -6.985 -0.129 -4.088 1.00 0.00 C ATOM 1014 OG1 THR A 65 -8.111 -0.041 -4.949 1.00 0.00 O ATOM 1015 CG2 THR A 65 -7.308 0.565 -2.760 1.00 0.00 C ATOM 0 H THR A 65 -5.085 -1.487 -4.613 1.00 0.00 H new ATOM 0 HA THR A 65 -6.077 1.102 -5.648 1.00 0.00 H new ATOM 0 HB THR A 65 -6.745 -1.172 -3.879 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.240 -0.898 -5.407 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.170 0.083 -2.298 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.450 0.491 -2.092 1.00 0.00 H new ATOM 0 HG23 THR A 65 -7.535 1.615 -2.944 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.353 1.018 -2.857 1.00 0.00 N ATOM 1024 CA LEU A 66 -3.610 1.936 -1.943 1.00 0.00 C ATOM 1025 C LEU A 66 -2.604 2.748 -2.755 1.00 0.00 C ATOM 1026 O LEU A 66 -2.571 3.959 -2.700 1.00 0.00 O ATOM 1027 CB LEU A 66 -2.867 1.020 -0.964 1.00 0.00 C ATOM 1028 CG LEU A 66 -3.823 -0.018 -0.370 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -3.178 -0.656 0.862 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -5.131 0.658 0.039 1.00 0.00 C ATOM 0 H LEU A 66 -4.280 0.026 -2.631 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.271 2.632 -1.426 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.048 0.517 -1.478 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.424 1.615 -0.165 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.030 -0.785 -1.117 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.857 -1.395 1.286 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.246 -1.142 0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.971 0.115 1.604 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.808 -0.085 0.461 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.926 1.427 0.784 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.594 1.115 -0.836 1.00 0.00 H new ATOM 1042 N GLU A 67 -1.789 2.069 -3.510 1.00 0.00 N ATOM 1043 CA GLU A 67 -0.764 2.752 -4.343 1.00 0.00 C ATOM 1044 C GLU A 67 -1.430 3.697 -5.336 1.00 0.00 C ATOM 1045 O GLU A 67 -0.860 4.684 -5.754 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.042 1.590 -5.045 1.00 0.00 C ATOM 1047 CG GLU A 67 -0.351 1.556 -6.550 1.00 0.00 C ATOM 1048 CD GLU A 67 0.557 2.546 -7.280 1.00 0.00 C ATOM 1049 OE1 GLU A 67 1.740 2.267 -7.387 1.00 0.00 O ATOM 1050 OE2 GLU A 67 0.053 3.568 -7.719 1.00 0.00 O ATOM 0 H GLU A 67 -1.790 1.052 -3.586 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.077 3.374 -3.770 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.033 1.687 -4.896 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -0.343 0.646 -4.590 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.198 0.550 -6.941 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -1.397 1.810 -6.723 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.631 3.398 -5.713 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.335 4.273 -6.677 1.00 0.00 C ATOM 1059 C ASN A 68 -3.443 5.667 -6.098 1.00 0.00 C ATOM 1060 O ASN A 68 -3.200 6.655 -6.760 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.717 3.669 -6.801 1.00 0.00 C ATOM 1062 CG ASN A 68 -5.250 3.882 -8.218 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -5.020 3.073 -9.094 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -5.957 4.946 -8.481 1.00 0.00 N ATOM 0 H ASN A 68 -3.158 2.584 -5.396 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.822 4.343 -7.636 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.680 2.604 -6.573 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.390 4.127 -6.077 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -6.317 5.099 -9.423 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -6.150 5.625 -7.745 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.798 5.747 -4.855 1.00 0.00 N ATOM 1072 CA ILE A 69 -3.913 7.073 -4.222 1.00 0.00 C ATOM 1073 C ILE A 69 -2.530 7.659 -4.146 1.00 0.00 C ATOM 1074 O ILE A 69 -2.282 8.808 -4.434 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.463 6.805 -2.830 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -5.954 6.505 -2.935 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -4.241 8.041 -1.951 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -6.170 5.136 -3.573 1.00 0.00 C ATOM 0 H ILE A 69 -4.013 4.952 -4.253 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.556 7.767 -4.764 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.951 5.952 -2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.408 6.529 -1.944 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.447 7.274 -3.530 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.634 7.852 -0.952 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.174 8.255 -1.887 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.757 8.896 -2.388 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.238 4.932 -3.643 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.732 5.127 -4.571 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.694 4.370 -2.961 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.623 6.834 -3.798 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.216 7.278 -3.735 1.00 0.00 C ATOM 1092 C LEU A 70 0.219 7.637 -5.142 1.00 0.00 C ATOM 1093 O LEU A 70 1.192 8.333 -5.349 1.00 0.00 O ATOM 1094 CB LEU A 70 0.577 6.095 -3.169 1.00 0.00 C ATOM 1095 CG LEU A 70 -0.068 5.611 -1.863 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.956 4.822 -1.050 1.00 0.00 C ATOM 1097 CD2 LEU A 70 -0.550 6.808 -1.036 1.00 0.00 C ATOM 0 H LEU A 70 -1.785 5.858 -3.549 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.061 8.154 -3.105 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.603 5.282 -3.895 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.610 6.392 -2.987 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.919 4.975 -2.106 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.498 4.478 -0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 70 1.295 3.962 -1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.808 5.462 -0.819 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.006 6.452 -0.112 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.297 7.451 -0.798 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.285 7.374 -1.609 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.532 7.203 -6.114 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.188 7.566 -7.508 1.00 0.00 C ATOM 1111 C ASP A 71 -0.730 8.967 -7.780 1.00 0.00 C ATOM 1112 O ASP A 71 0.000 9.860 -8.160 1.00 0.00 O ATOM 1113 CB ASP A 71 -0.869 6.522 -8.393 1.00 0.00 C ATOM 1114 CG ASP A 71 -0.093 6.385 -9.705 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.787 7.198 -9.935 1.00 0.00 O ATOM 1116 OD2 ASP A 71 -0.391 5.471 -10.454 1.00 0.00 O ATOM 0 H ASP A 71 -1.360 6.619 -6.002 1.00 0.00 H new ATOM 0 HA ASP A 71 0.885 7.577 -7.699 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.907 5.562 -7.878 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.899 6.817 -8.596 1.00 0.00 H new ATOM 1121 N LYS A 72 -1.999 9.182 -7.545 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.555 10.539 -7.747 1.00 0.00 C ATOM 1123 C LYS A 72 -1.876 11.481 -6.767 1.00 0.00 C ATOM 1124 O LYS A 72 -1.686 12.651 -7.032 1.00 0.00 O ATOM 1125 CB LYS A 72 -4.045 10.389 -7.481 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.276 9.602 -6.205 1.00 0.00 C ATOM 1127 CD LYS A 72 -5.703 9.836 -5.786 1.00 0.00 C ATOM 1128 CE LYS A 72 -5.828 9.762 -4.263 1.00 0.00 C ATOM 1129 NZ LYS A 72 -7.188 9.206 -4.021 1.00 0.00 N ATOM 0 H LYS A 72 -2.664 8.478 -7.225 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.391 10.951 -8.743 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.507 11.373 -7.398 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.522 9.882 -8.320 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.093 8.540 -6.370 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.588 9.926 -5.424 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.037 10.812 -6.138 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.351 9.091 -6.248 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.057 9.123 -3.833 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.716 10.746 -3.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.257 8.871 -3.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.900 9.946 -4.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.359 8.411 -4.670 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.454 10.954 -5.661 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.721 11.782 -4.677 1.00 0.00 C ATOM 1145 C ALA A 73 0.606 12.191 -5.305 1.00 0.00 C ATOM 1146 O ALA A 73 1.131 13.259 -5.064 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.481 10.854 -3.494 1.00 0.00 C ATOM 0 H ALA A 73 -1.586 9.978 -5.394 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.255 12.684 -4.377 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.060 11.391 -2.715 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.438 10.511 -3.101 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.107 9.996 -3.818 1.00 0.00 H new ATOM 1153 N ARG A 74 1.130 11.334 -6.138 1.00 0.00 N ATOM 1154 CA ARG A 74 2.408 11.637 -6.834 1.00 0.00 C ATOM 1155 C ARG A 74 2.076 12.385 -8.126 1.00 0.00 C ATOM 1156 O ARG A 74 2.860 13.165 -8.631 1.00 0.00 O ATOM 1157 CB ARG A 74 3.049 10.257 -7.100 1.00 0.00 C ATOM 1158 CG ARG A 74 3.300 10.039 -8.600 1.00 0.00 C ATOM 1159 CD ARG A 74 3.910 8.654 -8.823 1.00 0.00 C ATOM 1160 NE ARG A 74 5.294 8.919 -9.304 1.00 0.00 N ATOM 1161 CZ ARG A 74 5.924 8.022 -10.014 1.00 0.00 C ATOM 1162 NH1 ARG A 74 5.723 6.753 -9.792 1.00 0.00 N ATOM 1163 NH2 ARG A 74 6.755 8.397 -10.948 1.00 0.00 N ATOM 0 H ARG A 74 0.721 10.428 -6.367 1.00 0.00 H new ATOM 0 HA ARG A 74 3.093 12.266 -6.266 1.00 0.00 H new ATOM 0 HB2 ARG A 74 3.991 10.180 -6.556 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.396 9.471 -6.720 1.00 0.00 H new ATOM 0 HG2 ARG A 74 2.364 10.128 -9.152 1.00 0.00 H new ATOM 0 HG3 ARG A 74 3.971 10.809 -8.982 1.00 0.00 H new ATOM 0 HD2 ARG A 74 3.917 8.072 -7.901 1.00 0.00 H new ATOM 0 HD3 ARG A 74 3.339 8.084 -9.556 1.00 0.00 H new ATOM 0 HE ARG A 74 5.751 9.803 -9.079 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.073 6.460 -9.063 1.00 0.00 H new ATOM 0 HH12 ARG A 74 6.216 6.054 -10.347 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.912 9.390 -11.123 1.00 0.00 H new ATOM 0 HH22 ARG A 74 7.248 7.697 -11.503 1.00 0.00 H new ATOM 1177 N ASN A 75 0.899 12.163 -8.646 1.00 0.00 N ATOM 1178 CA ASN A 75 0.489 12.870 -9.887 1.00 0.00 C ATOM 1179 C ASN A 75 0.272 14.347 -9.562 1.00 0.00 C ATOM 1180 O ASN A 75 0.082 15.168 -10.439 1.00 0.00 O ATOM 1181 CB ASN A 75 -0.822 12.208 -10.314 1.00 0.00 C ATOM 1182 CG ASN A 75 -1.089 12.512 -11.788 1.00 0.00 C ATOM 1183 OD1 ASN A 75 -2.122 13.051 -12.133 1.00 0.00 O ATOM 1184 ND2 ASN A 75 -0.194 12.187 -12.680 1.00 0.00 N ATOM 0 H ASN A 75 0.205 11.521 -8.263 1.00 0.00 H new ATOM 0 HA ASN A 75 1.235 12.810 -10.680 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -0.766 11.131 -10.158 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -1.644 12.576 -9.701 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -0.362 12.385 -13.666 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.673 11.735 -12.391 1.00 0.00 H new ATOM 1191 N SER A 76 0.300 14.682 -8.294 1.00 0.00 N ATOM 1192 CA SER A 76 0.101 16.095 -7.864 1.00 0.00 C ATOM 1193 C SER A 76 -1.376 16.464 -7.928 1.00 0.00 C ATOM 1194 O SER A 76 -1.729 17.599 -8.181 1.00 0.00 O ATOM 1195 CB SER A 76 0.917 16.952 -8.835 1.00 0.00 C ATOM 1196 OG SER A 76 1.577 17.981 -8.110 1.00 0.00 O ATOM 0 H SER A 76 0.455 14.023 -7.531 1.00 0.00 H new ATOM 0 HA SER A 76 0.424 16.251 -6.835 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.647 16.334 -9.359 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.264 17.386 -9.593 1.00 0.00 H new ATOM 0 HG SER A 76 2.102 18.531 -8.728 1.00 0.00 H new ATOM 1202 N GLU A 77 -2.253 15.525 -7.689 1.00 0.00 N ATOM 1203 CA GLU A 77 -3.692 15.856 -7.727 1.00 0.00 C ATOM 1204 C GLU A 77 -4.257 15.759 -6.321 1.00 0.00 C ATOM 1205 O GLU A 77 -5.125 16.513 -5.925 1.00 0.00 O ATOM 1206 CB GLU A 77 -4.303 14.828 -8.683 1.00 0.00 C ATOM 1207 CG GLU A 77 -4.738 13.580 -7.934 1.00 0.00 C ATOM 1208 CD GLU A 77 -5.587 12.708 -8.865 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -5.010 11.940 -9.616 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -6.800 12.825 -8.810 1.00 0.00 O ATOM 0 H GLU A 77 -2.030 14.554 -7.472 1.00 0.00 H new ATOM 0 HA GLU A 77 -3.906 16.868 -8.072 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.160 15.266 -9.195 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -3.575 14.561 -9.450 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -3.866 13.024 -7.590 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -5.311 13.854 -7.048 1.00 0.00 H new ATOM 1217 N ILE A 78 -3.752 14.842 -5.563 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.244 14.693 -4.157 1.00 0.00 C ATOM 1219 C ILE A 78 -3.086 14.703 -3.160 1.00 0.00 C ATOM 1220 O ILE A 78 -1.932 14.703 -3.531 1.00 0.00 O ATOM 1221 CB ILE A 78 -4.929 13.341 -4.103 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -3.947 12.283 -4.572 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.171 13.340 -4.991 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -3.550 11.433 -3.376 1.00 0.00 C ATOM 0 H ILE A 78 -3.023 14.186 -5.843 1.00 0.00 H new ATOM 0 HA ILE A 78 -4.909 15.516 -3.894 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.244 13.127 -3.081 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.399 11.662 -5.345 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.067 12.751 -5.013 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.652 12.363 -4.942 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -6.866 14.105 -4.645 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -5.882 13.551 -6.021 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -2.844 10.666 -3.693 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.084 12.064 -2.619 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.437 10.958 -2.957 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.405 14.686 -1.893 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.357 14.672 -0.837 1.00 0.00 C ATOM 1238 C LYS A 79 -2.908 13.960 0.403 1.00 0.00 C ATOM 1239 O LYS A 79 -4.071 14.090 0.731 1.00 0.00 O ATOM 1240 CB LYS A 79 -2.080 16.146 -0.534 1.00 0.00 C ATOM 1241 CG LYS A 79 -1.360 16.798 -1.722 1.00 0.00 C ATOM 1242 CD LYS A 79 -0.017 16.099 -2.001 1.00 0.00 C ATOM 1243 CE LYS A 79 0.591 15.555 -0.706 1.00 0.00 C ATOM 1244 NZ LYS A 79 1.725 14.699 -1.154 1.00 0.00 N ATOM 0 H LYS A 79 -4.363 14.681 -1.542 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.450 14.150 -1.143 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.016 16.667 -0.335 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -1.469 16.233 0.365 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -1.992 16.747 -2.608 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -1.189 17.854 -1.513 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -0.166 15.284 -2.709 1.00 0.00 H new ATOM 0 HD3 LYS A 79 0.674 16.802 -2.466 1.00 0.00 H new ATOM 0 HE2 LYS A 79 0.935 16.363 -0.060 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -0.139 14.980 -0.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 2.208 14.300 -0.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 1.363 13.926 -1.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 2.397 15.272 -1.703 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.096 13.208 1.099 1.00 0.00 N ATOM 1259 CA ILE A 80 -2.608 12.507 2.307 1.00 0.00 C ATOM 1260 C ILE A 80 -3.285 13.520 3.211 1.00 0.00 C ATOM 1261 O ILE A 80 -2.662 14.251 3.954 1.00 0.00 O ATOM 1262 CB ILE A 80 -1.395 11.887 2.981 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -1.058 10.568 2.287 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -1.692 11.616 4.456 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.975 10.779 0.775 1.00 0.00 C ATOM 0 H ILE A 80 -1.111 13.052 0.884 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.341 11.737 2.068 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.554 12.576 2.908 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.110 10.183 2.661 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.818 9.822 2.517 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.816 11.172 4.928 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.938 12.553 4.956 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.535 10.930 4.537 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.734 9.834 0.288 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -1.933 11.144 0.405 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -0.198 11.510 0.552 1.00 0.00 H new ATOM 1277 N THR A 81 -4.561 13.560 3.119 1.00 0.00 N ATOM 1278 CA THR A 81 -5.360 14.518 3.931 1.00 0.00 C ATOM 1279 C THR A 81 -5.867 13.847 5.205 1.00 0.00 C ATOM 1280 O THR A 81 -6.857 14.256 5.777 1.00 0.00 O ATOM 1281 CB THR A 81 -6.533 14.888 3.024 1.00 0.00 C ATOM 1282 OG1 THR A 81 -7.313 15.903 3.642 1.00 0.00 O ATOM 1283 CG2 THR A 81 -7.394 13.653 2.773 1.00 0.00 C ATOM 0 H THR A 81 -5.111 12.960 2.504 1.00 0.00 H new ATOM 0 HA THR A 81 -4.779 15.385 4.245 1.00 0.00 H new ATOM 0 HB THR A 81 -6.153 15.259 2.072 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.471 15.668 4.580 1.00 0.00 H new ATOM 0 HG21 THR A 81 -8.230 13.918 2.126 1.00 0.00 H new ATOM 0 HG22 THR A 81 -6.793 12.882 2.291 1.00 0.00 H new ATOM 0 HG23 THR A 81 -7.775 13.276 3.722 1.00 0.00 H new ATOM 1291 N SER A 82 -5.209 12.801 5.638 1.00 0.00 N ATOM 1292 CA SER A 82 -5.662 12.075 6.866 1.00 0.00 C ATOM 1293 C SER A 82 -6.923 11.266 6.555 1.00 0.00 C ATOM 1294 O SER A 82 -7.414 10.520 7.378 1.00 0.00 O ATOM 1295 CB SER A 82 -5.971 13.158 7.891 1.00 0.00 C ATOM 1296 OG SER A 82 -5.346 12.833 9.126 1.00 0.00 O ATOM 0 H SER A 82 -4.375 12.417 5.193 1.00 0.00 H new ATOM 0 HA SER A 82 -4.907 11.379 7.232 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.615 14.124 7.534 1.00 0.00 H new ATOM 0 HB3 SER A 82 -7.049 13.247 8.029 1.00 0.00 H new ATOM 0 HG SER A 82 -5.543 13.530 9.786 1.00 0.00 H new ATOM 1302 N ASP A 83 -7.440 11.403 5.366 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.654 10.640 4.980 1.00 0.00 C ATOM 1304 C ASP A 83 -8.289 9.707 3.834 1.00 0.00 C ATOM 1305 O ASP A 83 -8.558 8.524 3.872 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.666 11.690 4.521 1.00 0.00 C ATOM 1307 CG ASP A 83 -11.072 11.088 4.540 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -11.316 10.180 3.764 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -11.879 11.544 5.333 1.00 0.00 O ATOM 0 H ASP A 83 -7.069 12.017 4.641 1.00 0.00 H new ATOM 0 HA ASP A 83 -9.059 10.038 5.793 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.623 12.561 5.175 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.420 12.033 3.516 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.644 10.222 2.824 1.00 0.00 N ATOM 1315 CA LEU A 84 -7.237 9.344 1.699 1.00 0.00 C ATOM 1316 C LEU A 84 -6.252 8.313 2.228 1.00 0.00 C ATOM 1317 O LEU A 84 -6.130 7.226 1.707 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.568 10.268 0.682 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.569 11.328 0.220 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.982 12.103 -0.960 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.867 10.647 -0.214 1.00 0.00 C ATOM 0 H LEU A 84 -7.384 11.204 2.732 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.072 8.810 1.245 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.696 10.746 1.128 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.214 9.691 -0.172 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.775 12.016 1.040 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.695 12.859 -1.290 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.056 12.588 -0.652 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.776 11.416 -1.781 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.581 11.402 -0.543 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.661 9.960 -1.035 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.286 10.093 0.626 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.558 8.648 3.280 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.583 7.690 3.863 1.00 0.00 C ATOM 1335 C LEU A 85 -5.291 6.799 4.891 1.00 0.00 C ATOM 1336 O LEU A 85 -4.969 5.638 5.050 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.498 8.588 4.490 1.00 0.00 C ATOM 1338 CG LEU A 85 -3.589 8.606 6.020 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -2.751 7.466 6.600 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -3.054 9.943 6.537 1.00 0.00 C ATOM 0 H LEU A 85 -5.625 9.545 3.760 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.144 7.005 3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.513 8.232 4.189 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.601 9.604 4.108 1.00 0.00 H new ATOM 0 HG LEU A 85 -4.628 8.479 6.325 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.818 7.482 7.688 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.126 6.513 6.227 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.711 7.589 6.299 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -3.116 9.963 7.625 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -2.015 10.062 6.230 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -3.650 10.757 6.125 1.00 0.00 H new ATOM 1352 N ASP A 86 -6.265 7.333 5.577 1.00 0.00 N ATOM 1353 CA ASP A 86 -7.005 6.514 6.582 1.00 0.00 C ATOM 1354 C ASP A 86 -7.808 5.428 5.868 1.00 0.00 C ATOM 1355 O ASP A 86 -8.161 4.417 6.443 1.00 0.00 O ATOM 1356 CB ASP A 86 -7.942 7.495 7.288 1.00 0.00 C ATOM 1357 CG ASP A 86 -7.755 7.383 8.803 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -7.663 6.267 9.287 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -7.709 8.415 9.452 1.00 0.00 O ATOM 0 H ASP A 86 -6.580 8.299 5.486 1.00 0.00 H new ATOM 0 HA ASP A 86 -6.338 6.017 7.286 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -7.733 8.513 6.960 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.977 7.280 7.022 1.00 0.00 H new ATOM 1364 N LYS A 87 -8.078 5.619 4.608 1.00 0.00 N ATOM 1365 CA LYS A 87 -8.835 4.589 3.852 1.00 0.00 C ATOM 1366 C LYS A 87 -7.839 3.607 3.265 1.00 0.00 C ATOM 1367 O LYS A 87 -8.016 2.406 3.334 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.577 5.351 2.752 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.617 6.285 3.382 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.356 5.551 4.504 1.00 0.00 C ATOM 1371 CE LYS A 87 -12.687 6.250 4.788 1.00 0.00 C ATOM 1372 NZ LYS A 87 -13.491 5.249 5.539 1.00 0.00 N ATOM 0 H LYS A 87 -7.807 6.443 4.071 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.538 4.028 4.468 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.870 5.928 2.155 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -10.066 4.649 2.076 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -10.128 7.176 3.777 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.326 6.620 2.625 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.532 4.514 4.219 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.744 5.534 5.406 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.540 7.158 5.373 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.185 6.543 3.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -14.420 5.654 5.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.620 4.398 4.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -12.995 4.994 6.417 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.769 4.107 2.717 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.744 3.192 2.165 1.00 0.00 C ATOM 1388 C ILE A 88 -5.180 2.356 3.312 1.00 0.00 C ATOM 1389 O ILE A 88 -4.824 1.206 3.146 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.668 4.100 1.582 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -5.169 4.722 0.283 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -3.405 3.293 1.310 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.522 6.093 0.114 1.00 0.00 C ATOM 0 H ILE A 88 -6.564 5.102 2.629 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.135 2.512 1.408 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.441 4.891 2.296 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -4.921 4.081 -0.563 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -6.255 4.817 0.304 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.638 3.946 0.893 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -3.044 2.858 2.242 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -3.628 2.496 0.600 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.872 6.549 -0.812 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.792 6.729 0.957 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.438 5.982 0.076 1.00 0.00 H new ATOM 1405 N PHE A 89 -5.117 2.932 4.486 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.599 2.179 5.661 1.00 0.00 C ATOM 1407 C PHE A 89 -5.623 1.137 6.078 1.00 0.00 C ATOM 1408 O PHE A 89 -5.293 0.057 6.528 1.00 0.00 O ATOM 1409 CB PHE A 89 -4.406 3.220 6.763 1.00 0.00 C ATOM 1410 CG PHE A 89 -4.165 2.513 8.075 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -5.251 2.075 8.842 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -2.856 2.289 8.521 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -5.029 1.412 10.055 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -2.635 1.627 9.736 1.00 0.00 C ATOM 1415 CZ PHE A 89 -3.721 1.189 10.502 1.00 0.00 C ATOM 0 H PHE A 89 -5.403 3.892 4.678 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.666 1.657 5.446 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.562 3.868 6.525 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.287 3.858 6.836 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.260 2.248 8.498 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.018 2.626 7.929 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.867 1.073 10.646 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.626 1.455 10.081 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.550 0.679 11.438 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.865 1.447 5.891 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.934 0.474 6.228 1.00 0.00 C ATOM 1427 C ALA A 90 -7.836 -0.659 5.220 1.00 0.00 C ATOM 1428 O ALA A 90 -8.068 -1.811 5.524 1.00 0.00 O ATOM 1429 CB ALA A 90 -9.250 1.236 6.074 1.00 0.00 C ATOM 0 H ALA A 90 -7.192 2.338 5.517 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.857 0.060 7.233 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -10.083 0.574 6.309 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.260 2.087 6.755 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -9.347 1.591 5.048 1.00 0.00 H new ATOM 1435 N GLY A 91 -7.445 -0.327 4.020 1.00 0.00 N ATOM 1436 CA GLY A 91 -7.273 -1.366 2.981 1.00 0.00 C ATOM 1437 C GLY A 91 -6.082 -2.218 3.396 1.00 0.00 C ATOM 1438 O GLY A 91 -6.104 -3.430 3.315 1.00 0.00 O ATOM 0 H GLY A 91 -7.238 0.625 3.719 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -8.172 -1.976 2.894 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -7.100 -0.911 2.006 1.00 0.00 H new ATOM 1442 N VAL A 92 -5.050 -1.581 3.879 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.862 -2.335 4.351 1.00 0.00 C ATOM 1444 C VAL A 92 -4.277 -3.147 5.575 1.00 0.00 C ATOM 1445 O VAL A 92 -3.691 -4.160 5.901 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.837 -1.261 4.720 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.828 -1.821 5.727 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -2.094 -0.813 3.459 1.00 0.00 C ATOM 0 H VAL A 92 -4.982 -0.567 3.966 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.453 -3.025 3.613 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.356 -0.413 5.166 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.103 -1.049 5.983 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.352 -2.140 6.628 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -1.310 -2.674 5.287 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.363 -0.048 3.720 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.582 -1.667 3.015 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.807 -0.405 2.742 1.00 0.00 H new ATOM 1458 N ASP A 93 -5.312 -2.707 6.239 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.807 -3.446 7.429 1.00 0.00 C ATOM 1460 C ASP A 93 -6.445 -4.752 6.963 1.00 0.00 C ATOM 1461 O ASP A 93 -6.501 -5.725 7.687 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.852 -2.523 8.059 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.551 -2.350 9.548 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -5.434 -2.641 9.944 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -7.441 -1.929 10.268 1.00 0.00 O ATOM 0 H ASP A 93 -5.836 -1.864 6.005 1.00 0.00 H new ATOM 0 HA ASP A 93 -5.020 -3.697 8.141 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.844 -1.554 7.561 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.850 -2.941 7.925 1.00 0.00 H new ATOM 1470 N MET A 94 -6.908 -4.780 5.743 1.00 0.00 N ATOM 1471 CA MET A 94 -7.525 -6.021 5.208 1.00 0.00 C ATOM 1472 C MET A 94 -6.420 -6.998 4.817 1.00 0.00 C ATOM 1473 O MET A 94 -6.395 -8.127 5.260 1.00 0.00 O ATOM 1474 CB MET A 94 -8.314 -5.575 3.977 1.00 0.00 C ATOM 1475 CG MET A 94 -9.276 -4.454 4.370 1.00 0.00 C ATOM 1476 SD MET A 94 -9.992 -3.719 2.880 1.00 0.00 S ATOM 1477 CE MET A 94 -11.446 -2.990 3.669 1.00 0.00 C ATOM 0 H MET A 94 -6.884 -3.993 5.094 1.00 0.00 H new ATOM 0 HA MET A 94 -8.168 -6.523 5.931 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.632 -5.229 3.200 1.00 0.00 H new ATOM 0 HB3 MET A 94 -8.869 -6.417 3.562 1.00 0.00 H new ATOM 0 HG2 MET A 94 -10.066 -4.847 5.010 1.00 0.00 H new ATOM 0 HG3 MET A 94 -8.748 -3.693 4.946 1.00 0.00 H new ATOM 0 HE1 MET A 94 -12.317 -3.132 3.029 1.00 0.00 H new ATOM 0 HE2 MET A 94 -11.619 -3.474 4.630 1.00 0.00 H new ATOM 0 HE3 MET A 94 -11.280 -1.924 3.824 1.00 0.00 H new ATOM 1487 N ILE A 95 -5.494 -6.569 4.003 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.390 -7.463 3.609 1.00 0.00 C ATOM 1489 C ILE A 95 -3.690 -7.978 4.865 1.00 0.00 C ATOM 1490 O ILE A 95 -3.280 -9.120 4.939 1.00 0.00 O ATOM 1491 CB ILE A 95 -3.471 -6.576 2.783 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -2.980 -5.404 3.637 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -4.236 -6.037 1.575 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -1.960 -4.586 2.843 1.00 0.00 C ATOM 0 H ILE A 95 -5.462 -5.634 3.597 1.00 0.00 H new ATOM 0 HA ILE A 95 -4.712 -8.339 3.047 1.00 0.00 H new ATOM 0 HB ILE A 95 -2.615 -7.160 2.444 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.821 -4.774 3.927 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.528 -5.775 4.557 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.579 -5.401 0.982 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.584 -6.870 0.963 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -5.092 -5.455 1.917 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.610 -3.752 3.451 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.114 -5.220 2.576 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.428 -4.203 1.936 1.00 0.00 H new ATOM 1506 N THR A 96 -3.578 -7.149 5.867 1.00 0.00 N ATOM 1507 CA THR A 96 -2.938 -7.597 7.131 1.00 0.00 C ATOM 1508 C THR A 96 -3.829 -8.655 7.770 1.00 0.00 C ATOM 1509 O THR A 96 -3.365 -9.599 8.376 1.00 0.00 O ATOM 1510 CB THR A 96 -2.861 -6.346 8.009 1.00 0.00 C ATOM 1511 OG1 THR A 96 -2.080 -5.358 7.355 1.00 0.00 O ATOM 1512 CG2 THR A 96 -2.220 -6.699 9.353 1.00 0.00 C ATOM 0 H THR A 96 -3.903 -6.182 5.863 1.00 0.00 H new ATOM 0 HA THR A 96 -1.949 -8.032 6.985 1.00 0.00 H new ATOM 0 HB THR A 96 -3.866 -5.961 8.180 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.655 -4.612 7.085 1.00 0.00 H new ATOM 0 HG21 THR A 96 -2.166 -5.806 9.976 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.822 -7.457 9.855 1.00 0.00 H new ATOM 0 HG23 THR A 96 -1.215 -7.086 9.186 1.00 0.00 H new ATOM 1520 N ARG A 97 -5.119 -8.505 7.615 1.00 0.00 N ATOM 1521 CA ARG A 97 -6.060 -9.503 8.186 1.00 0.00 C ATOM 1522 C ARG A 97 -6.196 -10.683 7.224 1.00 0.00 C ATOM 1523 O ARG A 97 -6.340 -11.818 7.633 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.388 -8.760 8.333 1.00 0.00 C ATOM 1525 CG ARG A 97 -7.399 -7.995 9.658 1.00 0.00 C ATOM 1526 CD ARG A 97 -8.103 -6.650 9.472 1.00 0.00 C ATOM 1527 NE ARG A 97 -9.299 -6.719 10.356 1.00 0.00 N ATOM 1528 CZ ARG A 97 -9.314 -6.067 11.487 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -8.194 -5.804 12.104 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -10.448 -5.677 12.000 1.00 0.00 N ATOM 0 H ARG A 97 -5.558 -7.731 7.116 1.00 0.00 H new ATOM 0 HA ARG A 97 -5.722 -9.905 9.141 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.525 -8.070 7.501 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.218 -9.466 8.301 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.909 -8.581 10.423 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -6.378 -7.837 10.006 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -7.452 -5.821 9.751 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -8.389 -6.494 8.432 1.00 0.00 H new ATOM 0 HE ARG A 97 -10.107 -7.276 10.078 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -7.307 -6.108 11.702 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -8.206 -5.295 12.988 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -11.323 -5.881 11.518 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -10.460 -5.168 12.884 1.00 0.00 H new ATOM 1544 N MET A 98 -6.124 -10.427 5.946 1.00 0.00 N ATOM 1545 CA MET A 98 -6.218 -11.539 4.964 1.00 0.00 C ATOM 1546 C MET A 98 -4.922 -12.340 5.031 1.00 0.00 C ATOM 1547 O MET A 98 -4.913 -13.548 4.928 1.00 0.00 O ATOM 1548 CB MET A 98 -6.374 -10.865 3.598 1.00 0.00 C ATOM 1549 CG MET A 98 -7.646 -10.014 3.591 1.00 0.00 C ATOM 1550 SD MET A 98 -7.429 -8.613 2.466 1.00 0.00 S ATOM 1551 CE MET A 98 -8.801 -8.999 1.350 1.00 0.00 C ATOM 0 H MET A 98 -6.004 -9.498 5.542 1.00 0.00 H new ATOM 0 HA MET A 98 -7.049 -12.218 5.156 1.00 0.00 H new ATOM 0 HB2 MET A 98 -5.505 -10.241 3.387 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.424 -11.619 2.812 1.00 0.00 H new ATOM 0 HG2 MET A 98 -8.498 -10.617 3.278 1.00 0.00 H new ATOM 0 HG3 MET A 98 -7.862 -9.656 4.598 1.00 0.00 H new ATOM 0 HE1 MET A 98 -9.141 -8.086 0.861 1.00 0.00 H new ATOM 0 HE2 MET A 98 -8.467 -9.711 0.596 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.623 -9.433 1.920 1.00 0.00 H new ATOM 1561 N VAL A 99 -3.827 -11.659 5.232 1.00 0.00 N ATOM 1562 CA VAL A 99 -2.517 -12.351 5.336 1.00 0.00 C ATOM 1563 C VAL A 99 -2.457 -13.131 6.652 1.00 0.00 C ATOM 1564 O VAL A 99 -1.890 -14.203 6.723 1.00 0.00 O ATOM 1565 CB VAL A 99 -1.485 -11.222 5.322 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.152 -11.735 5.870 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.288 -10.734 3.885 1.00 0.00 C ATOM 0 H VAL A 99 -3.787 -10.644 5.329 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.344 -13.066 4.532 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.839 -10.400 5.944 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.581 -10.928 5.859 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.290 -12.086 6.893 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.204 -12.557 5.250 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.553 -9.929 3.872 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.935 -11.559 3.266 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.236 -10.366 3.492 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.052 -12.610 7.696 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.036 -13.341 8.993 1.00 0.00 C ATOM 1579 C ASP A 100 -3.940 -14.564 8.887 1.00 0.00 C ATOM 1580 O ASP A 100 -3.701 -15.584 9.502 1.00 0.00 O ATOM 1581 CB ASP A 100 -3.575 -12.349 10.026 1.00 0.00 C ATOM 1582 CG ASP A 100 -2.819 -12.521 11.346 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -1.631 -12.248 11.365 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -3.443 -12.923 12.314 1.00 0.00 O ATOM 0 H ASP A 100 -3.544 -11.716 7.704 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.042 -13.692 9.269 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -3.460 -11.329 9.660 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.641 -12.514 10.182 1.00 0.00 H new ATOM 1589 N LYS A 101 -4.960 -14.480 8.082 1.00 0.00 N ATOM 1590 CA LYS A 101 -5.857 -15.643 7.901 1.00 0.00 C ATOM 1591 C LYS A 101 -5.294 -16.489 6.763 1.00 0.00 C ATOM 1592 O LYS A 101 -5.324 -17.700 6.796 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.231 -15.032 7.585 1.00 0.00 C ATOM 1594 CG LYS A 101 -7.724 -15.421 6.189 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.396 -14.224 5.572 1.00 0.00 C ATOM 1596 CE LYS A 101 -9.737 -14.662 5.001 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.688 -14.580 6.145 1.00 0.00 N ATOM 0 H LYS A 101 -5.209 -13.651 7.542 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.942 -16.300 8.767 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -7.955 -15.362 8.330 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.171 -13.946 7.659 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -6.889 -15.748 5.570 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -8.421 -16.257 6.252 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -8.540 -13.444 6.319 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -7.770 -13.802 4.786 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -10.048 -14.014 4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.685 -15.675 4.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -11.597 -14.198 5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.836 -15.530 6.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.296 -13.955 6.878 1.00 0.00 H new ATOM 1611 N ILE A 102 -4.755 -15.841 5.762 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.159 -16.592 4.632 1.00 0.00 C ATOM 1613 C ILE A 102 -3.041 -17.441 5.211 1.00 0.00 C ATOM 1614 O ILE A 102 -2.756 -18.536 4.770 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.621 -15.520 3.677 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -4.733 -15.098 2.715 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.444 -16.073 2.873 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.182 -14.081 1.717 1.00 0.00 C ATOM 0 H ILE A 102 -4.705 -14.825 5.684 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.853 -17.247 4.105 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.284 -14.662 4.258 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.122 -15.969 2.187 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.565 -14.665 3.271 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -2.070 -15.303 2.198 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.649 -16.376 3.554 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -2.773 -16.935 2.293 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.973 -13.779 1.031 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -3.814 -13.207 2.254 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.365 -14.531 1.153 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.434 -16.934 6.240 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.355 -17.690 6.919 1.00 0.00 C ATOM 1632 C VAL A 103 -2.015 -18.719 7.835 1.00 0.00 C ATOM 1633 O VAL A 103 -1.495 -19.790 8.079 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.589 -16.639 7.725 1.00 0.00 C ATOM 1635 CG1 VAL A 103 0.120 -17.300 8.911 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.452 -15.969 6.826 1.00 0.00 C ATOM 0 H VAL A 103 -2.641 -16.020 6.643 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.686 -18.221 6.241 1.00 0.00 H new ATOM 0 HB VAL A 103 -1.292 -15.894 8.097 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.662 -16.544 9.478 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.618 -17.778 9.556 1.00 0.00 H new ATOM 0 HG13 VAL A 103 0.821 -18.050 8.544 1.00 0.00 H new ATOM 0 HG21 VAL A 103 0.999 -15.220 7.398 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.148 -16.720 6.453 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.048 -15.489 5.985 1.00 0.00 H new ATOM 1646 N SER A 104 -3.170 -18.382 8.338 1.00 0.00 N ATOM 1647 CA SER A 104 -3.906 -19.309 9.241 1.00 0.00 C ATOM 1648 C SER A 104 -4.707 -20.326 8.435 1.00 0.00 C ATOM 1649 O SER A 104 -5.125 -21.350 8.938 1.00 0.00 O ATOM 1650 CB SER A 104 -4.850 -18.406 10.027 1.00 0.00 C ATOM 1651 OG SER A 104 -5.430 -19.142 11.096 1.00 0.00 O ATOM 0 H SER A 104 -3.640 -17.494 8.160 1.00 0.00 H new ATOM 0 HA SER A 104 -3.232 -19.877 9.883 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.306 -17.545 10.417 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.631 -18.020 9.372 1.00 0.00 H new ATOM 0 HG SER A 104 -6.036 -18.561 11.602 1.00 0.00 H new ATOM 1657 N GLU A 105 -4.925 -20.043 7.191 1.00 0.00 N ATOM 1658 CA GLU A 105 -5.707 -20.977 6.329 1.00 0.00 C ATOM 1659 C GLU A 105 -5.296 -20.817 4.864 1.00 0.00 C ATOM 1660 O GLU A 105 -5.252 -21.773 4.116 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.181 -20.575 6.497 1.00 0.00 C ATOM 1662 CG GLU A 105 -7.454 -20.103 7.929 1.00 0.00 C ATOM 1663 CD GLU A 105 -8.951 -19.838 8.101 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -9.712 -20.275 7.253 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -9.311 -19.202 9.077 1.00 0.00 O ATOM 0 H GLU A 105 -4.595 -19.199 6.723 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.533 -22.015 6.612 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.429 -19.780 5.793 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.824 -21.423 6.259 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.123 -20.858 8.642 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.887 -19.196 8.139 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.005 -19.616 4.446 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.610 -19.403 3.023 1.00 0.00 C ATOM 1674 C GLY A 106 -5.762 -18.735 2.271 1.00 0.00 C ATOM 1675 O GLY A 106 -5.849 -18.801 1.061 1.00 0.00 O ATOM 0 H GLY A 106 -5.023 -18.776 5.024 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -3.717 -18.780 2.971 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.361 -20.356 2.557 1.00 0.00 H new ATOM 1679 N SER A 107 -6.645 -18.083 2.979 1.00 0.00 N ATOM 1680 CA SER A 107 -7.788 -17.404 2.304 1.00 0.00 C ATOM 1681 C SER A 107 -7.652 -15.900 2.444 1.00 0.00 C ATOM 1682 O SER A 107 -7.470 -15.388 3.521 1.00 0.00 O ATOM 1683 CB SER A 107 -9.035 -17.892 3.033 1.00 0.00 C ATOM 1684 OG SER A 107 -8.909 -19.282 3.302 1.00 0.00 O ATOM 0 H SER A 107 -6.624 -17.991 3.995 1.00 0.00 H new ATOM 0 HA SER A 107 -7.828 -17.629 1.238 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.165 -17.340 3.964 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.921 -17.706 2.426 1.00 0.00 H new ATOM 0 HG SER A 107 -9.709 -19.598 3.772 1.00 0.00 H new ATOM 1690 N ASP A 108 -7.757 -15.193 1.362 1.00 0.00 N ATOM 1691 CA ASP A 108 -7.661 -13.712 1.427 1.00 0.00 C ATOM 1692 C ASP A 108 -9.075 -13.140 1.440 1.00 0.00 C ATOM 1693 O ASP A 108 -9.290 -11.966 1.215 1.00 0.00 O ATOM 1694 CB ASP A 108 -6.918 -13.301 0.154 1.00 0.00 C ATOM 1695 CG ASP A 108 -7.799 -13.583 -1.064 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -8.714 -14.381 -0.938 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -7.543 -12.998 -2.104 1.00 0.00 O ATOM 0 H ASP A 108 -7.906 -15.577 0.429 1.00 0.00 H new ATOM 0 HA ASP A 108 -7.143 -13.350 2.315 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.663 -12.242 0.195 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.981 -13.851 0.073 1.00 0.00 H new ATOM 1702 N ASP A 109 -10.046 -13.978 1.694 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.461 -13.495 1.711 1.00 0.00 C ATOM 1704 C ASP A 109 -11.915 -13.195 3.144 1.00 0.00 C ATOM 1705 O ASP A 109 -12.445 -14.049 3.827 1.00 0.00 O ATOM 1706 CB ASP A 109 -12.276 -14.648 1.125 1.00 0.00 C ATOM 1707 CG ASP A 109 -12.179 -14.620 -0.401 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -12.553 -13.614 -0.980 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -11.733 -15.606 -0.964 1.00 0.00 O ATOM 0 H ASP A 109 -9.923 -14.971 1.890 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.584 -12.572 1.145 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -11.905 -15.600 1.506 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -13.318 -14.565 1.435 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.718 -11.988 3.606 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.148 -11.648 4.994 1.00 0.00 C ATOM 1716 C ILE A 110 -13.485 -10.901 4.963 1.00 0.00 C ATOM 1717 O ILE A 110 -13.848 -10.219 5.902 1.00 0.00 O ATOM 1718 CB ILE A 110 -11.039 -10.757 5.564 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -10.736 -9.618 4.588 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -9.772 -11.588 5.784 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -9.896 -8.553 5.296 1.00 0.00 C ATOM 0 H ILE A 110 -11.281 -11.227 3.086 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.295 -12.538 5.606 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.370 -10.340 6.515 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.201 -10.001 3.719 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.665 -9.181 4.222 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -8.985 -10.952 6.189 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.983 -12.395 6.486 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.444 -12.010 4.834 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.679 -7.741 4.603 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.448 -8.163 6.151 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -8.961 -8.996 5.640 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.223 -11.033 3.894 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.540 -10.342 3.803 1.00 0.00 C ATOM 1735 C GLY A 111 -15.334 -8.886 3.383 1.00 0.00 C ATOM 1736 O GLY A 111 -16.282 -8.153 3.173 1.00 0.00 O ATOM 0 H GLY A 111 -13.970 -11.591 3.079 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.179 -10.851 3.081 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -16.050 -10.384 4.765 1.00 0.00 H new ATOM 1740 N GLU A 112 -14.108 -8.457 3.257 1.00 0.00 N ATOM 1741 CA GLU A 112 -13.860 -7.043 2.850 1.00 0.00 C ATOM 1742 C GLU A 112 -14.151 -6.858 1.359 1.00 0.00 C ATOM 1743 O GLU A 112 -14.236 -7.809 0.607 1.00 0.00 O ATOM 1744 CB GLU A 112 -12.380 -6.795 3.147 1.00 0.00 C ATOM 1745 CG GLU A 112 -12.176 -6.696 4.659 1.00 0.00 C ATOM 1746 CD GLU A 112 -13.174 -5.698 5.248 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -13.490 -4.736 4.567 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -13.608 -5.915 6.366 1.00 0.00 O ATOM 0 H GLU A 112 -13.272 -9.019 3.417 1.00 0.00 H new ATOM 0 HA GLU A 112 -14.503 -6.344 3.384 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.775 -7.605 2.739 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -12.050 -5.876 2.663 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -12.311 -7.675 5.119 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -11.157 -6.379 4.878 1.00 0.00 H new ATOM 1755 N ASN A 113 -14.311 -5.635 0.930 1.00 0.00 N ATOM 1756 CA ASN A 113 -14.603 -5.372 -0.509 1.00 0.00 C ATOM 1757 C ASN A 113 -13.437 -4.633 -1.160 1.00 0.00 C ATOM 1758 O ASN A 113 -12.753 -3.860 -0.523 1.00 0.00 O ATOM 1759 CB ASN A 113 -15.854 -4.495 -0.494 1.00 0.00 C ATOM 1760 CG ASN A 113 -16.897 -5.074 -1.450 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -16.590 -5.927 -2.260 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -18.127 -4.642 -1.394 1.00 0.00 N ATOM 0 H ASN A 113 -14.252 -4.803 1.517 1.00 0.00 H new ATOM 0 HA ASN A 113 -14.750 -6.289 -1.079 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -16.261 -4.442 0.516 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -15.600 -3.477 -0.789 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.830 -5.020 -2.029 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -18.386 -3.926 -0.715 1.00 0.00 H new ATOM 1769 N ILE A 114 -13.202 -4.859 -2.425 1.00 0.00 N ATOM 1770 CA ILE A 114 -12.079 -4.154 -3.102 1.00 0.00 C ATOM 1771 C ILE A 114 -12.624 -3.190 -4.152 1.00 0.00 C ATOM 1772 O ILE A 114 -12.643 -1.993 -3.949 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.240 -5.246 -3.762 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.944 -6.358 -2.749 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -9.931 -4.633 -4.254 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -10.456 -5.746 -1.435 1.00 0.00 C ATOM 0 H ILE A 114 -13.736 -5.497 -3.014 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.486 -3.567 -2.400 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.787 -5.673 -4.603 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -11.842 -6.951 -2.573 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -10.188 -7.035 -3.148 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.323 -5.404 -4.727 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -10.147 -3.846 -4.977 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.387 -4.210 -3.409 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.247 -6.541 -0.719 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -9.547 -5.173 -1.616 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.226 -5.088 -1.032 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.092 -3.693 -5.264 1.00 0.00 N ATOM 1789 CA ASP A 115 -13.654 -2.777 -6.293 1.00 0.00 C ATOM 1790 C ASP A 115 -14.596 -1.802 -5.605 1.00 0.00 C ATOM 1791 O ASP A 115 -14.835 -0.702 -6.062 1.00 0.00 O ATOM 1792 CB ASP A 115 -14.413 -3.675 -7.272 1.00 0.00 C ATOM 1793 CG ASP A 115 -14.352 -3.069 -8.676 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -13.853 -1.963 -8.801 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -14.805 -3.722 -9.601 1.00 0.00 O ATOM 0 H ASP A 115 -13.109 -4.685 -5.500 1.00 0.00 H new ATOM 0 HA ASP A 115 -12.892 -2.197 -6.814 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -13.978 -4.674 -7.277 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -15.451 -3.781 -6.955 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.117 -2.216 -4.493 1.00 0.00 N ATOM 1801 CA VAL A 116 -16.042 -1.353 -3.716 1.00 0.00 C ATOM 1802 C VAL A 116 -15.260 -0.491 -2.739 1.00 0.00 C ATOM 1803 O VAL A 116 -15.378 0.719 -2.722 1.00 0.00 O ATOM 1804 CB VAL A 116 -16.938 -2.334 -2.963 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -17.766 -1.577 -1.923 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -17.876 -3.032 -3.951 1.00 0.00 C ATOM 0 H VAL A 116 -14.939 -3.132 -4.080 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.612 -0.674 -4.350 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.318 -3.078 -2.462 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.405 -2.278 -1.386 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -17.099 -1.081 -1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -18.385 -0.832 -2.423 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.515 -3.732 -3.413 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.494 -2.288 -4.453 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.287 -3.574 -4.691 1.00 0.00 H new ATOM 1816 N PHE A 117 -14.458 -1.105 -1.930 1.00 0.00 N ATOM 1817 CA PHE A 117 -13.658 -0.318 -0.949 1.00 0.00 C ATOM 1818 C PHE A 117 -12.637 0.537 -1.699 1.00 0.00 C ATOM 1819 O PHE A 117 -12.134 1.519 -1.187 1.00 0.00 O ATOM 1820 CB PHE A 117 -12.967 -1.349 -0.063 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.531 -0.697 1.228 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -13.401 -0.670 2.324 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -11.259 -0.121 1.330 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -13.000 -0.066 3.522 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -10.858 0.482 2.528 1.00 0.00 C ATOM 1826 CZ PHE A 117 -11.728 0.510 3.624 1.00 0.00 C ATOM 0 H PHE A 117 -14.317 -2.115 -1.900 1.00 0.00 H new ATOM 0 HA PHE A 117 -14.271 0.358 -0.353 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -13.645 -2.176 0.147 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -12.104 -1.768 -0.580 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -14.382 -1.115 2.246 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -10.587 -0.142 0.485 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -13.672 -0.044 4.367 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -9.877 0.926 2.607 1.00 0.00 H new ATOM 0 HZ PHE A 117 -11.418 0.976 4.548 1.00 0.00 H new ATOM 1836 N SER A 118 -12.359 0.193 -2.927 1.00 0.00 N ATOM 1837 CA SER A 118 -11.412 0.998 -3.721 1.00 0.00 C ATOM 1838 C SER A 118 -12.216 2.051 -4.440 1.00 0.00 C ATOM 1839 O SER A 118 -11.801 3.176 -4.594 1.00 0.00 O ATOM 1840 CB SER A 118 -10.769 0.027 -4.710 1.00 0.00 C ATOM 1841 OG SER A 118 -10.179 0.763 -5.775 1.00 0.00 O ATOM 0 H SER A 118 -12.753 -0.615 -3.409 1.00 0.00 H new ATOM 0 HA SER A 118 -10.644 1.490 -3.124 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.013 -0.576 -4.206 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.518 -0.662 -5.100 1.00 0.00 H new ATOM 0 HG SER A 118 -9.230 0.530 -5.847 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.395 1.682 -4.837 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.297 2.648 -5.522 1.00 0.00 C ATOM 1849 C ASP A 119 -14.716 3.698 -4.511 1.00 0.00 C ATOM 1850 O ASP A 119 -14.893 4.859 -4.817 1.00 0.00 O ATOM 1851 CB ASP A 119 -15.497 1.823 -5.994 1.00 0.00 C ATOM 1852 CG ASP A 119 -16.692 2.746 -6.245 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -16.786 3.278 -7.339 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -17.494 2.904 -5.339 1.00 0.00 O ATOM 0 H ASP A 119 -13.779 0.745 -4.717 1.00 0.00 H new ATOM 0 HA ASP A 119 -13.830 3.158 -6.364 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.243 1.284 -6.907 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.754 1.075 -5.244 1.00 0.00 H new ATOM 1859 N THR A 120 -14.837 3.280 -3.295 1.00 0.00 N ATOM 1860 CA THR A 120 -15.203 4.218 -2.207 1.00 0.00 C ATOM 1861 C THR A 120 -14.075 5.227 -2.071 1.00 0.00 C ATOM 1862 O THR A 120 -14.278 6.419 -1.957 1.00 0.00 O ATOM 1863 CB THR A 120 -15.327 3.324 -0.964 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.687 2.953 -0.786 1.00 0.00 O ATOM 1865 CG2 THR A 120 -14.832 4.056 0.284 1.00 0.00 C ATOM 0 H THR A 120 -14.696 2.314 -3.000 1.00 0.00 H new ATOM 0 HA THR A 120 -16.124 4.776 -2.374 1.00 0.00 H new ATOM 0 HB THR A 120 -14.713 2.436 -1.111 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.769 2.381 0.005 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.930 3.403 1.151 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.786 4.332 0.153 1.00 0.00 H new ATOM 0 HG23 THR A 120 -15.428 4.956 0.438 1.00 0.00 H new ATOM 1873 N ILE A 121 -12.888 4.727 -2.110 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.690 5.593 -2.015 1.00 0.00 C ATOM 1875 C ILE A 121 -11.474 6.297 -3.361 1.00 0.00 C ATOM 1876 O ILE A 121 -11.182 7.474 -3.420 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.562 4.606 -1.672 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -10.049 4.906 -0.267 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.406 4.703 -2.673 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -9.394 6.288 -0.245 1.00 0.00 C ATOM 0 H ILE A 121 -12.687 3.732 -2.206 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.758 6.387 -1.272 1.00 0.00 H new ATOM 0 HB ILE A 121 -10.963 3.594 -1.722 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -10.872 4.871 0.447 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -9.329 4.146 0.038 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.627 3.991 -2.399 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -9.771 4.474 -3.674 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.996 5.713 -2.659 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -9.028 6.501 0.759 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -8.560 6.307 -0.947 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -10.127 7.042 -0.532 1.00 0.00 H new ATOM 1892 N LYS A 122 -11.637 5.580 -4.440 1.00 0.00 N ATOM 1893 CA LYS A 122 -11.467 6.193 -5.778 1.00 0.00 C ATOM 1894 C LYS A 122 -12.530 7.263 -5.964 1.00 0.00 C ATOM 1895 O LYS A 122 -12.301 8.293 -6.567 1.00 0.00 O ATOM 1896 CB LYS A 122 -11.679 5.042 -6.761 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.323 4.615 -7.311 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.043 3.162 -6.931 1.00 0.00 C ATOM 1899 CE LYS A 122 -8.829 3.111 -6.002 1.00 0.00 C ATOM 1900 NZ LYS A 122 -7.748 2.497 -6.820 1.00 0.00 N ATOM 0 H LYS A 122 -11.882 4.590 -4.447 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.495 6.665 -5.918 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.166 4.204 -6.262 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.335 5.354 -7.573 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.309 4.726 -8.395 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.540 5.261 -6.915 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.913 2.729 -6.437 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -9.856 2.569 -7.826 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.549 4.108 -5.662 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.037 2.517 -5.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.832 2.640 -6.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -7.928 1.478 -6.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.728 2.943 -7.759 1.00 0.00 H new ATOM 1914 N SER A 123 -13.688 7.026 -5.427 1.00 0.00 N ATOM 1915 CA SER A 123 -14.776 8.028 -5.540 1.00 0.00 C ATOM 1916 C SER A 123 -14.598 9.084 -4.459 1.00 0.00 C ATOM 1917 O SER A 123 -15.230 10.121 -4.470 1.00 0.00 O ATOM 1918 CB SER A 123 -16.056 7.246 -5.313 1.00 0.00 C ATOM 1919 OG SER A 123 -17.162 7.989 -5.808 1.00 0.00 O ATOM 0 H SER A 123 -13.929 6.179 -4.913 1.00 0.00 H new ATOM 0 HA SER A 123 -14.783 8.539 -6.503 1.00 0.00 H new ATOM 0 HB2 SER A 123 -15.999 6.281 -5.816 1.00 0.00 H new ATOM 0 HB3 SER A 123 -16.187 7.044 -4.250 1.00 0.00 H new ATOM 0 HG SER A 123 -17.988 7.482 -5.662 1.00 0.00 H new ATOM 1925 N PHE A 124 -13.717 8.828 -3.537 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.463 9.818 -2.458 1.00 0.00 C ATOM 1927 C PHE A 124 -12.673 10.990 -3.030 1.00 0.00 C ATOM 1928 O PHE A 124 -12.388 11.960 -2.354 1.00 0.00 O ATOM 1929 CB PHE A 124 -12.636 9.069 -1.416 1.00 0.00 C ATOM 1930 CG PHE A 124 -13.163 9.379 -0.037 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -12.670 10.482 0.670 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -14.146 8.563 0.536 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -13.159 10.770 1.949 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -14.636 8.851 1.816 1.00 0.00 C ATOM 1935 CZ PHE A 124 -14.143 9.955 2.522 1.00 0.00 C ATOM 0 H PHE A 124 -13.161 7.975 -3.484 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.380 10.218 -2.026 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -12.683 7.996 -1.602 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.588 9.360 -1.490 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -11.912 11.111 0.228 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -14.526 7.712 -0.009 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -12.778 11.621 2.494 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -15.394 8.222 2.258 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.522 10.178 3.509 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.319 10.901 -4.279 1.00 0.00 N ATOM 1946 CA ALA A 125 -11.545 11.999 -4.922 1.00 0.00 C ATOM 1947 C ALA A 125 -11.537 11.821 -6.443 1.00 0.00 C ATOM 1948 O ALA A 125 -10.496 11.792 -7.069 1.00 0.00 O ATOM 1949 CB ALA A 125 -10.130 11.868 -4.358 1.00 0.00 C ATOM 0 H ALA A 125 -12.533 10.111 -4.887 1.00 0.00 H new ATOM 0 HA ALA A 125 -11.975 12.980 -4.721 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.495 12.645 -4.784 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -10.159 11.978 -3.274 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -9.726 10.888 -4.613 1.00 0.00 H new ATOM 1955 N SER A 126 -12.690 11.700 -7.044 1.00 0.00 N ATOM 1956 CA SER A 126 -12.745 11.523 -8.525 1.00 0.00 C ATOM 1957 C SER A 126 -14.189 11.290 -8.978 1.00 0.00 C ATOM 1958 O SER A 126 -15.076 11.077 -8.177 1.00 0.00 O ATOM 1959 CB SER A 126 -11.882 10.292 -8.812 1.00 0.00 C ATOM 1960 OG SER A 126 -12.715 9.207 -9.201 1.00 0.00 O ATOM 0 H SER A 126 -13.596 11.716 -6.575 1.00 0.00 H new ATOM 0 HA SER A 126 -12.386 12.403 -9.059 1.00 0.00 H new ATOM 0 HB2 SER A 126 -11.164 10.514 -9.602 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.307 10.023 -7.926 1.00 0.00 H new ATOM 0 HG SER A 126 -12.808 8.581 -8.453 1.00 0.00 H new ATOM 1966 N SER A 127 -14.433 11.332 -10.261 1.00 0.00 N ATOM 1967 CA SER A 127 -15.820 11.116 -10.766 1.00 0.00 C ATOM 1968 C SER A 127 -16.426 9.864 -10.128 1.00 0.00 C ATOM 1969 O SER A 127 -17.249 9.945 -9.237 1.00 0.00 O ATOM 1970 CB SER A 127 -15.670 10.925 -12.274 1.00 0.00 C ATOM 1971 OG SER A 127 -14.340 10.513 -12.564 1.00 0.00 O ATOM 0 H SER A 127 -13.732 11.507 -10.981 1.00 0.00 H new ATOM 0 HA SER A 127 -16.480 11.949 -10.524 1.00 0.00 H new ATOM 0 HB2 SER A 127 -16.380 10.179 -12.630 1.00 0.00 H new ATOM 0 HB3 SER A 127 -15.897 11.855 -12.795 1.00 0.00 H new ATOM 0 HG SER A 127 -14.240 10.388 -13.531 1.00 0.00 H new ATOM 1977 N GLY A 128 -16.027 8.706 -10.577 1.00 0.00 N ATOM 1978 CA GLY A 128 -16.579 7.450 -9.997 1.00 0.00 C ATOM 1979 C GLY A 128 -18.021 7.259 -10.469 1.00 0.00 C ATOM 1980 O GLY A 128 -18.959 7.425 -9.714 1.00 0.00 O ATOM 0 H GLY A 128 -15.342 8.575 -11.321 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -15.970 6.599 -10.301 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -16.545 7.494 -8.908 1.00 0.00 H new ATOM 1984 N LYS A 129 -18.208 6.911 -11.712 1.00 0.00 N ATOM 1985 CA LYS A 129 -19.590 6.708 -12.231 1.00 0.00 C ATOM 1986 C LYS A 129 -19.547 6.303 -13.706 1.00 0.00 C ATOM 1987 O LYS A 129 -20.423 6.639 -14.479 1.00 0.00 O ATOM 1988 CB LYS A 129 -20.278 8.063 -12.065 1.00 0.00 C ATOM 1989 CG LYS A 129 -21.767 7.850 -11.787 1.00 0.00 C ATOM 1990 CD LYS A 129 -21.990 7.689 -10.283 1.00 0.00 C ATOM 1991 CE LYS A 129 -22.166 9.067 -9.640 1.00 0.00 C ATOM 1992 NZ LYS A 129 -23.634 9.322 -9.663 1.00 0.00 N ATOM 0 H LYS A 129 -17.463 6.758 -12.392 1.00 0.00 H new ATOM 0 HA LYS A 129 -20.118 5.916 -11.701 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -19.820 8.617 -11.246 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -20.148 8.662 -12.967 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -22.342 8.697 -12.162 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -22.123 6.965 -12.314 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -22.872 7.075 -10.099 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -21.143 7.172 -9.833 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -21.780 9.079 -8.621 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -21.624 9.833 -10.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -23.832 10.250 -9.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -23.973 9.312 -10.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -24.124 8.582 -9.121 1.00 0.00 H new ATOM 2006 N GLU A 130 -18.534 5.582 -14.103 1.00 0.00 N ATOM 2007 CA GLU A 130 -18.432 5.154 -15.528 1.00 0.00 C ATOM 2008 C GLU A 130 -18.653 3.643 -15.640 1.00 0.00 C ATOM 2009 O GLU A 130 -18.391 2.897 -14.717 1.00 0.00 O ATOM 2010 CB GLU A 130 -17.010 5.523 -15.952 1.00 0.00 C ATOM 2011 CG GLU A 130 -17.064 6.444 -17.173 1.00 0.00 C ATOM 2012 CD GLU A 130 -16.598 7.847 -16.778 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -15.405 8.095 -16.849 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -17.441 8.649 -16.410 1.00 0.00 O ATOM 0 H GLU A 130 -17.771 5.270 -13.502 1.00 0.00 H new ATOM 0 HA GLU A 130 -19.181 5.633 -16.159 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -16.492 6.019 -15.132 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -16.444 4.622 -16.188 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -16.430 6.049 -17.967 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -18.080 6.484 -17.566 1.00 0.00 H new ATOM 2021 N LYS A 131 -19.133 3.186 -16.764 1.00 0.00 N ATOM 2022 CA LYS A 131 -19.369 1.723 -16.932 1.00 0.00 C ATOM 2023 C LYS A 131 -18.147 1.059 -17.572 1.00 0.00 C ATOM 2024 O LYS A 131 -17.513 1.616 -18.446 1.00 0.00 O ATOM 2025 CB LYS A 131 -20.581 1.622 -17.859 1.00 0.00 C ATOM 2026 CG LYS A 131 -21.855 1.492 -17.022 1.00 0.00 C ATOM 2027 CD LYS A 131 -22.221 0.015 -16.874 1.00 0.00 C ATOM 2028 CE LYS A 131 -23.037 -0.183 -15.593 1.00 0.00 C ATOM 2029 NZ LYS A 131 -22.394 -1.334 -14.901 1.00 0.00 N ATOM 0 H LYS A 131 -19.372 3.761 -17.572 1.00 0.00 H new ATOM 0 HA LYS A 131 -19.540 1.220 -15.980 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -20.640 2.505 -18.495 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -20.477 0.760 -18.518 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -21.705 1.940 -16.040 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -22.672 2.034 -17.498 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -22.796 -0.317 -17.739 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -21.317 -0.593 -16.840 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -23.019 0.712 -14.971 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -24.082 -0.392 -15.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -22.898 -1.531 -14.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -22.432 -2.173 -15.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -21.402 -1.103 -14.692 1.00 0.00 H new ATOM 2043 N LEU A 132 -17.811 -0.125 -17.141 1.00 0.00 N ATOM 2044 CA LEU A 132 -16.629 -0.824 -17.724 1.00 0.00 C ATOM 2045 C LEU A 132 -16.418 -2.170 -17.026 1.00 0.00 C ATOM 2046 O LEU A 132 -16.938 -2.411 -15.955 1.00 0.00 O ATOM 2047 CB LEU A 132 -15.449 0.112 -17.457 1.00 0.00 C ATOM 2048 CG LEU A 132 -14.863 0.588 -18.786 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -13.695 1.539 -18.520 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -14.365 -0.618 -19.584 1.00 0.00 C ATOM 0 H LEU A 132 -18.303 -0.640 -16.411 1.00 0.00 H new ATOM 0 HA LEU A 132 -16.751 -1.033 -18.787 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -15.776 0.967 -16.865 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -14.686 -0.405 -16.875 1.00 0.00 H new ATOM 0 HG LEU A 132 -15.633 1.109 -19.355 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -13.278 1.878 -19.469 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -14.048 2.399 -17.951 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -12.925 1.019 -17.950 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -13.947 -0.279 -20.532 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -13.596 -1.139 -19.014 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -15.197 -1.296 -19.776 1.00 0.00 H new ATOM 2062 N GLU A 133 -15.661 -3.050 -17.624 1.00 0.00 N ATOM 2063 CA GLU A 133 -15.425 -4.378 -16.987 1.00 0.00 C ATOM 2064 C GLU A 133 -16.751 -5.124 -16.819 1.00 0.00 C ATOM 2065 O GLU A 133 -17.170 -5.299 -15.686 1.00 0.00 O ATOM 2066 CB GLU A 133 -14.814 -4.056 -15.622 1.00 0.00 C ATOM 2067 CG GLU A 133 -13.338 -4.457 -15.613 1.00 0.00 C ATOM 2068 CD GLU A 133 -12.556 -3.494 -14.716 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -13.076 -2.428 -14.430 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -11.452 -3.840 -14.330 1.00 0.00 O ATOM 0 H GLU A 133 -15.198 -2.908 -18.522 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.775 -5.016 -17.585 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -14.913 -2.991 -15.410 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -15.351 -4.589 -14.837 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.229 -5.479 -15.250 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -12.937 -4.434 -16.626 1.00 0.00 H new TER 2077 GLU A 133