USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=34 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 130:sc= -1.84! USER MOD Set 1.2: A 118 SER OG : rot 173:sc= 0.485 USER MOD Set 1.3: A 122 LYS NZ :NH3+ -172:sc= -0.721! (180deg=-1.92!) USER MOD Set 2.1: A 68 ASN : amide:sc= -0.0318 X(o=-0.35,f=0.04) USER MOD Set 2.2: A 72 LYS NZ :NH3+ -125:sc= -0.316 (180deg=-1.97!) USER MOD Set 3.1: A 13 THR OG1 : rot 100:sc= -3.72! USER MOD Set 3.2: A 50 MET CE :methyl -167:sc= -0.184 (180deg=-1.1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) 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+ 150:sc= -0.658 (180deg=-3.24!) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -2.62! C(o=-2.6!,f=-4!) USER MOD Single : A 21 ASN : amide:sc= -0.328 K(o=-0.33,f=-3!) USER MOD Single : A 23 THR OG1 : rot 75:sc= 1.15 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 34 MET CE :methyl -175:sc= -0.917 (180deg=-0.992) USER MOD Single : A 38 ASN : amide:sc= -1.38 K(o=-1.4,f=-2.8!) USER MOD Single : A 45 HIS : no HD1:sc= -1.67 X(o=-1.7,f=-2!) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 170:sc= 1.09 (180deg=1.05) USER MOD Single : A 53 THR OG1 : rot 73:sc= 0.288 USER MOD Single : A 54 MET CE :methyl -137:sc= -3.66! (180deg=-5.65!) USER MOD Single : A 57 SER OG : rot 180:sc= -0.0257 USER MOD Single : A 58 SER OG : rot 180:sc= 0.108 USER MOD Single : A 59 MET CE :methyl 148:sc= -9.8! (180deg=-10.8!) USER MOD Single : A 61 LYS NZ :NH3+ -129:sc=-0.00688 (180deg=-0.258) USER MOD Single : A 63 CYS SG : rot 180:sc= -0.165 USER MOD Single : A 64 HIS : no HD1:sc= -0.206 X(o=-0.21,f=-0.013) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0.31) USER MOD Single : A 76 SER OG : rot -58:sc= 0.877 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.0176 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 167:sc= -1.21 (180deg=-1.53) USER MOD Single : A 96 THR OG1 : rot 89:sc= -0.666! USER MOD Single : A 98 MET CE :methyl -162:sc= -3.05! (180deg=-3.36!) USER MOD Single : A 101 LYS NZ :NH3+ -109:sc= -3.11! (180deg=-4.99!) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 127:sc= 0.0429 USER MOD Single : A 113 ASN : amide:sc= -4.24 K(o=-4.2,f=-6.5!) USER MOD Single : A 120 THR OG1 : rot 89:sc= 0.134 USER MOD Single : A 123 SER OG : rot 96:sc= 0.0793 USER MOD Single : A 126 SER OG : rot -87:sc= 0.766 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ -133:sc= -0.242 (180deg=-0.911) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.630 -24.291 -3.921 1.00 0.00 N ATOM 2 CA MET A 1 1.599 -23.357 -2.759 1.00 0.00 C ATOM 3 C MET A 1 1.754 -24.137 -1.451 1.00 0.00 C ATOM 4 O MET A 1 0.843 -24.211 -0.651 1.00 0.00 O ATOM 5 CB MET A 1 0.228 -22.685 -2.823 1.00 0.00 C ATOM 6 CG MET A 1 0.397 -21.171 -2.695 1.00 0.00 C ATOM 7 SD MET A 1 -1.174 -20.426 -2.191 1.00 0.00 S ATOM 8 CE MET A 1 -0.686 -19.979 -0.505 1.00 0.00 C ATOM 0 H1 MET A 1 1.524 -23.751 -4.803 1.00 0.00 H new ATOM 0 H2 MET A 1 2.537 -24.800 -3.933 1.00 0.00 H new ATOM 0 H3 MET A 1 0.851 -24.975 -3.838 1.00 0.00 H new ATOM 0 HA MET A 1 2.410 -22.629 -2.794 1.00 0.00 H new ATOM 0 HB2 MET A 1 -0.265 -22.929 -3.764 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.410 -23.060 -2.023 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.171 -20.942 -1.963 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.723 -20.749 -3.646 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.522 -19.495 -0.000 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.403 -20.878 0.042 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.161 -19.294 -0.541 1.00 0.00 H new ATOM 20 N MET A 2 2.900 -24.719 -1.227 1.00 0.00 N ATOM 21 CA MET A 2 3.107 -25.492 0.032 1.00 0.00 C ATOM 22 C MET A 2 4.601 -25.708 0.289 1.00 0.00 C ATOM 23 O MET A 2 5.059 -26.825 0.432 1.00 0.00 O ATOM 24 CB MET A 2 2.400 -26.831 -0.191 1.00 0.00 C ATOM 25 CG MET A 2 2.669 -27.324 -1.612 1.00 0.00 C ATOM 26 SD MET A 2 2.704 -29.133 -1.628 1.00 0.00 S ATOM 27 CE MET A 2 4.374 -29.321 -2.302 1.00 0.00 C ATOM 0 H MET A 2 3.700 -24.693 -1.859 1.00 0.00 H new ATOM 0 HA MET A 2 2.711 -24.966 0.901 1.00 0.00 H new ATOM 0 HB2 MET A 2 2.754 -27.565 0.532 1.00 0.00 H new ATOM 0 HB3 MET A 2 1.328 -26.718 -0.032 1.00 0.00 H new ATOM 0 HG2 MET A 2 1.895 -26.959 -2.287 1.00 0.00 H new ATOM 0 HG3 MET A 2 3.619 -26.928 -1.972 1.00 0.00 H new ATOM 0 HE1 MET A 2 4.610 -30.381 -2.398 1.00 0.00 H new ATOM 0 HE2 MET A 2 4.426 -28.847 -3.282 1.00 0.00 H new ATOM 0 HE3 MET A 2 5.092 -28.849 -1.632 1.00 0.00 H new ATOM 37 N GLU A 3 5.367 -24.652 0.354 1.00 0.00 N ATOM 38 CA GLU A 3 6.828 -24.812 0.610 1.00 0.00 C ATOM 39 C GLU A 3 7.429 -23.526 1.161 1.00 0.00 C ATOM 40 O GLU A 3 6.819 -22.811 1.934 1.00 0.00 O ATOM 41 CB GLU A 3 7.455 -25.116 -0.747 1.00 0.00 C ATOM 42 CG GLU A 3 7.509 -23.840 -1.600 1.00 0.00 C ATOM 43 CD GLU A 3 6.435 -23.908 -2.686 1.00 0.00 C ATOM 44 OE1 GLU A 3 6.729 -24.429 -3.750 1.00 0.00 O ATOM 45 OE2 GLU A 3 5.337 -23.441 -2.436 1.00 0.00 O ATOM 0 H GLU A 3 5.047 -23.690 0.242 1.00 0.00 H new ATOM 0 HA GLU A 3 7.010 -25.599 1.342 1.00 0.00 H new ATOM 0 HB2 GLU A 3 8.460 -25.515 -0.611 1.00 0.00 H new ATOM 0 HB3 GLU A 3 6.875 -25.882 -1.261 1.00 0.00 H new ATOM 0 HG2 GLU A 3 7.352 -22.963 -0.972 1.00 0.00 H new ATOM 0 HG3 GLU A 3 8.494 -23.734 -2.054 1.00 0.00 H new ATOM 52 N GLU A 4 8.629 -23.219 0.746 1.00 0.00 N ATOM 53 CA GLU A 4 9.261 -21.982 1.230 1.00 0.00 C ATOM 54 C GLU A 4 8.959 -20.812 0.303 1.00 0.00 C ATOM 55 O GLU A 4 8.845 -19.680 0.728 1.00 0.00 O ATOM 56 CB GLU A 4 10.758 -22.283 1.287 1.00 0.00 C ATOM 57 CG GLU A 4 10.982 -23.595 2.040 1.00 0.00 C ATOM 58 CD GLU A 4 12.335 -23.552 2.750 1.00 0.00 C ATOM 59 OE1 GLU A 4 12.624 -22.543 3.372 1.00 0.00 O ATOM 60 OE2 GLU A 4 13.059 -24.531 2.664 1.00 0.00 O ATOM 0 H GLU A 4 9.187 -23.774 0.097 1.00 0.00 H new ATOM 0 HA GLU A 4 8.879 -21.689 2.208 1.00 0.00 H new ATOM 0 HB2 GLU A 4 11.165 -22.355 0.278 1.00 0.00 H new ATOM 0 HB3 GLU A 4 11.285 -21.470 1.786 1.00 0.00 H new ATOM 0 HG2 GLU A 4 10.184 -23.751 2.766 1.00 0.00 H new ATOM 0 HG3 GLU A 4 10.950 -24.435 1.346 1.00 0.00 H new ATOM 67 N TYR A 5 8.824 -21.082 -0.953 1.00 0.00 N ATOM 68 CA TYR A 5 8.520 -19.992 -1.924 1.00 0.00 C ATOM 69 C TYR A 5 7.464 -19.068 -1.336 1.00 0.00 C ATOM 70 O TYR A 5 7.569 -17.858 -1.386 1.00 0.00 O ATOM 71 CB TYR A 5 7.992 -20.705 -3.171 1.00 0.00 C ATOM 72 CG TYR A 5 8.214 -19.834 -4.386 1.00 0.00 C ATOM 73 CD1 TYR A 5 9.488 -19.324 -4.659 1.00 0.00 C ATOM 74 CD2 TYR A 5 7.144 -19.542 -5.242 1.00 0.00 C ATOM 75 CE1 TYR A 5 9.694 -18.520 -5.787 1.00 0.00 C ATOM 76 CE2 TYR A 5 7.350 -18.737 -6.371 1.00 0.00 C ATOM 77 CZ TYR A 5 8.624 -18.227 -6.643 1.00 0.00 C ATOM 78 OH TYR A 5 8.828 -17.435 -7.755 1.00 0.00 O ATOM 0 H TYR A 5 8.910 -22.013 -1.360 1.00 0.00 H new ATOM 0 HA TYR A 5 9.390 -19.378 -2.156 1.00 0.00 H new ATOM 0 HB2 TYR A 5 8.501 -21.661 -3.298 1.00 0.00 H new ATOM 0 HB3 TYR A 5 6.930 -20.922 -3.056 1.00 0.00 H new ATOM 0 HD1 TYR A 5 10.313 -19.550 -4.000 1.00 0.00 H new ATOM 0 HD2 TYR A 5 6.161 -19.937 -5.032 1.00 0.00 H new ATOM 0 HE1 TYR A 5 10.677 -18.126 -5.997 1.00 0.00 H new ATOM 0 HE2 TYR A 5 6.525 -18.511 -7.031 1.00 0.00 H new ATOM 0 HH TYR A 5 7.984 -17.331 -8.242 1.00 0.00 H new ATOM 88 N LEU A 6 6.460 -19.642 -0.763 1.00 0.00 N ATOM 89 CA LEU A 6 5.381 -18.826 -0.139 1.00 0.00 C ATOM 90 C LEU A 6 5.738 -18.534 1.321 1.00 0.00 C ATOM 91 O LEU A 6 5.390 -17.502 1.860 1.00 0.00 O ATOM 92 CB LEU A 6 4.116 -19.682 -0.232 1.00 0.00 C ATOM 93 CG LEU A 6 4.163 -20.797 0.817 1.00 0.00 C ATOM 94 CD1 LEU A 6 3.642 -20.264 2.153 1.00 0.00 C ATOM 95 CD2 LEU A 6 3.288 -21.965 0.358 1.00 0.00 C ATOM 0 H LEU A 6 6.331 -20.652 -0.695 1.00 0.00 H new ATOM 0 HA LEU A 6 5.244 -17.865 -0.636 1.00 0.00 H new ATOM 0 HB2 LEU A 6 3.234 -19.061 -0.076 1.00 0.00 H new ATOM 0 HB3 LEU A 6 4.030 -20.113 -1.230 1.00 0.00 H new ATOM 0 HG LEU A 6 5.191 -21.138 0.939 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.676 -21.058 2.899 1.00 0.00 H new ATOM 0 HD12 LEU A 6 4.265 -19.431 2.480 1.00 0.00 H new ATOM 0 HD13 LEU A 6 2.614 -19.923 2.032 1.00 0.00 H new ATOM 0 HD21 LEU A 6 3.321 -22.759 1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 6 2.260 -21.624 0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 6 3.659 -22.346 -0.594 1.00 0.00 H new ATOM 107 N GLY A 7 6.437 -19.434 1.965 1.00 0.00 N ATOM 108 CA GLY A 7 6.816 -19.200 3.384 1.00 0.00 C ATOM 109 C GLY A 7 7.631 -17.909 3.490 1.00 0.00 C ATOM 110 O GLY A 7 7.420 -17.102 4.374 1.00 0.00 O ATOM 0 H GLY A 7 6.759 -20.317 1.568 1.00 0.00 H new ATOM 0 HA2 GLY A 7 5.922 -19.130 4.003 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.398 -20.042 3.759 1.00 0.00 H new ATOM 114 N VAL A 8 8.562 -17.703 2.596 1.00 0.00 N ATOM 115 CA VAL A 8 9.384 -16.460 2.659 1.00 0.00 C ATOM 116 C VAL A 8 8.655 -15.307 1.980 1.00 0.00 C ATOM 117 O VAL A 8 8.823 -14.155 2.327 1.00 0.00 O ATOM 118 CB VAL A 8 10.682 -16.797 1.924 1.00 0.00 C ATOM 119 CG1 VAL A 8 11.401 -15.507 1.527 1.00 0.00 C ATOM 120 CG2 VAL A 8 11.588 -17.620 2.844 1.00 0.00 C ATOM 0 H VAL A 8 8.787 -18.337 1.830 1.00 0.00 H new ATOM 0 HA VAL A 8 9.575 -16.145 3.685 1.00 0.00 H new ATOM 0 HB VAL A 8 10.450 -17.371 1.027 1.00 0.00 H new ATOM 0 HG11 VAL A 8 12.325 -15.752 1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.758 -14.919 0.872 1.00 0.00 H new ATOM 0 HG13 VAL A 8 11.633 -14.930 2.422 1.00 0.00 H new ATOM 0 HG21 VAL A 8 12.514 -17.861 2.322 1.00 0.00 H new ATOM 0 HG22 VAL A 8 11.817 -17.043 3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 8 11.079 -18.542 3.126 1.00 0.00 H new ATOM 130 N PHE A 9 7.840 -15.613 1.025 1.00 0.00 N ATOM 131 CA PHE A 9 7.083 -14.538 0.323 1.00 0.00 C ATOM 132 C PHE A 9 6.211 -13.792 1.334 1.00 0.00 C ATOM 133 O PHE A 9 5.972 -12.607 1.211 1.00 0.00 O ATOM 134 CB PHE A 9 6.220 -15.257 -0.710 1.00 0.00 C ATOM 135 CG PHE A 9 6.862 -15.133 -2.071 1.00 0.00 C ATOM 136 CD1 PHE A 9 8.196 -15.515 -2.252 1.00 0.00 C ATOM 137 CD2 PHE A 9 6.124 -14.635 -3.152 1.00 0.00 C ATOM 138 CE1 PHE A 9 8.794 -15.399 -3.512 1.00 0.00 C ATOM 139 CE2 PHE A 9 6.721 -14.519 -4.412 1.00 0.00 C ATOM 140 CZ PHE A 9 8.056 -14.901 -4.592 1.00 0.00 C ATOM 0 H PHE A 9 7.659 -16.561 0.693 1.00 0.00 H new ATOM 0 HA PHE A 9 7.736 -13.805 -0.150 1.00 0.00 H new ATOM 0 HB2 PHE A 9 6.111 -16.308 -0.441 1.00 0.00 H new ATOM 0 HB3 PHE A 9 5.219 -14.827 -0.727 1.00 0.00 H new ATOM 0 HD1 PHE A 9 8.765 -15.900 -1.418 1.00 0.00 H new ATOM 0 HD2 PHE A 9 5.094 -14.341 -3.013 1.00 0.00 H new ATOM 0 HE1 PHE A 9 9.824 -15.693 -3.651 1.00 0.00 H new ATOM 0 HE2 PHE A 9 6.152 -14.135 -5.246 1.00 0.00 H new ATOM 0 HZ PHE A 9 8.517 -14.811 -5.565 1.00 0.00 H new ATOM 150 N VAL A 10 5.747 -14.479 2.342 1.00 0.00 N ATOM 151 CA VAL A 10 4.906 -13.811 3.372 1.00 0.00 C ATOM 152 C VAL A 10 5.803 -13.049 4.348 1.00 0.00 C ATOM 153 O VAL A 10 5.612 -11.877 4.598 1.00 0.00 O ATOM 154 CB VAL A 10 4.175 -14.943 4.091 1.00 0.00 C ATOM 155 CG1 VAL A 10 3.274 -14.353 5.178 1.00 0.00 C ATOM 156 CG2 VAL A 10 3.319 -15.719 3.087 1.00 0.00 C ATOM 0 H VAL A 10 5.914 -15.473 2.496 1.00 0.00 H new ATOM 0 HA VAL A 10 4.208 -13.094 2.940 1.00 0.00 H new ATOM 0 HB VAL A 10 4.903 -15.617 4.544 1.00 0.00 H new ATOM 0 HG11 VAL A 10 2.751 -15.158 5.693 1.00 0.00 H new ATOM 0 HG12 VAL A 10 3.882 -13.799 5.893 1.00 0.00 H new ATOM 0 HG13 VAL A 10 2.547 -13.681 4.723 1.00 0.00 H new ATOM 0 HG21 VAL A 10 2.798 -16.527 3.601 1.00 0.00 H new ATOM 0 HG22 VAL A 10 2.590 -15.047 2.634 1.00 0.00 H new ATOM 0 HG23 VAL A 10 3.959 -16.137 2.310 1.00 0.00 H new ATOM 166 N ASP A 11 6.792 -13.703 4.896 1.00 0.00 N ATOM 167 CA ASP A 11 7.696 -12.997 5.843 1.00 0.00 C ATOM 168 C ASP A 11 8.144 -11.682 5.221 1.00 0.00 C ATOM 169 O ASP A 11 8.470 -10.726 5.899 1.00 0.00 O ATOM 170 CB ASP A 11 8.884 -13.940 6.042 1.00 0.00 C ATOM 171 CG ASP A 11 9.396 -13.823 7.479 1.00 0.00 C ATOM 172 OD1 ASP A 11 8.588 -13.569 8.357 1.00 0.00 O ATOM 173 OD2 ASP A 11 10.588 -13.991 7.677 1.00 0.00 O ATOM 0 H ASP A 11 7.010 -14.685 4.730 1.00 0.00 H new ATOM 0 HA ASP A 11 7.215 -12.761 6.793 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.585 -14.967 5.834 1.00 0.00 H new ATOM 0 HB3 ASP A 11 9.680 -13.692 5.340 1.00 0.00 H new ATOM 178 N GLU A 12 8.142 -11.635 3.927 1.00 0.00 N ATOM 179 CA GLU A 12 8.550 -10.392 3.213 1.00 0.00 C ATOM 180 C GLU A 12 7.331 -9.496 2.994 1.00 0.00 C ATOM 181 O GLU A 12 7.424 -8.286 3.045 1.00 0.00 O ATOM 182 CB GLU A 12 9.118 -10.868 1.876 1.00 0.00 C ATOM 183 CG GLU A 12 10.306 -11.800 2.126 1.00 0.00 C ATOM 184 CD GLU A 12 11.512 -10.977 2.585 1.00 0.00 C ATOM 185 OE1 GLU A 12 11.497 -9.774 2.381 1.00 0.00 O ATOM 186 OE2 GLU A 12 12.430 -11.565 3.133 1.00 0.00 O ATOM 0 H GLU A 12 7.873 -12.410 3.321 1.00 0.00 H new ATOM 0 HA GLU A 12 9.280 -9.809 3.775 1.00 0.00 H new ATOM 0 HB2 GLU A 12 8.348 -11.389 1.307 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.433 -10.013 1.278 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.048 -12.540 2.883 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.551 -12.347 1.216 1.00 0.00 H new ATOM 193 N THR A 13 6.185 -10.078 2.758 1.00 0.00 N ATOM 194 CA THR A 13 4.966 -9.249 2.545 1.00 0.00 C ATOM 195 C THR A 13 4.610 -8.515 3.841 1.00 0.00 C ATOM 196 O THR A 13 4.289 -7.346 3.832 1.00 0.00 O ATOM 197 CB THR A 13 3.866 -10.242 2.125 1.00 0.00 C ATOM 198 OG1 THR A 13 2.981 -9.600 1.219 1.00 0.00 O ATOM 199 CG2 THR A 13 3.073 -10.730 3.345 1.00 0.00 C ATOM 0 H THR A 13 6.042 -11.086 2.704 1.00 0.00 H new ATOM 0 HA THR A 13 5.102 -8.481 1.783 1.00 0.00 H new ATOM 0 HB THR A 13 4.337 -11.103 1.650 1.00 0.00 H new ATOM 0 HG1 THR A 13 3.206 -9.860 0.302 1.00 0.00 H new ATOM 0 HG21 THR A 13 2.302 -11.430 3.022 1.00 0.00 H new ATOM 0 HG22 THR A 13 3.747 -11.229 4.041 1.00 0.00 H new ATOM 0 HG23 THR A 13 2.605 -9.878 3.839 1.00 0.00 H new ATOM 207 N LYS A 14 4.683 -9.189 4.957 1.00 0.00 N ATOM 208 CA LYS A 14 4.364 -8.523 6.249 1.00 0.00 C ATOM 209 C LYS A 14 5.423 -7.465 6.534 1.00 0.00 C ATOM 210 O LYS A 14 5.118 -6.322 6.804 1.00 0.00 O ATOM 211 CB LYS A 14 4.418 -9.633 7.298 1.00 0.00 C ATOM 212 CG LYS A 14 3.012 -10.183 7.533 1.00 0.00 C ATOM 213 CD LYS A 14 3.003 -11.684 7.246 1.00 0.00 C ATOM 214 CE LYS A 14 2.491 -12.439 8.475 1.00 0.00 C ATOM 215 NZ LYS A 14 1.274 -11.693 8.909 1.00 0.00 N ATOM 0 H LYS A 14 4.950 -10.171 5.028 1.00 0.00 H new ATOM 0 HA LYS A 14 3.392 -8.030 6.244 1.00 0.00 H new ATOM 0 HB2 LYS A 14 5.081 -10.431 6.964 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.829 -9.247 8.231 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.703 -9.996 8.561 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.297 -9.673 6.887 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.368 -11.896 6.386 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.008 -12.022 6.992 1.00 0.00 H new ATOM 0 HE2 LYS A 14 2.253 -13.474 8.231 1.00 0.00 H new ATOM 0 HE3 LYS A 14 3.242 -12.462 9.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 0.606 -12.350 9.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.544 -10.953 9.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.822 -11.255 8.081 1.00 0.00 H new ATOM 229 N GLU A 15 6.670 -7.836 6.451 1.00 0.00 N ATOM 230 CA GLU A 15 7.747 -6.849 6.693 1.00 0.00 C ATOM 231 C GLU A 15 7.592 -5.699 5.708 1.00 0.00 C ATOM 232 O GLU A 15 8.103 -4.613 5.902 1.00 0.00 O ATOM 233 CB GLU A 15 9.055 -7.607 6.455 1.00 0.00 C ATOM 234 CG GLU A 15 9.170 -8.758 7.456 1.00 0.00 C ATOM 235 CD GLU A 15 9.641 -8.216 8.806 1.00 0.00 C ATOM 236 OE1 GLU A 15 10.501 -7.351 8.807 1.00 0.00 O ATOM 237 OE2 GLU A 15 9.135 -8.675 9.817 1.00 0.00 O ATOM 0 H GLU A 15 6.985 -8.780 6.226 1.00 0.00 H new ATOM 0 HA GLU A 15 7.720 -6.427 7.697 1.00 0.00 H new ATOM 0 HB2 GLU A 15 9.083 -7.993 5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 15 9.904 -6.931 6.563 1.00 0.00 H new ATOM 0 HG2 GLU A 15 8.206 -9.254 7.568 1.00 0.00 H new ATOM 0 HG3 GLU A 15 9.872 -9.506 7.087 1.00 0.00 H new ATOM 244 N TYR A 16 6.864 -5.936 4.661 1.00 0.00 N ATOM 245 CA TYR A 16 6.631 -4.877 3.648 1.00 0.00 C ATOM 246 C TYR A 16 5.397 -4.070 4.039 1.00 0.00 C ATOM 247 O TYR A 16 5.222 -2.945 3.621 1.00 0.00 O ATOM 248 CB TYR A 16 6.400 -5.619 2.330 1.00 0.00 C ATOM 249 CG TYR A 16 7.631 -5.504 1.463 1.00 0.00 C ATOM 250 CD1 TYR A 16 8.256 -4.263 1.293 1.00 0.00 C ATOM 251 CD2 TYR A 16 8.147 -6.640 0.825 1.00 0.00 C ATOM 252 CE1 TYR A 16 9.396 -4.156 0.488 1.00 0.00 C ATOM 253 CE2 TYR A 16 9.287 -6.533 0.020 1.00 0.00 C ATOM 254 CZ TYR A 16 9.911 -5.291 -0.149 1.00 0.00 C ATOM 255 OH TYR A 16 11.035 -5.185 -0.943 1.00 0.00 O ATOM 0 H TYR A 16 6.414 -6.829 4.460 1.00 0.00 H new ATOM 0 HA TYR A 16 7.466 -4.181 3.567 1.00 0.00 H new ATOM 0 HB2 TYR A 16 6.177 -6.668 2.525 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.537 -5.201 1.812 1.00 0.00 H new ATOM 0 HD1 TYR A 16 7.858 -3.387 1.784 1.00 0.00 H new ATOM 0 HD2 TYR A 16 7.665 -7.598 0.954 1.00 0.00 H new ATOM 0 HE1 TYR A 16 9.878 -3.198 0.358 1.00 0.00 H new ATOM 0 HE2 TYR A 16 9.685 -7.409 -0.471 1.00 0.00 H new ATOM 0 HH TYR A 16 11.261 -6.065 -1.309 1.00 0.00 H new ATOM 265 N LEU A 17 4.557 -4.623 4.873 1.00 0.00 N ATOM 266 CA LEU A 17 3.357 -3.871 5.327 1.00 0.00 C ATOM 267 C LEU A 17 3.801 -2.996 6.481 1.00 0.00 C ATOM 268 O LEU A 17 3.345 -1.886 6.670 1.00 0.00 O ATOM 269 CB LEU A 17 2.359 -4.931 5.790 1.00 0.00 C ATOM 270 CG LEU A 17 1.816 -5.671 4.571 1.00 0.00 C ATOM 271 CD1 LEU A 17 0.811 -6.734 5.019 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.126 -4.675 3.640 1.00 0.00 C ATOM 0 H LEU A 17 4.652 -5.563 5.258 1.00 0.00 H new ATOM 0 HA LEU A 17 2.905 -3.243 4.559 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.843 -5.632 6.470 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.543 -4.464 6.341 1.00 0.00 H new ATOM 0 HG LEU A 17 2.639 -6.154 4.044 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.425 -7.261 4.146 1.00 0.00 H new ATOM 0 HD12 LEU A 17 1.304 -7.444 5.683 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -0.013 -6.255 5.548 1.00 0.00 H new ATOM 0 HD21 LEU A 17 0.737 -5.201 2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.304 -4.192 4.169 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.844 -3.920 3.318 1.00 0.00 H new ATOM 284 N GLN A 18 4.745 -3.494 7.221 1.00 0.00 N ATOM 285 CA GLN A 18 5.313 -2.715 8.346 1.00 0.00 C ATOM 286 C GLN A 18 6.158 -1.627 7.739 1.00 0.00 C ATOM 287 O GLN A 18 6.086 -0.467 8.091 1.00 0.00 O ATOM 288 CB GLN A 18 6.212 -3.683 9.106 1.00 0.00 C ATOM 289 CG GLN A 18 5.578 -5.066 9.156 1.00 0.00 C ATOM 290 CD GLN A 18 5.584 -5.590 10.592 1.00 0.00 C ATOM 291 OE1 GLN A 18 6.631 -5.844 11.155 1.00 0.00 O ATOM 292 NE2 GLN A 18 4.449 -5.764 11.214 1.00 0.00 N ATOM 0 H GLN A 18 5.152 -4.420 7.092 1.00 0.00 H new ATOM 0 HA GLN A 18 4.556 -2.283 9.001 1.00 0.00 H new ATOM 0 HB2 GLN A 18 7.187 -3.740 8.622 1.00 0.00 H new ATOM 0 HB3 GLN A 18 6.379 -3.316 10.118 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.556 -5.021 8.781 1.00 0.00 H new ATOM 0 HG3 GLN A 18 6.126 -5.750 8.508 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.571 -5.551 10.741 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.441 -6.113 12.172 1.00 0.00 H new ATOM 301 N ASN A 19 6.945 -2.023 6.794 1.00 0.00 N ATOM 302 CA ASN A 19 7.808 -1.055 6.089 1.00 0.00 C ATOM 303 C ASN A 19 6.911 -0.110 5.313 1.00 0.00 C ATOM 304 O ASN A 19 7.231 1.037 5.074 1.00 0.00 O ATOM 305 CB ASN A 19 8.680 -1.896 5.154 1.00 0.00 C ATOM 306 CG ASN A 19 9.281 -0.999 4.070 1.00 0.00 C ATOM 307 OD1 ASN A 19 9.210 0.210 4.157 1.00 0.00 O ATOM 308 ND2 ASN A 19 9.873 -1.545 3.043 1.00 0.00 N ATOM 0 H ASN A 19 7.029 -2.988 6.475 1.00 0.00 H new ATOM 0 HA ASN A 19 8.432 -0.456 6.753 1.00 0.00 H new ATOM 0 HB2 ASN A 19 9.475 -2.382 5.720 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.084 -2.687 4.697 1.00 0.00 H new ATOM 0 HD21 ASN A 19 10.276 -0.956 2.314 1.00 0.00 H new ATOM 0 HD22 ASN A 19 9.933 -2.561 2.969 1.00 0.00 H new ATOM 315 N LEU A 20 5.766 -0.596 4.956 1.00 0.00 N ATOM 316 CA LEU A 20 4.784 0.242 4.228 1.00 0.00 C ATOM 317 C LEU A 20 3.876 0.929 5.242 1.00 0.00 C ATOM 318 O LEU A 20 3.073 1.774 4.904 1.00 0.00 O ATOM 319 CB LEU A 20 3.989 -0.730 3.356 1.00 0.00 C ATOM 320 CG LEU A 20 2.845 0.010 2.660 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.415 0.955 1.601 1.00 0.00 C ATOM 322 CD2 LEU A 20 1.918 -1.006 1.989 1.00 0.00 C ATOM 0 H LEU A 20 5.462 -1.552 5.139 1.00 0.00 H new ATOM 0 HA LEU A 20 5.252 1.018 3.622 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.644 -1.185 2.613 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.591 -1.539 3.968 1.00 0.00 H new ATOM 0 HG LEU A 20 2.285 0.587 3.396 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.599 1.481 1.106 1.00 0.00 H new ATOM 0 HD12 LEU A 20 4.077 1.678 2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 20 3.976 0.380 0.864 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.102 -0.481 1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.480 -1.581 1.254 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.511 -1.680 2.743 1.00 0.00 H new ATOM 334 N ASN A 21 4.031 0.603 6.496 1.00 0.00 N ATOM 335 CA ASN A 21 3.219 1.265 7.529 1.00 0.00 C ATOM 336 C ASN A 21 4.030 2.424 8.019 1.00 0.00 C ATOM 337 O ASN A 21 3.536 3.485 8.327 1.00 0.00 O ATOM 338 CB ASN A 21 3.024 0.240 8.637 1.00 0.00 C ATOM 339 CG ASN A 21 1.588 -0.288 8.606 1.00 0.00 C ATOM 340 OD1 ASN A 21 0.701 0.363 8.089 1.00 0.00 O ATOM 341 ND2 ASN A 21 1.320 -1.448 9.142 1.00 0.00 N ATOM 0 H ASN A 21 4.689 -0.096 6.840 1.00 0.00 H new ATOM 0 HA ASN A 21 2.250 1.616 7.174 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.727 -0.583 8.511 1.00 0.00 H new ATOM 0 HB3 ASN A 21 3.234 0.693 9.606 1.00 0.00 H new ATOM 0 HD21 ASN A 21 0.366 -1.809 9.127 1.00 0.00 H new ATOM 0 HD22 ASN A 21 2.065 -1.994 9.576 1.00 0.00 H new ATOM 348 N ASP A 22 5.301 2.216 8.062 1.00 0.00 N ATOM 349 CA ASP A 22 6.194 3.291 8.505 1.00 0.00 C ATOM 350 C ASP A 22 6.229 4.344 7.419 1.00 0.00 C ATOM 351 O ASP A 22 6.349 5.529 7.657 1.00 0.00 O ATOM 352 CB ASP A 22 7.566 2.648 8.716 1.00 0.00 C ATOM 353 CG ASP A 22 8.352 3.448 9.756 1.00 0.00 C ATOM 354 OD1 ASP A 22 7.785 3.750 10.794 1.00 0.00 O ATOM 355 OD2 ASP A 22 9.506 3.746 9.497 1.00 0.00 O ATOM 0 H ASP A 22 5.761 1.342 7.807 1.00 0.00 H new ATOM 0 HA ASP A 22 5.869 3.770 9.428 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.448 1.617 9.048 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.114 2.619 7.774 1.00 0.00 H new ATOM 360 N THR A 23 6.078 3.890 6.223 1.00 0.00 N ATOM 361 CA THR A 23 6.044 4.800 5.056 1.00 0.00 C ATOM 362 C THR A 23 4.679 5.469 5.002 1.00 0.00 C ATOM 363 O THR A 23 4.552 6.652 4.755 1.00 0.00 O ATOM 364 CB THR A 23 6.178 3.867 3.874 1.00 0.00 C ATOM 365 OG1 THR A 23 7.458 3.247 3.894 1.00 0.00 O ATOM 366 CG2 THR A 23 5.993 4.646 2.571 1.00 0.00 C ATOM 0 H THR A 23 5.974 2.901 5.994 1.00 0.00 H new ATOM 0 HA THR A 23 6.811 5.574 5.084 1.00 0.00 H new ATOM 0 HB THR A 23 5.409 3.097 3.937 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.476 2.556 4.589 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.091 3.967 1.724 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.003 5.103 2.557 1.00 0.00 H new ATOM 0 HG23 THR A 23 6.753 5.425 2.502 1.00 0.00 H new ATOM 374 N LEU A 24 3.650 4.698 5.236 1.00 0.00 N ATOM 375 CA LEU A 24 2.279 5.254 5.207 1.00 0.00 C ATOM 376 C LEU A 24 2.015 5.999 6.505 1.00 0.00 C ATOM 377 O LEU A 24 1.236 6.930 6.548 1.00 0.00 O ATOM 378 CB LEU A 24 1.358 4.040 5.076 1.00 0.00 C ATOM 379 CG LEU A 24 1.435 3.491 3.650 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.435 2.343 3.488 1.00 0.00 C ATOM 381 CD2 LEU A 24 1.096 4.604 2.658 1.00 0.00 C ATOM 0 H LEU A 24 3.708 3.702 5.447 1.00 0.00 H new ATOM 0 HA LEU A 24 2.123 5.958 4.390 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.651 3.270 5.790 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.332 4.321 5.314 1.00 0.00 H new ATOM 0 HG LEU A 24 2.443 3.124 3.457 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.491 1.953 2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.675 1.549 4.195 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.573 2.709 3.681 1.00 0.00 H new ATOM 0 HD21 LEU A 24 1.150 4.214 1.641 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.088 4.970 2.853 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.808 5.422 2.772 1.00 0.00 H new ATOM 393 N LEU A 25 2.663 5.610 7.570 1.00 0.00 N ATOM 394 CA LEU A 25 2.424 6.340 8.852 1.00 0.00 C ATOM 395 C LEU A 25 3.278 7.590 8.906 1.00 0.00 C ATOM 396 O LEU A 25 3.028 8.503 9.668 1.00 0.00 O ATOM 397 CB LEU A 25 2.792 5.370 9.958 1.00 0.00 C ATOM 398 CG LEU A 25 1.765 4.253 9.948 1.00 0.00 C ATOM 399 CD1 LEU A 25 2.303 3.058 10.726 1.00 0.00 C ATOM 400 CD2 LEU A 25 0.468 4.758 10.579 1.00 0.00 C ATOM 0 H LEU A 25 3.330 4.840 7.612 1.00 0.00 H new ATOM 0 HA LEU A 25 1.388 6.665 8.951 1.00 0.00 H new ATOM 0 HB2 LEU A 25 3.794 4.971 9.800 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.799 5.875 10.924 1.00 0.00 H new ATOM 0 HG LEU A 25 1.565 3.942 8.923 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.564 2.256 10.718 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.225 2.707 10.262 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.505 3.355 11.755 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.274 3.959 10.575 1.00 0.00 H new ATOM 0 HD22 LEU A 25 0.660 5.069 11.606 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.091 5.606 10.007 1.00 0.00 H new ATOM 412 N GLU A 26 4.240 7.664 8.050 1.00 0.00 N ATOM 413 CA GLU A 26 5.068 8.882 7.979 1.00 0.00 C ATOM 414 C GLU A 26 4.431 9.733 6.917 1.00 0.00 C ATOM 415 O GLU A 26 4.444 10.948 6.950 1.00 0.00 O ATOM 416 CB GLU A 26 6.471 8.415 7.586 1.00 0.00 C ATOM 417 CG GLU A 26 7.150 7.767 8.795 1.00 0.00 C ATOM 418 CD GLU A 26 8.498 7.179 8.373 1.00 0.00 C ATOM 419 OE1 GLU A 26 8.687 6.974 7.186 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.318 6.941 9.245 1.00 0.00 O ATOM 0 H GLU A 26 4.491 6.928 7.390 1.00 0.00 H new ATOM 0 HA GLU A 26 5.137 9.453 8.905 1.00 0.00 H new ATOM 0 HB2 GLU A 26 6.412 7.702 6.763 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.062 9.260 7.233 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.295 8.506 9.583 1.00 0.00 H new ATOM 0 HG3 GLU A 26 6.513 6.984 9.206 1.00 0.00 H new ATOM 427 N LEU A 27 3.839 9.064 5.980 1.00 0.00 N ATOM 428 CA LEU A 27 3.146 9.751 4.895 1.00 0.00 C ATOM 429 C LEU A 27 1.928 10.476 5.455 1.00 0.00 C ATOM 430 O LEU A 27 1.550 11.531 4.993 1.00 0.00 O ATOM 431 CB LEU A 27 2.720 8.647 3.930 1.00 0.00 C ATOM 432 CG LEU A 27 1.903 9.262 2.802 1.00 0.00 C ATOM 433 CD1 LEU A 27 2.812 10.131 1.934 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.284 8.152 1.950 1.00 0.00 C ATOM 0 H LEU A 27 3.812 8.046 5.929 1.00 0.00 H new ATOM 0 HA LEU A 27 3.770 10.494 4.399 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.597 8.141 3.527 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.131 7.895 4.455 1.00 0.00 H new ATOM 0 HG LEU A 27 1.107 9.876 3.223 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.229 10.573 1.125 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.247 10.924 2.543 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.609 9.517 1.514 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.700 8.595 1.144 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.076 7.534 1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 27 0.635 7.535 2.572 1.00 0.00 H new ATOM 446 N GLU A 28 1.312 9.916 6.461 1.00 0.00 N ATOM 447 CA GLU A 28 0.126 10.578 7.059 1.00 0.00 C ATOM 448 C GLU A 28 0.580 11.840 7.780 1.00 0.00 C ATOM 449 O GLU A 28 -0.081 12.859 7.752 1.00 0.00 O ATOM 450 CB GLU A 28 -0.440 9.568 8.054 1.00 0.00 C ATOM 451 CG GLU A 28 -1.244 8.507 7.303 1.00 0.00 C ATOM 452 CD GLU A 28 -1.831 7.509 8.304 1.00 0.00 C ATOM 453 OE1 GLU A 28 -2.534 7.943 9.201 1.00 0.00 O ATOM 454 OE2 GLU A 28 -1.567 6.327 8.155 1.00 0.00 O ATOM 0 H GLU A 28 1.581 9.031 6.891 1.00 0.00 H new ATOM 0 HA GLU A 28 -0.620 10.864 6.317 1.00 0.00 H new ATOM 0 HB2 GLU A 28 0.370 9.098 8.612 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -1.076 10.074 8.780 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -2.044 8.978 6.731 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -0.604 7.989 6.589 1.00 0.00 H new ATOM 461 N LYS A 29 1.724 11.785 8.406 1.00 0.00 N ATOM 462 CA LYS A 29 2.235 12.993 9.103 1.00 0.00 C ATOM 463 C LYS A 29 2.787 13.952 8.057 1.00 0.00 C ATOM 464 O LYS A 29 2.902 15.143 8.264 1.00 0.00 O ATOM 465 CB LYS A 29 3.318 12.467 10.052 1.00 0.00 C ATOM 466 CG LYS A 29 4.723 12.712 9.494 1.00 0.00 C ATOM 467 CD LYS A 29 5.648 11.611 10.001 1.00 0.00 C ATOM 468 CE LYS A 29 6.703 11.297 8.939 1.00 0.00 C ATOM 469 NZ LYS A 29 7.884 12.124 9.315 1.00 0.00 N ATOM 0 H LYS A 29 2.322 10.960 8.463 1.00 0.00 H new ATOM 0 HA LYS A 29 1.479 13.542 9.663 1.00 0.00 H new ATOM 0 HB2 LYS A 29 3.221 12.955 11.022 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.172 11.399 10.216 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.702 12.716 8.404 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.090 13.689 9.809 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.131 11.926 10.926 1.00 0.00 H new ATOM 0 HD3 LYS A 29 5.071 10.715 10.231 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.951 10.236 8.930 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.346 11.549 7.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.652 11.963 8.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 7.620 13.130 9.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.206 11.857 10.267 1.00 0.00 H new ATOM 483 N ASN A 30 3.098 13.411 6.924 1.00 0.00 N ATOM 484 CA ASN A 30 3.623 14.235 5.801 1.00 0.00 C ATOM 485 C ASN A 30 3.272 13.547 4.501 1.00 0.00 C ATOM 486 O ASN A 30 4.075 12.867 3.894 1.00 0.00 O ATOM 487 CB ASN A 30 5.134 14.330 6.005 1.00 0.00 C ATOM 488 CG ASN A 30 5.525 15.788 6.252 1.00 0.00 C ATOM 489 OD1 ASN A 30 5.233 16.651 5.448 1.00 0.00 O ATOM 490 ND2 ASN A 30 6.175 16.102 7.339 1.00 0.00 N ATOM 0 H ASN A 30 3.011 12.416 6.719 1.00 0.00 H new ATOM 0 HA ASN A 30 3.195 15.237 5.771 1.00 0.00 H new ATOM 0 HB2 ASN A 30 5.437 13.713 6.851 1.00 0.00 H new ATOM 0 HB3 ASN A 30 5.655 13.946 5.128 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.438 17.072 7.514 1.00 0.00 H new ATOM 0 HD22 ASN A 30 6.420 15.378 8.014 1.00 0.00 H new ATOM 497 N PRO A 31 2.042 13.738 4.152 1.00 0.00 N ATOM 498 CA PRO A 31 1.480 13.126 2.947 1.00 0.00 C ATOM 499 C PRO A 31 1.733 13.999 1.715 1.00 0.00 C ATOM 500 O PRO A 31 0.974 13.984 0.766 1.00 0.00 O ATOM 501 CB PRO A 31 0.001 13.060 3.285 1.00 0.00 C ATOM 502 CG PRO A 31 -0.258 14.149 4.277 1.00 0.00 C ATOM 503 CD PRO A 31 1.058 14.550 4.872 1.00 0.00 C ATOM 0 HA PRO A 31 1.915 12.158 2.700 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -0.607 13.197 2.391 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -0.259 12.087 3.701 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -0.734 15.002 3.793 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.939 13.803 5.055 1.00 0.00 H new ATOM 0 HD2 PRO A 31 1.247 15.615 4.739 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.087 14.353 5.944 1.00 0.00 H new ATOM 511 N GLU A 32 2.793 14.756 1.719 1.00 0.00 N ATOM 512 CA GLU A 32 3.090 15.626 0.544 1.00 0.00 C ATOM 513 C GLU A 32 4.602 15.703 0.322 1.00 0.00 C ATOM 514 O GLU A 32 5.080 16.450 -0.509 1.00 0.00 O ATOM 515 CB GLU A 32 2.524 17.020 0.876 1.00 0.00 C ATOM 516 CG GLU A 32 2.094 17.100 2.344 1.00 0.00 C ATOM 517 CD GLU A 32 2.029 18.565 2.781 1.00 0.00 C ATOM 518 OE1 GLU A 32 1.797 19.406 1.928 1.00 0.00 O ATOM 519 OE2 GLU A 32 2.212 18.820 3.959 1.00 0.00 O ATOM 0 H GLU A 32 3.467 14.811 2.483 1.00 0.00 H new ATOM 0 HA GLU A 32 2.642 15.231 -0.368 1.00 0.00 H new ATOM 0 HB2 GLU A 32 3.277 17.781 0.672 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.672 17.234 0.231 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.120 16.628 2.474 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.800 16.554 2.970 1.00 0.00 H new ATOM 526 N ASP A 33 5.357 14.930 1.054 1.00 0.00 N ATOM 527 CA ASP A 33 6.836 14.956 0.880 1.00 0.00 C ATOM 528 C ASP A 33 7.215 14.322 -0.456 1.00 0.00 C ATOM 529 O ASP A 33 8.324 14.454 -0.935 1.00 0.00 O ATOM 530 CB ASP A 33 7.395 14.139 2.046 1.00 0.00 C ATOM 531 CG ASP A 33 8.001 15.082 3.088 1.00 0.00 C ATOM 532 OD1 ASP A 33 8.428 16.160 2.705 1.00 0.00 O ATOM 533 OD2 ASP A 33 8.030 14.711 4.249 1.00 0.00 O ATOM 0 H ASP A 33 5.014 14.283 1.764 1.00 0.00 H new ATOM 0 HA ASP A 33 7.234 15.971 0.876 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.603 13.542 2.498 1.00 0.00 H new ATOM 0 HB3 ASP A 33 8.153 13.443 1.686 1.00 0.00 H new ATOM 538 N MET A 34 6.291 13.622 -1.044 1.00 0.00 N ATOM 539 CA MET A 34 6.541 12.943 -2.346 1.00 0.00 C ATOM 540 C MET A 34 7.595 11.854 -2.179 1.00 0.00 C ATOM 541 O MET A 34 7.987 11.205 -3.130 1.00 0.00 O ATOM 542 CB MET A 34 7.015 14.038 -3.306 1.00 0.00 C ATOM 543 CG MET A 34 5.833 14.516 -4.152 1.00 0.00 C ATOM 544 SD MET A 34 5.667 13.461 -5.612 1.00 0.00 S ATOM 545 CE MET A 34 4.226 14.290 -6.325 1.00 0.00 C ATOM 0 H MET A 34 5.351 13.488 -0.670 1.00 0.00 H new ATOM 0 HA MET A 34 5.646 12.452 -2.729 1.00 0.00 H new ATOM 0 HB2 MET A 34 7.436 14.872 -2.745 1.00 0.00 H new ATOM 0 HB3 MET A 34 7.807 13.655 -3.950 1.00 0.00 H new ATOM 0 HG2 MET A 34 4.916 14.487 -3.563 1.00 0.00 H new ATOM 0 HG3 MET A 34 5.985 15.552 -4.455 1.00 0.00 H new ATOM 0 HE1 MET A 34 3.889 13.742 -7.205 1.00 0.00 H new ATOM 0 HE2 MET A 34 3.423 14.322 -5.588 1.00 0.00 H new ATOM 0 HE3 MET A 34 4.496 15.306 -6.612 1.00 0.00 H new ATOM 555 N GLU A 35 8.024 11.616 -0.975 1.00 0.00 N ATOM 556 CA GLU A 35 9.006 10.535 -0.745 1.00 0.00 C ATOM 557 C GLU A 35 8.252 9.389 -0.095 1.00 0.00 C ATOM 558 O GLU A 35 8.398 8.238 -0.456 1.00 0.00 O ATOM 559 CB GLU A 35 10.075 11.127 0.185 1.00 0.00 C ATOM 560 CG GLU A 35 9.633 11.015 1.649 1.00 0.00 C ATOM 561 CD GLU A 35 10.786 11.434 2.563 1.00 0.00 C ATOM 562 OE1 GLU A 35 11.925 11.213 2.187 1.00 0.00 O ATOM 563 OE2 GLU A 35 10.509 11.968 3.625 1.00 0.00 O ATOM 0 H GLU A 35 7.734 12.126 -0.141 1.00 0.00 H new ATOM 0 HA GLU A 35 9.485 10.162 -1.650 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.020 10.603 0.043 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.249 12.172 -0.070 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.765 11.649 1.827 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.332 9.991 1.872 1.00 0.00 H new ATOM 570 N LEU A 36 7.403 9.716 0.835 1.00 0.00 N ATOM 571 CA LEU A 36 6.582 8.664 1.479 1.00 0.00 C ATOM 572 C LEU A 36 5.508 8.240 0.482 1.00 0.00 C ATOM 573 O LEU A 36 4.958 7.161 0.562 1.00 0.00 O ATOM 574 CB LEU A 36 5.959 9.323 2.709 1.00 0.00 C ATOM 575 CG LEU A 36 7.065 9.751 3.667 1.00 0.00 C ATOM 576 CD1 LEU A 36 6.525 10.793 4.645 1.00 0.00 C ATOM 577 CD2 LEU A 36 7.569 8.532 4.439 1.00 0.00 C ATOM 0 H LEU A 36 7.244 10.664 1.175 1.00 0.00 H new ATOM 0 HA LEU A 36 7.152 7.781 1.769 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.366 10.187 2.411 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.282 8.627 3.205 1.00 0.00 H new ATOM 0 HG LEU A 36 7.888 10.186 3.099 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.318 11.096 5.328 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.171 11.662 4.091 1.00 0.00 H new ATOM 0 HD13 LEU A 36 5.700 10.365 5.214 1.00 0.00 H new ATOM 0 HD21 LEU A 36 8.360 8.837 5.124 1.00 0.00 H new ATOM 0 HD22 LEU A 36 6.747 8.095 5.005 1.00 0.00 H new ATOM 0 HD23 LEU A 36 7.960 7.794 3.739 1.00 0.00 H new ATOM 589 N ILE A 37 5.226 9.088 -0.479 1.00 0.00 N ATOM 590 CA ILE A 37 4.210 8.735 -1.504 1.00 0.00 C ATOM 591 C ILE A 37 4.835 7.777 -2.517 1.00 0.00 C ATOM 592 O ILE A 37 4.166 6.939 -3.089 1.00 0.00 O ATOM 593 CB ILE A 37 3.833 10.059 -2.168 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.222 10.994 -1.119 1.00 0.00 C ATOM 595 CG2 ILE A 37 2.811 9.801 -3.278 1.00 0.00 C ATOM 596 CD1 ILE A 37 2.546 12.178 -1.812 1.00 0.00 C ATOM 0 H ILE A 37 5.658 10.005 -0.592 1.00 0.00 H new ATOM 0 HA ILE A 37 3.334 8.242 -1.082 1.00 0.00 H new ATOM 0 HB ILE A 37 4.723 10.520 -2.596 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.495 10.452 -0.514 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.997 11.352 -0.441 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.542 10.745 -3.752 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.243 9.132 -4.022 1.00 0.00 H new ATOM 0 HG23 ILE A 37 1.919 9.342 -2.852 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.113 12.840 -1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.284 12.727 -2.398 1.00 0.00 H new ATOM 0 HD13 ILE A 37 1.759 11.813 -2.471 1.00 0.00 H new ATOM 608 N ASN A 38 6.121 7.883 -2.734 1.00 0.00 N ATOM 609 CA ASN A 38 6.780 6.960 -3.699 1.00 0.00 C ATOM 610 C ASN A 38 7.262 5.717 -2.966 1.00 0.00 C ATOM 611 O ASN A 38 7.425 4.660 -3.542 1.00 0.00 O ATOM 612 CB ASN A 38 7.958 7.744 -4.280 1.00 0.00 C ATOM 613 CG ASN A 38 7.435 8.918 -5.109 1.00 0.00 C ATOM 614 OD1 ASN A 38 6.294 8.922 -5.529 1.00 0.00 O ATOM 615 ND2 ASN A 38 8.227 9.924 -5.363 1.00 0.00 N ATOM 0 H ASN A 38 6.737 8.563 -2.288 1.00 0.00 H new ATOM 0 HA ASN A 38 6.103 6.629 -4.487 1.00 0.00 H new ATOM 0 HB2 ASN A 38 8.596 8.110 -3.476 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.571 7.091 -4.902 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.889 10.713 -5.914 1.00 0.00 H new ATOM 0 HD22 ASN A 38 9.184 9.921 -5.011 1.00 0.00 H new ATOM 622 N GLU A 39 7.461 5.836 -1.693 1.00 0.00 N ATOM 623 CA GLU A 39 7.903 4.659 -0.896 1.00 0.00 C ATOM 624 C GLU A 39 6.705 3.754 -0.674 1.00 0.00 C ATOM 625 O GLU A 39 6.824 2.560 -0.482 1.00 0.00 O ATOM 626 CB GLU A 39 8.413 5.229 0.427 1.00 0.00 C ATOM 627 CG GLU A 39 9.806 5.825 0.224 1.00 0.00 C ATOM 628 CD GLU A 39 10.777 4.724 -0.204 1.00 0.00 C ATOM 629 OE1 GLU A 39 10.806 3.697 0.455 1.00 0.00 O ATOM 630 OE2 GLU A 39 11.476 4.925 -1.183 1.00 0.00 O ATOM 0 H GLU A 39 7.338 6.698 -1.162 1.00 0.00 H new ATOM 0 HA GLU A 39 8.680 4.073 -1.388 1.00 0.00 H new ATOM 0 HB2 GLU A 39 7.729 5.994 0.793 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.448 4.445 1.183 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.771 6.608 -0.534 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.152 6.290 1.147 1.00 0.00 H new ATOM 637 N ALA A 40 5.547 4.329 -0.732 1.00 0.00 N ATOM 638 CA ALA A 40 4.300 3.541 -0.564 1.00 0.00 C ATOM 639 C ALA A 40 3.858 3.035 -1.936 1.00 0.00 C ATOM 640 O ALA A 40 3.624 1.859 -2.128 1.00 0.00 O ATOM 641 CB ALA A 40 3.282 4.521 0.019 1.00 0.00 C ATOM 0 H ALA A 40 5.406 5.327 -0.891 1.00 0.00 H new ATOM 0 HA ALA A 40 4.419 2.674 0.086 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.331 4.010 0.172 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.647 4.900 0.973 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.140 5.352 -0.672 1.00 0.00 H new ATOM 647 N PHE A 41 3.777 3.909 -2.906 1.00 0.00 N ATOM 648 CA PHE A 41 3.393 3.454 -4.269 1.00 0.00 C ATOM 649 C PHE A 41 4.304 2.287 -4.656 1.00 0.00 C ATOM 650 O PHE A 41 3.969 1.457 -5.477 1.00 0.00 O ATOM 651 CB PHE A 41 3.637 4.669 -5.169 1.00 0.00 C ATOM 652 CG PHE A 41 3.654 4.242 -6.617 1.00 0.00 C ATOM 653 CD1 PHE A 41 4.797 3.637 -7.155 1.00 0.00 C ATOM 654 CD2 PHE A 41 2.531 4.459 -7.424 1.00 0.00 C ATOM 655 CE1 PHE A 41 4.814 3.245 -8.499 1.00 0.00 C ATOM 656 CE2 PHE A 41 2.550 4.069 -8.769 1.00 0.00 C ATOM 657 CZ PHE A 41 3.691 3.462 -9.306 1.00 0.00 C ATOM 0 H PHE A 41 3.959 4.908 -2.812 1.00 0.00 H new ATOM 0 HA PHE A 41 2.361 3.111 -4.346 1.00 0.00 H new ATOM 0 HB2 PHE A 41 2.856 5.413 -5.010 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.585 5.140 -4.909 1.00 0.00 H new ATOM 0 HD1 PHE A 41 5.665 3.473 -6.533 1.00 0.00 H new ATOM 0 HD2 PHE A 41 1.650 4.927 -7.010 1.00 0.00 H new ATOM 0 HE1 PHE A 41 5.694 2.775 -8.913 1.00 0.00 H new ATOM 0 HE2 PHE A 41 1.684 4.237 -9.392 1.00 0.00 H new ATOM 0 HZ PHE A 41 3.705 3.161 -10.343 1.00 0.00 H new ATOM 667 N ARG A 42 5.454 2.223 -4.040 1.00 0.00 N ATOM 668 CA ARG A 42 6.412 1.123 -4.322 1.00 0.00 C ATOM 669 C ARG A 42 6.010 -0.130 -3.539 1.00 0.00 C ATOM 670 O ARG A 42 5.647 -1.141 -4.105 1.00 0.00 O ATOM 671 CB ARG A 42 7.754 1.656 -3.819 1.00 0.00 C ATOM 672 CG ARG A 42 8.629 2.044 -5.009 1.00 0.00 C ATOM 673 CD ARG A 42 9.122 0.774 -5.693 1.00 0.00 C ATOM 674 NE ARG A 42 10.606 0.829 -5.589 1.00 0.00 N ATOM 675 CZ ARG A 42 11.322 1.165 -6.628 1.00 0.00 C ATOM 676 NH1 ARG A 42 11.017 2.233 -7.312 1.00 0.00 N ATOM 677 NH2 ARG A 42 12.343 0.433 -6.981 1.00 0.00 N ATOM 0 H ARG A 42 5.772 2.898 -3.344 1.00 0.00 H new ATOM 0 HA ARG A 42 6.442 0.846 -5.376 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.595 2.520 -3.174 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.256 0.898 -3.218 1.00 0.00 H new ATOM 0 HG2 ARG A 42 8.061 2.655 -5.711 1.00 0.00 H new ATOM 0 HG3 ARG A 42 9.475 2.645 -4.675 1.00 0.00 H new ATOM 0 HD2 ARG A 42 8.725 -0.116 -5.205 1.00 0.00 H new ATOM 0 HD3 ARG A 42 8.801 0.737 -6.734 1.00 0.00 H new ATOM 0 HE ARG A 42 11.064 0.604 -4.706 1.00 0.00 H new ATOM 0 HH11 ARG A 42 10.219 2.805 -7.035 1.00 0.00 H new ATOM 0 HH12 ARG A 42 11.576 2.496 -8.124 1.00 0.00 H new ATOM 0 HH21 ARG A 42 12.582 -0.402 -6.445 1.00 0.00 H new ATOM 0 HH22 ARG A 42 12.902 0.695 -7.793 1.00 0.00 H new ATOM 691 N ALA A 43 6.074 -0.065 -2.236 1.00 0.00 N ATOM 692 CA ALA A 43 5.699 -1.244 -1.399 1.00 0.00 C ATOM 693 C ALA A 43 4.284 -1.712 -1.724 1.00 0.00 C ATOM 694 O ALA A 43 3.948 -2.856 -1.511 1.00 0.00 O ATOM 695 CB ALA A 43 5.784 -0.747 0.044 1.00 0.00 C ATOM 0 H ALA A 43 6.371 0.758 -1.712 1.00 0.00 H new ATOM 0 HA ALA A 43 6.354 -2.096 -1.579 1.00 0.00 H new ATOM 0 HB1 ALA A 43 5.522 -1.558 0.724 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.800 -0.411 0.254 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.091 0.083 0.184 1.00 0.00 H new ATOM 701 N LEU A 44 3.453 -0.853 -2.240 1.00 0.00 N ATOM 702 CA LEU A 44 2.069 -1.291 -2.574 1.00 0.00 C ATOM 703 C LEU A 44 2.053 -1.940 -3.958 1.00 0.00 C ATOM 704 O LEU A 44 1.478 -2.992 -4.149 1.00 0.00 O ATOM 705 CB LEU A 44 1.221 -0.020 -2.553 1.00 0.00 C ATOM 706 CG LEU A 44 0.707 0.229 -1.134 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.226 1.676 -1.011 1.00 0.00 C ATOM 708 CD2 LEU A 44 -0.457 -0.719 -0.841 1.00 0.00 C ATOM 0 H LEU A 44 3.667 0.123 -2.444 1.00 0.00 H new ATOM 0 HA LEU A 44 1.686 -2.030 -1.871 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.813 0.830 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.383 -0.118 -3.243 1.00 0.00 H new ATOM 0 HG LEU A 44 1.512 0.051 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.140 1.853 0.000 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.054 2.354 -1.221 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.579 1.854 -1.725 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.824 -0.543 0.170 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.261 -0.540 -1.555 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.117 -1.751 -0.929 1.00 0.00 H new ATOM 720 N HIS A 45 2.702 -1.339 -4.917 1.00 0.00 N ATOM 721 CA HIS A 45 2.738 -1.953 -6.274 1.00 0.00 C ATOM 722 C HIS A 45 3.540 -3.244 -6.188 1.00 0.00 C ATOM 723 O HIS A 45 3.264 -4.215 -6.866 1.00 0.00 O ATOM 724 CB HIS A 45 3.441 -0.932 -7.167 1.00 0.00 C ATOM 725 CG HIS A 45 3.637 -1.520 -8.538 1.00 0.00 C ATOM 726 ND1 HIS A 45 4.612 -2.469 -8.803 1.00 0.00 N ATOM 727 CD2 HIS A 45 2.986 -1.309 -9.729 1.00 0.00 C ATOM 728 CE1 HIS A 45 4.522 -2.791 -10.107 1.00 0.00 C ATOM 729 NE2 HIS A 45 3.547 -2.113 -10.718 1.00 0.00 N ATOM 0 H HIS A 45 3.205 -0.457 -4.821 1.00 0.00 H new ATOM 0 HA HIS A 45 1.750 -2.191 -6.667 1.00 0.00 H new ATOM 0 HB2 HIS A 45 2.848 -0.020 -7.232 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.404 -0.657 -6.736 1.00 0.00 H new ATOM 0 HD2 HIS A 45 2.164 -0.624 -9.876 1.00 0.00 H new ATOM 0 HE1 HIS A 45 5.160 -3.510 -10.599 1.00 0.00 H new ATOM 0 HE2 HIS A 45 3.272 -2.172 -11.699 1.00 0.00 H new ATOM 737 N THR A 46 4.518 -3.263 -5.328 1.00 0.00 N ATOM 738 CA THR A 46 5.333 -4.490 -5.152 1.00 0.00 C ATOM 739 C THR A 46 4.459 -5.548 -4.473 1.00 0.00 C ATOM 740 O THR A 46 4.471 -6.709 -4.831 1.00 0.00 O ATOM 741 CB THR A 46 6.506 -4.044 -4.263 1.00 0.00 C ATOM 742 OG1 THR A 46 7.655 -3.841 -5.073 1.00 0.00 O ATOM 743 CG2 THR A 46 6.820 -5.100 -3.198 1.00 0.00 C ATOM 0 H THR A 46 4.787 -2.476 -4.738 1.00 0.00 H new ATOM 0 HA THR A 46 5.700 -4.928 -6.080 1.00 0.00 H new ATOM 0 HB THR A 46 6.228 -3.117 -3.761 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.405 -3.555 -4.511 1.00 0.00 H new ATOM 0 HG21 THR A 46 7.653 -4.760 -2.583 1.00 0.00 H new ATOM 0 HG22 THR A 46 5.943 -5.254 -2.569 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.087 -6.038 -3.684 1.00 0.00 H new ATOM 751 N LEU A 47 3.680 -5.140 -3.504 1.00 0.00 N ATOM 752 CA LEU A 47 2.783 -6.099 -2.810 1.00 0.00 C ATOM 753 C LEU A 47 1.634 -6.481 -3.749 1.00 0.00 C ATOM 754 O LEU A 47 1.243 -7.629 -3.837 1.00 0.00 O ATOM 755 CB LEU A 47 2.268 -5.326 -1.599 1.00 0.00 C ATOM 756 CG LEU A 47 2.932 -5.863 -0.332 1.00 0.00 C ATOM 757 CD1 LEU A 47 2.534 -4.990 0.860 1.00 0.00 C ATOM 758 CD2 LEU A 47 2.474 -7.302 -0.085 1.00 0.00 C ATOM 0 H LEU A 47 3.630 -4.179 -3.166 1.00 0.00 H new ATOM 0 HA LEU A 47 3.278 -7.024 -2.516 1.00 0.00 H new ATOM 0 HB2 LEU A 47 2.484 -4.264 -1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 47 1.185 -5.425 -1.525 1.00 0.00 H new ATOM 0 HG LEU A 47 4.015 -5.843 -0.453 1.00 0.00 H new ATOM 0 HD11 LEU A 47 3.007 -5.372 1.765 1.00 0.00 H new ATOM 0 HD12 LEU A 47 2.860 -3.965 0.685 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.451 -5.011 0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 47 2.948 -7.685 0.819 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.391 -7.323 0.036 1.00 0.00 H new ATOM 0 HD23 LEU A 47 2.756 -7.925 -0.934 1.00 0.00 H new ATOM 770 N LYS A 48 1.108 -5.523 -4.465 1.00 0.00 N ATOM 771 CA LYS A 48 0.006 -5.807 -5.419 1.00 0.00 C ATOM 772 C LYS A 48 0.384 -7.007 -6.292 1.00 0.00 C ATOM 773 O LYS A 48 -0.425 -7.865 -6.583 1.00 0.00 O ATOM 774 CB LYS A 48 -0.091 -4.534 -6.261 1.00 0.00 C ATOM 775 CG LYS A 48 -1.525 -4.349 -6.746 1.00 0.00 C ATOM 776 CD LYS A 48 -1.996 -5.643 -7.396 1.00 0.00 C ATOM 777 CE LYS A 48 -1.094 -5.965 -8.589 1.00 0.00 C ATOM 778 NZ LYS A 48 -1.449 -7.360 -8.977 1.00 0.00 N ATOM 0 H LYS A 48 1.401 -4.547 -4.426 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.938 -6.052 -4.931 1.00 0.00 H new ATOM 0 HB2 LYS A 48 0.218 -3.671 -5.671 1.00 0.00 H new ATOM 0 HB3 LYS A 48 0.586 -4.597 -7.113 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -2.175 -4.088 -5.911 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -1.579 -3.527 -7.460 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.968 -6.458 -6.673 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.031 -5.544 -7.724 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -1.265 -5.271 -9.412 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -0.041 -5.886 -8.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -0.999 -7.593 -9.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -1.114 -8.020 -8.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -2.482 -7.442 -9.071 1.00 0.00 H new ATOM 792 N GLY A 49 1.616 -7.070 -6.713 1.00 0.00 N ATOM 793 CA GLY A 49 2.055 -8.207 -7.570 1.00 0.00 C ATOM 794 C GLY A 49 2.135 -9.485 -6.731 1.00 0.00 C ATOM 795 O GLY A 49 1.468 -10.463 -7.009 1.00 0.00 O ATOM 0 H GLY A 49 2.339 -6.383 -6.501 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.355 -8.345 -8.394 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.028 -7.988 -8.011 1.00 0.00 H new ATOM 799 N MET A 50 2.949 -9.488 -5.711 1.00 0.00 N ATOM 800 CA MET A 50 3.076 -10.704 -4.858 1.00 0.00 C ATOM 801 C MET A 50 1.691 -11.209 -4.437 1.00 0.00 C ATOM 802 O MET A 50 1.504 -12.380 -4.173 1.00 0.00 O ATOM 803 CB MET A 50 3.877 -10.249 -3.639 1.00 0.00 C ATOM 804 CG MET A 50 5.350 -10.095 -4.024 1.00 0.00 C ATOM 805 SD MET A 50 6.379 -10.256 -2.544 1.00 0.00 S ATOM 806 CE MET A 50 5.544 -8.992 -1.551 1.00 0.00 C ATOM 0 H MET A 50 3.533 -8.700 -5.431 1.00 0.00 H new ATOM 0 HA MET A 50 3.563 -11.526 -5.383 1.00 0.00 H new ATOM 0 HB2 MET A 50 3.487 -9.302 -3.267 1.00 0.00 H new ATOM 0 HB3 MET A 50 3.775 -10.975 -2.832 1.00 0.00 H new ATOM 0 HG2 MET A 50 5.627 -10.853 -4.757 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.515 -9.124 -4.491 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.152 -8.755 -0.678 1.00 0.00 H new ATOM 0 HE2 MET A 50 5.403 -8.093 -2.150 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.573 -9.367 -1.226 1.00 0.00 H new ATOM 816 N ALA A 51 0.722 -10.337 -4.371 1.00 0.00 N ATOM 817 CA ALA A 51 -0.648 -10.771 -3.967 1.00 0.00 C ATOM 818 C ALA A 51 -1.462 -11.167 -5.199 1.00 0.00 C ATOM 819 O ALA A 51 -2.514 -11.764 -5.093 1.00 0.00 O ATOM 820 CB ALA A 51 -1.269 -9.550 -3.287 1.00 0.00 C ATOM 0 H ALA A 51 0.819 -9.343 -4.579 1.00 0.00 H new ATOM 0 HA ALA A 51 -0.626 -11.638 -3.307 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -2.281 -9.791 -2.961 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.666 -9.269 -2.423 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -1.303 -8.719 -3.992 1.00 0.00 H new ATOM 826 N GLY A 52 -0.990 -10.834 -6.367 1.00 0.00 N ATOM 827 CA GLY A 52 -1.747 -11.185 -7.600 1.00 0.00 C ATOM 828 C GLY A 52 -1.365 -12.591 -8.067 1.00 0.00 C ATOM 829 O GLY A 52 -1.234 -12.849 -9.247 1.00 0.00 O ATOM 0 H GLY A 52 -0.114 -10.335 -6.521 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.818 -11.136 -7.405 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.533 -10.461 -8.386 1.00 0.00 H new ATOM 833 N THR A 53 -1.193 -13.502 -7.150 1.00 0.00 N ATOM 834 CA THR A 53 -0.828 -14.899 -7.532 1.00 0.00 C ATOM 835 C THR A 53 -0.449 -15.678 -6.277 1.00 0.00 C ATOM 836 O THR A 53 -0.642 -16.874 -6.177 1.00 0.00 O ATOM 837 CB THR A 53 0.350 -14.756 -8.521 1.00 0.00 C ATOM 838 OG1 THR A 53 -0.045 -15.257 -9.790 1.00 0.00 O ATOM 839 CG2 THR A 53 1.583 -15.530 -8.035 1.00 0.00 C ATOM 0 H THR A 53 -1.290 -13.340 -6.148 1.00 0.00 H new ATOM 0 HA THR A 53 -1.645 -15.450 -7.999 1.00 0.00 H new ATOM 0 HB THR A 53 0.614 -13.701 -8.592 1.00 0.00 H new ATOM 0 HG1 THR A 53 -0.669 -14.629 -10.210 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.394 -15.409 -8.753 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.896 -15.144 -7.065 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.335 -16.587 -7.942 1.00 0.00 H new ATOM 847 N MET A 54 0.074 -14.989 -5.325 1.00 0.00 N ATOM 848 CA MET A 54 0.467 -15.634 -4.044 1.00 0.00 C ATOM 849 C MET A 54 -0.414 -15.105 -2.924 1.00 0.00 C ATOM 850 O MET A 54 -0.467 -15.646 -1.837 1.00 0.00 O ATOM 851 CB MET A 54 1.905 -15.208 -3.825 1.00 0.00 C ATOM 852 CG MET A 54 2.802 -16.445 -3.758 1.00 0.00 C ATOM 853 SD MET A 54 2.380 -17.413 -2.287 1.00 0.00 S ATOM 854 CE MET A 54 3.079 -16.275 -1.067 1.00 0.00 C ATOM 0 H MET A 54 0.253 -13.986 -5.372 1.00 0.00 H new ATOM 0 HA MET A 54 0.360 -16.719 -4.064 1.00 0.00 H new ATOM 0 HB2 MET A 54 2.229 -14.555 -4.635 1.00 0.00 H new ATOM 0 HB3 MET A 54 1.989 -14.635 -2.901 1.00 0.00 H new ATOM 0 HG2 MET A 54 2.673 -17.051 -4.655 1.00 0.00 H new ATOM 0 HG3 MET A 54 3.850 -16.147 -3.723 1.00 0.00 H new ATOM 0 HE1 MET A 54 3.623 -16.841 -0.311 1.00 0.00 H new ATOM 0 HE2 MET A 54 3.760 -15.584 -1.563 1.00 0.00 H new ATOM 0 HE3 MET A 54 2.275 -15.713 -0.591 1.00 0.00 H new ATOM 864 N GLY A 55 -1.119 -14.058 -3.204 1.00 0.00 N ATOM 865 CA GLY A 55 -2.033 -13.466 -2.197 1.00 0.00 C ATOM 866 C GLY A 55 -3.384 -13.265 -2.865 1.00 0.00 C ATOM 867 O GLY A 55 -4.271 -12.627 -2.335 1.00 0.00 O ATOM 0 H GLY A 55 -1.103 -13.576 -4.103 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -2.127 -14.123 -1.332 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -1.640 -12.516 -1.834 1.00 0.00 H new ATOM 871 N PHE A 56 -3.535 -13.809 -4.045 1.00 0.00 N ATOM 872 CA PHE A 56 -4.820 -13.660 -4.782 1.00 0.00 C ATOM 873 C PHE A 56 -5.033 -12.193 -5.154 1.00 0.00 C ATOM 874 O PHE A 56 -4.992 -11.315 -4.316 1.00 0.00 O ATOM 875 CB PHE A 56 -5.901 -14.145 -3.814 1.00 0.00 C ATOM 876 CG PHE A 56 -6.426 -15.479 -4.283 1.00 0.00 C ATOM 877 CD1 PHE A 56 -6.870 -15.631 -5.602 1.00 0.00 C ATOM 878 CD2 PHE A 56 -6.462 -16.567 -3.402 1.00 0.00 C ATOM 879 CE1 PHE A 56 -7.353 -16.869 -6.039 1.00 0.00 C ATOM 880 CE2 PHE A 56 -6.945 -17.806 -3.840 1.00 0.00 C ATOM 881 CZ PHE A 56 -7.390 -17.957 -5.159 1.00 0.00 C ATOM 0 H PHE A 56 -2.820 -14.351 -4.529 1.00 0.00 H new ATOM 0 HA PHE A 56 -4.838 -14.230 -5.711 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -5.491 -14.236 -2.808 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -6.712 -13.419 -3.763 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -6.840 -14.793 -6.282 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -6.117 -16.450 -2.385 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -7.698 -16.985 -7.056 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -6.974 -18.645 -3.161 1.00 0.00 H new ATOM 0 HZ PHE A 56 -7.762 -18.913 -5.497 1.00 0.00 H new ATOM 891 N SER A 57 -5.245 -11.919 -6.410 1.00 0.00 N ATOM 892 CA SER A 57 -5.442 -10.508 -6.844 1.00 0.00 C ATOM 893 C SER A 57 -6.638 -9.890 -6.134 1.00 0.00 C ATOM 894 O SER A 57 -6.814 -8.689 -6.123 1.00 0.00 O ATOM 895 CB SER A 57 -5.691 -10.580 -8.346 1.00 0.00 C ATOM 896 OG SER A 57 -4.502 -10.227 -9.039 1.00 0.00 O ATOM 0 H SER A 57 -5.291 -12.612 -7.157 1.00 0.00 H new ATOM 0 HA SER A 57 -4.579 -9.886 -6.604 1.00 0.00 H new ATOM 0 HB2 SER A 57 -6.003 -11.586 -8.626 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.501 -9.906 -8.624 1.00 0.00 H new ATOM 0 HG SER A 57 -4.660 -10.275 -10.005 1.00 0.00 H new ATOM 902 N SER A 58 -7.446 -10.699 -5.525 1.00 0.00 N ATOM 903 CA SER A 58 -8.622 -10.157 -4.799 1.00 0.00 C ATOM 904 C SER A 58 -8.121 -9.228 -3.706 1.00 0.00 C ATOM 905 O SER A 58 -8.711 -8.208 -3.410 1.00 0.00 O ATOM 906 CB SER A 58 -9.326 -11.370 -4.197 1.00 0.00 C ATOM 907 OG SER A 58 -9.263 -12.453 -5.114 1.00 0.00 O ATOM 0 H SER A 58 -7.345 -11.714 -5.497 1.00 0.00 H new ATOM 0 HA SER A 58 -9.300 -9.594 -5.440 1.00 0.00 H new ATOM 0 HB2 SER A 58 -8.854 -11.648 -3.255 1.00 0.00 H new ATOM 0 HB3 SER A 58 -10.365 -11.128 -3.973 1.00 0.00 H new ATOM 0 HG SER A 58 -9.713 -13.234 -4.729 1.00 0.00 H new ATOM 913 N MET A 59 -7.009 -9.567 -3.122 1.00 0.00 N ATOM 914 CA MET A 59 -6.430 -8.707 -2.068 1.00 0.00 C ATOM 915 C MET A 59 -5.368 -7.809 -2.699 1.00 0.00 C ATOM 916 O MET A 59 -4.983 -6.793 -2.153 1.00 0.00 O ATOM 917 CB MET A 59 -5.801 -9.672 -1.063 1.00 0.00 C ATOM 918 CG MET A 59 -4.970 -8.885 -0.047 1.00 0.00 C ATOM 919 SD MET A 59 -3.700 -9.965 0.657 1.00 0.00 S ATOM 920 CE MET A 59 -2.791 -10.273 -0.878 1.00 0.00 C ATOM 0 H MET A 59 -6.475 -10.410 -3.334 1.00 0.00 H new ATOM 0 HA MET A 59 -7.166 -8.064 -1.586 1.00 0.00 H new ATOM 0 HB2 MET A 59 -6.579 -10.238 -0.551 1.00 0.00 H new ATOM 0 HB3 MET A 59 -5.171 -10.394 -1.582 1.00 0.00 H new ATOM 0 HG2 MET A 59 -4.505 -8.025 -0.529 1.00 0.00 H new ATOM 0 HG3 MET A 59 -5.613 -8.498 0.744 1.00 0.00 H new ATOM 0 HE1 MET A 59 -1.733 -10.407 -0.654 1.00 0.00 H new ATOM 0 HE2 MET A 59 -3.177 -11.174 -1.355 1.00 0.00 H new ATOM 0 HE3 MET A 59 -2.915 -9.424 -1.551 1.00 0.00 H new ATOM 930 N ALA A 60 -4.900 -8.179 -3.861 1.00 0.00 N ATOM 931 CA ALA A 60 -3.870 -7.352 -4.542 1.00 0.00 C ATOM 932 C ALA A 60 -4.540 -6.216 -5.308 1.00 0.00 C ATOM 933 O ALA A 60 -3.978 -5.150 -5.465 1.00 0.00 O ATOM 934 CB ALA A 60 -3.155 -8.308 -5.496 1.00 0.00 C ATOM 0 H ALA A 60 -5.188 -9.018 -4.365 1.00 0.00 H new ATOM 0 HA ALA A 60 -3.173 -6.893 -3.841 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -2.377 -7.768 -6.037 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.704 -9.120 -4.926 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.873 -8.718 -6.206 1.00 0.00 H new ATOM 940 N LYS A 61 -5.750 -6.411 -5.758 1.00 0.00 N ATOM 941 CA LYS A 61 -6.436 -5.306 -6.470 1.00 0.00 C ATOM 942 C LYS A 61 -6.501 -4.139 -5.511 1.00 0.00 C ATOM 943 O LYS A 61 -6.280 -2.999 -5.866 1.00 0.00 O ATOM 944 CB LYS A 61 -7.833 -5.828 -6.789 1.00 0.00 C ATOM 945 CG LYS A 61 -7.760 -6.833 -7.936 1.00 0.00 C ATOM 946 CD LYS A 61 -8.842 -7.890 -7.735 1.00 0.00 C ATOM 947 CE LYS A 61 -10.214 -7.238 -7.895 1.00 0.00 C ATOM 948 NZ LYS A 61 -10.419 -7.124 -9.367 1.00 0.00 N ATOM 0 H LYS A 61 -6.283 -7.275 -5.664 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.935 -4.987 -7.384 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -8.265 -6.300 -5.907 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.488 -5.000 -7.060 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.900 -6.326 -8.891 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -6.776 -7.301 -7.965 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -8.721 -8.694 -8.461 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.751 -8.337 -6.745 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -10.994 -7.843 -7.434 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -10.244 -6.260 -7.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.691 -6.149 -9.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.536 -7.367 -9.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -11.173 -7.776 -9.664 1.00 0.00 H new ATOM 962 N LEU A 62 -6.758 -4.438 -4.274 1.00 0.00 N ATOM 963 CA LEU A 62 -6.789 -3.378 -3.256 1.00 0.00 C ATOM 964 C LEU A 62 -5.386 -2.790 -3.164 1.00 0.00 C ATOM 965 O LEU A 62 -5.204 -1.596 -3.066 1.00 0.00 O ATOM 966 CB LEU A 62 -7.164 -4.089 -1.958 1.00 0.00 C ATOM 967 CG LEU A 62 -7.055 -3.107 -0.798 1.00 0.00 C ATOM 968 CD1 LEU A 62 -8.411 -2.444 -0.555 1.00 0.00 C ATOM 969 CD2 LEU A 62 -6.623 -3.855 0.461 1.00 0.00 C ATOM 0 H LEU A 62 -6.948 -5.379 -3.929 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.489 -2.572 -3.475 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.179 -4.481 -2.024 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.504 -4.941 -1.792 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.317 -2.342 -1.041 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -8.329 -1.742 0.275 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -8.721 -1.909 -1.453 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.151 -3.207 -0.314 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.545 -3.154 1.292 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.361 -4.621 0.701 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -5.655 -4.325 0.291 1.00 0.00 H new ATOM 981 N CYS A 63 -4.390 -3.635 -3.233 1.00 0.00 N ATOM 982 CA CYS A 63 -2.990 -3.140 -3.182 1.00 0.00 C ATOM 983 C CYS A 63 -2.768 -2.190 -4.349 1.00 0.00 C ATOM 984 O CYS A 63 -2.002 -1.250 -4.271 1.00 0.00 O ATOM 985 CB CYS A 63 -2.115 -4.385 -3.322 1.00 0.00 C ATOM 986 SG CYS A 63 -1.616 -4.962 -1.680 1.00 0.00 S ATOM 0 H CYS A 63 -4.490 -4.646 -3.322 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.760 -2.601 -2.263 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -2.662 -5.170 -3.844 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.234 -4.157 -3.922 1.00 0.00 H new ATOM 0 HG CYS A 63 -0.874 -6.022 -1.800 1.00 0.00 H new ATOM 992 N HIS A 64 -3.459 -2.420 -5.430 1.00 0.00 N ATOM 993 CA HIS A 64 -3.319 -1.520 -6.601 1.00 0.00 C ATOM 994 C HIS A 64 -4.189 -0.290 -6.367 1.00 0.00 C ATOM 995 O HIS A 64 -3.903 0.796 -6.831 1.00 0.00 O ATOM 996 CB HIS A 64 -3.824 -2.324 -7.801 1.00 0.00 C ATOM 997 CG HIS A 64 -3.437 -1.616 -9.071 1.00 0.00 C ATOM 998 ND1 HIS A 64 -4.146 -1.775 -10.252 1.00 0.00 N ATOM 999 CD2 HIS A 64 -2.418 -0.742 -9.359 1.00 0.00 C ATOM 1000 CE1 HIS A 64 -3.549 -1.012 -11.187 1.00 0.00 C ATOM 1001 NE2 HIS A 64 -2.491 -0.362 -10.695 1.00 0.00 N ATOM 0 H HIS A 64 -4.114 -3.193 -5.550 1.00 0.00 H new ATOM 0 HA HIS A 64 -2.295 -1.185 -6.764 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -3.399 -3.327 -7.786 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.907 -2.436 -7.749 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -1.673 -0.401 -8.655 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -3.885 -0.935 -12.211 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -1.870 0.276 -11.192 1.00 0.00 H new ATOM 1009 N THR A 65 -5.251 -0.463 -5.630 1.00 0.00 N ATOM 1010 CA THR A 65 -6.160 0.675 -5.331 1.00 0.00 C ATOM 1011 C THR A 65 -5.451 1.686 -4.413 1.00 0.00 C ATOM 1012 O THR A 65 -5.370 2.859 -4.717 1.00 0.00 O ATOM 1013 CB THR A 65 -7.360 0.021 -4.635 1.00 0.00 C ATOM 1014 OG1 THR A 65 -8.293 -0.405 -5.619 1.00 0.00 O ATOM 1015 CG2 THR A 65 -8.039 1.014 -3.692 1.00 0.00 C ATOM 0 H THR A 65 -5.529 -1.354 -5.219 1.00 0.00 H new ATOM 0 HA THR A 65 -6.462 1.233 -6.217 1.00 0.00 H new ATOM 0 HB THR A 65 -7.010 -0.832 -4.054 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.540 -1.339 -5.453 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.888 0.533 -3.207 1.00 0.00 H new ATOM 0 HG22 THR A 65 -7.327 1.342 -2.935 1.00 0.00 H new ATOM 0 HG23 THR A 65 -8.387 1.876 -4.261 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.923 1.241 -3.302 1.00 0.00 N ATOM 1024 CA LEU A 66 -4.210 2.190 -2.393 1.00 0.00 C ATOM 1025 C LEU A 66 -3.063 2.843 -3.162 1.00 0.00 C ATOM 1026 O LEU A 66 -2.862 4.036 -3.105 1.00 0.00 O ATOM 1027 CB LEU A 66 -3.649 1.340 -1.244 1.00 0.00 C ATOM 1028 CG LEU A 66 -4.694 0.330 -0.758 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -4.296 -0.189 0.622 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -6.069 0.997 -0.673 1.00 0.00 C ATOM 0 H LEU A 66 -4.953 0.272 -2.986 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.869 2.974 -2.019 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.755 0.814 -1.577 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.350 1.987 -0.419 1.00 0.00 H new ATOM 0 HG LEU A 66 -4.743 -0.500 -1.463 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -5.039 -0.908 0.969 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -3.322 -0.675 0.561 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -4.243 0.644 1.323 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -6.805 0.271 -0.327 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -6.026 1.832 0.027 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -6.357 1.364 -1.658 1.00 0.00 H new ATOM 1042 N GLU A 67 -2.315 2.056 -3.886 1.00 0.00 N ATOM 1043 CA GLU A 67 -1.172 2.602 -4.670 1.00 0.00 C ATOM 1044 C GLU A 67 -1.681 3.546 -5.756 1.00 0.00 C ATOM 1045 O GLU A 67 -0.976 4.430 -6.203 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.496 1.354 -5.266 1.00 0.00 C ATOM 1047 CG GLU A 67 0.028 1.628 -6.682 1.00 0.00 C ATOM 1048 CD GLU A 67 0.468 0.312 -7.324 1.00 0.00 C ATOM 1049 OE1 GLU A 67 0.197 -0.727 -6.744 1.00 0.00 O ATOM 1050 OE2 GLU A 67 1.067 0.364 -8.385 1.00 0.00 O ATOM 0 H GLU A 67 -2.449 1.048 -3.968 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.477 3.189 -4.069 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.328 1.043 -4.624 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.208 0.529 -5.292 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.749 2.097 -7.285 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.866 2.324 -6.643 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.895 3.377 -6.181 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.427 4.279 -7.226 1.00 0.00 C ATOM 1059 C ASN A 68 -3.457 5.696 -6.682 1.00 0.00 C ATOM 1060 O ASN A 68 -3.056 6.639 -7.334 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.843 3.792 -7.484 1.00 0.00 C ATOM 1062 CG ASN A 68 -4.956 3.265 -8.916 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -5.108 2.077 -9.128 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -4.887 4.101 -9.915 1.00 0.00 N ATOM 0 H ASN A 68 -3.538 2.657 -5.852 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.826 4.276 -8.135 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -5.102 3.005 -6.776 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.551 4.606 -7.329 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.961 3.758 -10.873 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.760 5.097 -9.738 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.904 5.841 -5.469 1.00 0.00 N ATOM 1072 CA ILE A 69 -3.948 7.189 -4.852 1.00 0.00 C ATOM 1073 C ILE A 69 -2.532 7.681 -4.706 1.00 0.00 C ATOM 1074 O ILE A 69 -2.223 8.843 -4.879 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.597 6.981 -3.489 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -6.089 6.760 -3.686 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -4.379 8.220 -2.614 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -6.340 5.360 -4.242 1.00 0.00 C ATOM 0 H ILE A 69 -4.241 5.081 -4.878 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.502 7.922 -5.438 1.00 0.00 H new ATOM 0 HB ILE A 69 -4.150 6.116 -2.999 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -6.612 6.883 -2.737 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -6.489 7.509 -4.370 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -4.845 8.065 -1.641 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.310 8.388 -2.481 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -4.826 9.089 -3.096 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -7.411 5.210 -4.380 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -5.832 5.253 -5.200 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.957 4.617 -3.543 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.671 6.769 -4.431 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.237 7.119 -4.312 1.00 0.00 C ATOM 1092 C LEU A 70 0.308 7.326 -5.712 1.00 0.00 C ATOM 1093 O LEU A 70 1.354 7.909 -5.912 1.00 0.00 O ATOM 1094 CB LEU A 70 0.432 5.933 -3.614 1.00 0.00 C ATOM 1095 CG LEU A 70 -0.306 5.616 -2.310 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.589 4.768 -1.409 1.00 0.00 C ATOM 1097 CD2 LEU A 70 -0.666 6.916 -1.583 1.00 0.00 C ATOM 0 H LEU A 70 -1.892 5.785 -4.281 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.058 8.031 -3.742 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.423 5.062 -4.269 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.476 6.164 -3.405 1.00 0.00 H new ATOM 0 HG LEU A 70 -1.219 5.068 -2.543 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.063 4.543 -0.481 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.841 3.838 -1.918 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.503 5.317 -1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -1.191 6.682 -0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 70 0.245 7.469 -1.354 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -1.309 7.523 -2.220 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.430 6.884 -6.686 1.00 0.00 N ATOM 1110 CA ASP A 71 0.004 7.093 -8.081 1.00 0.00 C ATOM 1111 C ASP A 71 -0.423 8.493 -8.489 1.00 0.00 C ATOM 1112 O ASP A 71 0.374 9.283 -8.954 1.00 0.00 O ATOM 1113 CB ASP A 71 -0.714 6.026 -8.907 1.00 0.00 C ATOM 1114 CG ASP A 71 0.046 5.794 -10.213 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.716 6.712 -10.656 1.00 0.00 O ATOM 1116 OD2 ASP A 71 -0.056 4.702 -10.749 1.00 0.00 O ATOM 0 H ASP A 71 -1.314 6.388 -6.572 1.00 0.00 H new ATOM 0 HA ASP A 71 1.082 7.009 -8.222 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.779 5.096 -8.342 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -1.735 6.342 -9.120 1.00 0.00 H new ATOM 1121 N LYS A 72 -1.665 8.835 -8.271 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.095 10.203 -8.599 1.00 0.00 C ATOM 1123 C LYS A 72 -1.344 11.150 -7.683 1.00 0.00 C ATOM 1124 O LYS A 72 -0.921 12.222 -8.066 1.00 0.00 O ATOM 1125 CB LYS A 72 -3.568 10.200 -8.279 1.00 0.00 C ATOM 1126 CG LYS A 72 -4.334 9.446 -9.347 1.00 0.00 C ATOM 1127 CD LYS A 72 -5.561 8.867 -8.681 1.00 0.00 C ATOM 1128 CE LYS A 72 -5.276 7.437 -8.251 1.00 0.00 C ATOM 1129 NZ LYS A 72 -6.559 6.708 -8.446 1.00 0.00 N ATOM 0 H LYS A 72 -2.386 8.226 -7.884 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.907 10.508 -9.629 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -3.735 9.737 -7.306 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -3.935 11.224 -8.212 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -4.615 10.112 -10.163 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -3.719 8.656 -9.778 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -5.837 9.470 -7.816 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.406 8.890 -9.369 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -4.478 6.997 -8.850 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -4.954 7.395 -7.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -6.835 6.247 -7.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.300 7.379 -8.733 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.440 5.987 -9.186 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.145 10.718 -6.476 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.381 11.531 -5.505 1.00 0.00 C ATOM 1145 C ALA A 73 0.988 11.803 -6.110 1.00 0.00 C ATOM 1146 O ALA A 73 1.564 12.861 -5.948 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.270 10.642 -4.268 1.00 0.00 C ATOM 0 H ALA A 73 -1.484 9.825 -6.118 1.00 0.00 H new ATOM 0 HA ALA A 73 -0.839 12.489 -5.259 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.285 11.167 -3.491 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -1.268 10.402 -3.902 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.252 9.721 -4.527 1.00 0.00 H new ATOM 1153 N ARG A 74 1.492 10.850 -6.845 1.00 0.00 N ATOM 1154 CA ARG A 74 2.803 11.037 -7.510 1.00 0.00 C ATOM 1155 C ARG A 74 2.554 11.629 -8.903 1.00 0.00 C ATOM 1156 O ARG A 74 3.433 12.196 -9.520 1.00 0.00 O ATOM 1157 CB ARG A 74 3.426 9.625 -7.571 1.00 0.00 C ATOM 1158 CG ARG A 74 3.771 9.233 -9.015 1.00 0.00 C ATOM 1159 CD ARG A 74 4.433 7.853 -9.030 1.00 0.00 C ATOM 1160 NE ARG A 74 3.987 7.229 -10.306 1.00 0.00 N ATOM 1161 CZ ARG A 74 4.866 6.893 -11.211 1.00 0.00 C ATOM 1162 NH1 ARG A 74 5.715 7.780 -11.654 1.00 0.00 N ATOM 1163 NH2 ARG A 74 4.895 5.673 -11.672 1.00 0.00 N ATOM 0 H ARG A 74 1.047 9.948 -7.012 1.00 0.00 H new ATOM 0 HA ARG A 74 3.475 11.720 -6.990 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.327 9.595 -6.958 1.00 0.00 H new ATOM 0 HB3 ARG A 74 2.730 8.899 -7.151 1.00 0.00 H new ATOM 0 HG2 ARG A 74 2.867 9.220 -9.624 1.00 0.00 H new ATOM 0 HG3 ARG A 74 4.441 9.973 -9.453 1.00 0.00 H new ATOM 0 HD2 ARG A 74 5.519 7.935 -8.989 1.00 0.00 H new ATOM 0 HD3 ARG A 74 4.125 7.258 -8.170 1.00 0.00 H new ATOM 0 HE ARG A 74 2.994 7.064 -10.473 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.691 8.734 -11.293 1.00 0.00 H new ATOM 0 HH12 ARG A 74 6.402 7.519 -12.361 1.00 0.00 H new ATOM 0 HH21 ARG A 74 4.231 4.981 -11.325 1.00 0.00 H new ATOM 0 HH22 ARG A 74 5.582 5.411 -12.379 1.00 0.00 H new ATOM 1177 N ASN A 75 1.345 11.505 -9.389 1.00 0.00 N ATOM 1178 CA ASN A 75 1.015 12.062 -10.733 1.00 0.00 C ATOM 1179 C ASN A 75 0.504 13.499 -10.590 1.00 0.00 C ATOM 1180 O ASN A 75 0.235 14.170 -11.565 1.00 0.00 O ATOM 1181 CB ASN A 75 -0.082 11.153 -11.284 1.00 0.00 C ATOM 1182 CG ASN A 75 -0.007 11.133 -12.811 1.00 0.00 C ATOM 1183 OD1 ASN A 75 -0.337 12.106 -13.459 1.00 0.00 O ATOM 1184 ND2 ASN A 75 0.416 10.057 -13.417 1.00 0.00 N ATOM 0 H ASN A 75 0.572 11.041 -8.911 1.00 0.00 H new ATOM 0 HA ASN A 75 1.881 12.094 -11.394 1.00 0.00 H new ATOM 0 HB2 ASN A 75 0.035 10.143 -10.890 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -1.060 11.509 -10.962 1.00 0.00 H new ATOM 0 HD21 ASN A 75 0.470 10.033 -14.435 1.00 0.00 H new ATOM 0 HD22 ASN A 75 0.693 9.240 -12.872 1.00 0.00 H new ATOM 1191 N SER A 76 0.381 13.968 -9.371 1.00 0.00 N ATOM 1192 CA SER A 76 -0.098 15.364 -9.121 1.00 0.00 C ATOM 1193 C SER A 76 -1.620 15.474 -9.267 1.00 0.00 C ATOM 1194 O SER A 76 -2.147 16.555 -9.436 1.00 0.00 O ATOM 1195 CB SER A 76 0.601 16.243 -10.161 1.00 0.00 C ATOM 1196 OG SER A 76 -0.270 16.447 -11.265 1.00 0.00 O ATOM 0 H SER A 76 0.595 13.435 -8.528 1.00 0.00 H new ATOM 0 HA SER A 76 0.136 15.674 -8.102 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.877 17.200 -9.719 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.524 15.768 -10.494 1.00 0.00 H new ATOM 0 HG SER A 76 -0.520 15.581 -11.649 1.00 0.00 H new ATOM 1202 N GLU A 77 -2.344 14.385 -9.186 1.00 0.00 N ATOM 1203 CA GLU A 77 -3.822 14.502 -9.306 1.00 0.00 C ATOM 1204 C GLU A 77 -4.438 14.544 -7.912 1.00 0.00 C ATOM 1205 O GLU A 77 -5.283 15.365 -7.614 1.00 0.00 O ATOM 1206 CB GLU A 77 -4.287 13.277 -10.096 1.00 0.00 C ATOM 1207 CG GLU A 77 -3.387 13.071 -11.318 1.00 0.00 C ATOM 1208 CD GLU A 77 -3.795 14.045 -12.425 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -4.840 14.663 -12.289 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -3.057 14.157 -13.390 1.00 0.00 O ATOM 0 H GLU A 77 -1.982 13.442 -9.045 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.128 15.414 -9.819 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -4.260 12.392 -9.460 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -5.321 13.410 -10.414 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -2.344 13.231 -11.045 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -3.470 12.044 -11.674 1.00 0.00 H new ATOM 1217 N ILE A 78 -4.002 13.680 -7.049 1.00 0.00 N ATOM 1218 CA ILE A 78 -4.539 13.681 -5.656 1.00 0.00 C ATOM 1219 C ILE A 78 -3.392 13.590 -4.653 1.00 0.00 C ATOM 1220 O ILE A 78 -2.267 13.949 -4.938 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.407 12.430 -5.556 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.540 11.207 -5.818 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.526 12.498 -6.597 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -4.066 10.601 -4.499 1.00 0.00 C ATOM 0 H ILE A 78 -3.296 12.969 -7.242 1.00 0.00 H new ATOM 0 HA ILE A 78 -5.099 14.590 -5.439 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.848 12.364 -4.561 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -5.105 10.467 -6.384 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.681 11.486 -6.428 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -7.145 11.604 -6.525 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.140 13.380 -6.414 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.091 12.558 -7.595 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.447 9.727 -4.702 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.483 11.339 -3.948 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.930 10.304 -3.904 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.672 13.097 -3.483 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.616 12.952 -2.449 1.00 0.00 C ATOM 1238 C LYS A 79 -3.128 12.049 -1.336 1.00 0.00 C ATOM 1239 O LYS A 79 -4.062 11.293 -1.518 1.00 0.00 O ATOM 1240 CB LYS A 79 -2.342 14.368 -1.935 1.00 0.00 C ATOM 1241 CG LYS A 79 -3.445 14.807 -0.965 1.00 0.00 C ATOM 1242 CD LYS A 79 -4.171 16.019 -1.539 1.00 0.00 C ATOM 1243 CE LYS A 79 -3.146 17.068 -1.976 1.00 0.00 C ATOM 1244 NZ LYS A 79 -3.733 18.376 -1.572 1.00 0.00 N ATOM 0 H LYS A 79 -4.599 12.784 -3.196 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.703 12.501 -2.839 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -1.375 14.399 -1.434 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -2.289 15.062 -2.774 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.149 13.990 -0.804 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.014 15.053 0.006 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -4.786 15.720 -2.388 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.843 16.441 -0.792 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.183 16.903 -1.494 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -2.975 17.028 -3.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.085 19.145 -1.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.646 18.510 -2.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -3.878 18.388 -0.542 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.544 12.128 -0.184 1.00 0.00 N ATOM 1259 CA ILE A 80 -3.013 11.288 0.930 1.00 0.00 C ATOM 1260 C ILE A 80 -3.185 12.159 2.163 1.00 0.00 C ATOM 1261 O ILE A 80 -2.384 12.129 3.073 1.00 0.00 O ATOM 1262 CB ILE A 80 -1.928 10.267 1.188 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -0.570 10.836 0.830 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -2.197 8.984 0.399 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.333 10.748 -0.681 1.00 0.00 C ATOM 0 H ILE A 80 -1.759 12.742 0.032 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.963 10.806 0.698 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.931 10.023 2.250 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.507 11.875 1.154 1.00 0.00 H new ATOM 0 HG13 ILE A 80 0.211 10.290 1.359 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.405 8.262 0.598 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -3.156 8.564 0.703 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -2.222 9.211 -0.667 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.647 11.161 -0.920 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.374 9.705 -0.996 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.103 11.315 -1.204 1.00 0.00 H new ATOM 1277 N THR A 81 -4.210 12.944 2.182 1.00 0.00 N ATOM 1278 CA THR A 81 -4.460 13.852 3.342 1.00 0.00 C ATOM 1279 C THR A 81 -4.680 13.065 4.638 1.00 0.00 C ATOM 1280 O THR A 81 -5.659 13.274 5.321 1.00 0.00 O ATOM 1281 CB THR A 81 -5.745 14.573 2.956 1.00 0.00 C ATOM 1282 OG1 THR A 81 -6.787 13.620 2.792 1.00 0.00 O ATOM 1283 CG2 THR A 81 -5.524 15.320 1.643 1.00 0.00 C ATOM 0 H THR A 81 -4.903 13.004 1.436 1.00 0.00 H new ATOM 0 HA THR A 81 -3.618 14.518 3.531 1.00 0.00 H new ATOM 0 HB THR A 81 -6.021 15.281 3.737 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.616 14.081 2.545 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.440 15.839 1.361 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.720 16.046 1.768 1.00 0.00 H new ATOM 0 HG23 THR A 81 -5.253 14.610 0.862 1.00 0.00 H new ATOM 1291 N SER A 82 -3.791 12.165 4.980 1.00 0.00 N ATOM 1292 CA SER A 82 -3.980 11.363 6.219 1.00 0.00 C ATOM 1293 C SER A 82 -5.239 10.517 6.057 1.00 0.00 C ATOM 1294 O SER A 82 -5.184 9.309 6.015 1.00 0.00 O ATOM 1295 CB SER A 82 -4.141 12.380 7.348 1.00 0.00 C ATOM 1296 OG SER A 82 -3.450 11.916 8.500 1.00 0.00 O ATOM 0 H SER A 82 -2.944 11.954 4.452 1.00 0.00 H new ATOM 0 HA SER A 82 -3.148 10.690 6.426 1.00 0.00 H new ATOM 0 HB2 SER A 82 -3.748 13.349 7.039 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.197 12.523 7.576 1.00 0.00 H new ATOM 0 HG SER A 82 -3.550 12.567 9.226 1.00 0.00 H new ATOM 1302 N ASP A 83 -6.366 11.151 5.923 1.00 0.00 N ATOM 1303 CA ASP A 83 -7.630 10.406 5.710 1.00 0.00 C ATOM 1304 C ASP A 83 -7.465 9.501 4.502 1.00 0.00 C ATOM 1305 O ASP A 83 -7.719 8.314 4.560 1.00 0.00 O ATOM 1306 CB ASP A 83 -8.653 11.483 5.400 1.00 0.00 C ATOM 1307 CG ASP A 83 -10.031 11.050 5.901 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -10.184 9.883 6.223 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -10.912 11.892 5.955 1.00 0.00 O ATOM 0 H ASP A 83 -6.465 12.166 5.953 1.00 0.00 H new ATOM 0 HA ASP A 83 -7.916 9.792 6.564 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -8.362 12.421 5.874 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -8.688 11.666 4.326 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.003 10.048 3.409 1.00 0.00 N ATOM 1315 CA LEU A 84 -6.787 9.204 2.217 1.00 0.00 C ATOM 1316 C LEU A 84 -5.900 8.072 2.669 1.00 0.00 C ATOM 1317 O LEU A 84 -6.225 6.909 2.531 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.075 10.100 1.216 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.091 11.012 0.540 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.419 11.762 -0.611 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.250 10.174 -0.005 1.00 0.00 C ATOM 0 H LEU A 84 -6.770 11.035 3.298 1.00 0.00 H new ATOM 0 HA LEU A 84 -7.693 8.796 1.770 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.315 10.696 1.721 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -5.561 9.494 0.470 1.00 0.00 H new ATOM 0 HG LEU A 84 -7.473 11.729 1.267 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.146 12.414 -1.094 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.595 12.361 -0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.035 11.046 -1.337 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.976 10.828 -0.488 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.870 9.455 -0.731 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.731 9.641 0.815 1.00 0.00 H new ATOM 1333 N LEU A 85 -4.800 8.411 3.271 1.00 0.00 N ATOM 1334 CA LEU A 85 -3.924 7.340 3.799 1.00 0.00 C ATOM 1335 C LEU A 85 -4.771 6.424 4.653 1.00 0.00 C ATOM 1336 O LEU A 85 -4.746 5.222 4.533 1.00 0.00 O ATOM 1337 CB LEU A 85 -2.902 8.041 4.682 1.00 0.00 C ATOM 1338 CG LEU A 85 -1.702 8.372 3.834 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -1.044 9.651 4.343 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -0.698 7.220 3.880 1.00 0.00 C ATOM 0 H LEU A 85 -4.474 9.366 3.418 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.444 6.762 3.010 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -3.328 8.948 5.111 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -2.615 7.399 5.515 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.026 8.522 2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.177 9.885 3.725 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.758 10.473 4.292 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -0.726 9.510 5.376 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.167 7.467 3.264 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -0.377 7.058 4.909 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -1.167 6.313 3.499 1.00 0.00 H new ATOM 1352 N ASP A 86 -5.521 7.017 5.521 1.00 0.00 N ATOM 1353 CA ASP A 86 -6.399 6.232 6.424 1.00 0.00 C ATOM 1354 C ASP A 86 -7.185 5.202 5.618 1.00 0.00 C ATOM 1355 O ASP A 86 -7.426 4.099 6.068 1.00 0.00 O ATOM 1356 CB ASP A 86 -7.339 7.256 7.061 1.00 0.00 C ATOM 1357 CG ASP A 86 -7.381 7.041 8.575 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -7.870 6.004 8.993 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -6.923 7.916 9.291 1.00 0.00 O ATOM 0 H ASP A 86 -5.567 8.028 5.649 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.835 5.683 7.178 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.998 8.267 6.836 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.340 7.156 6.641 1.00 0.00 H new ATOM 1364 N LYS A 87 -7.574 5.545 4.423 1.00 0.00 N ATOM 1365 CA LYS A 87 -8.329 4.573 3.586 1.00 0.00 C ATOM 1366 C LYS A 87 -7.345 3.586 2.969 1.00 0.00 C ATOM 1367 O LYS A 87 -7.548 2.389 2.992 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.009 5.409 2.502 1.00 0.00 C ATOM 1369 CG LYS A 87 -9.876 6.490 3.149 1.00 0.00 C ATOM 1370 CD LYS A 87 -10.762 5.861 4.226 1.00 0.00 C ATOM 1371 CE LYS A 87 -12.158 6.484 4.167 1.00 0.00 C ATOM 1372 NZ LYS A 87 -12.419 6.974 5.550 1.00 0.00 N ATOM 0 H LYS A 87 -7.403 6.453 3.991 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.061 4.002 4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.258 5.869 1.860 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.623 4.769 1.868 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.244 7.262 3.589 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.494 6.975 2.393 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.827 4.783 4.075 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.323 6.019 5.211 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.196 7.300 3.445 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -12.905 5.752 3.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.360 7.415 5.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.383 6.174 6.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.697 7.675 5.812 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.266 4.085 2.437 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.248 3.184 1.842 1.00 0.00 C ATOM 1388 C ILE A 88 -4.642 2.334 2.960 1.00 0.00 C ATOM 1389 O ILE A 88 -4.231 1.209 2.762 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.223 4.138 1.223 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -4.610 4.405 -0.222 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -2.820 3.536 1.282 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.719 5.915 -0.451 1.00 0.00 C ATOM 0 H ILE A 88 -6.047 5.080 2.389 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.638 2.492 1.096 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.216 5.071 1.786 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.866 3.977 -0.894 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.560 3.922 -0.450 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.107 4.230 0.837 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.547 3.352 2.321 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.804 2.596 0.730 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.997 6.107 -1.487 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.479 6.329 0.211 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.759 6.385 -0.240 1.00 0.00 H new ATOM 1405 N PHE A 89 -4.608 2.877 4.140 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.058 2.127 5.305 1.00 0.00 C ATOM 1407 C PHE A 89 -5.095 1.121 5.780 1.00 0.00 C ATOM 1408 O PHE A 89 -4.782 0.109 6.374 1.00 0.00 O ATOM 1409 CB PHE A 89 -3.788 3.186 6.377 1.00 0.00 C ATOM 1410 CG PHE A 89 -3.582 2.516 7.715 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -4.687 2.168 8.500 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -2.286 2.248 8.172 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -4.496 1.550 9.743 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -2.095 1.630 9.414 1.00 0.00 C ATOM 1415 CZ PHE A 89 -3.200 1.282 10.199 1.00 0.00 C ATOM 0 H PHE A 89 -4.940 3.818 4.353 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.150 1.573 5.065 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.906 3.769 6.112 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -4.625 3.882 6.433 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -5.687 2.376 8.148 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.433 2.518 7.567 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.348 1.281 10.349 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.095 1.422 9.766 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.053 0.806 11.157 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.325 1.385 5.476 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.409 0.443 5.852 1.00 0.00 C ATOM 1427 C ALA A 90 -7.370 -0.711 4.862 1.00 0.00 C ATOM 1428 O ALA A 90 -7.590 -1.855 5.203 1.00 0.00 O ATOM 1429 CB ALA A 90 -8.708 1.238 5.717 1.00 0.00 C ATOM 0 H ALA A 90 -6.633 2.220 4.978 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.314 0.041 6.861 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.553 0.602 5.980 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -8.679 2.098 6.386 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -8.819 1.582 4.689 1.00 0.00 H new ATOM 1435 N GLY A 91 -7.046 -0.407 3.634 1.00 0.00 N ATOM 1436 CA GLY A 91 -6.937 -1.472 2.609 1.00 0.00 C ATOM 1437 C GLY A 91 -5.712 -2.312 2.954 1.00 0.00 C ATOM 1438 O GLY A 91 -5.724 -3.525 2.881 1.00 0.00 O ATOM 0 H GLY A 91 -6.852 0.537 3.300 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.835 -2.089 2.599 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.837 -1.038 1.614 1.00 0.00 H new ATOM 1442 N VAL A 92 -4.658 -1.665 3.368 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.436 -2.411 3.763 1.00 0.00 C ATOM 1444 C VAL A 92 -3.721 -3.140 5.078 1.00 0.00 C ATOM 1445 O VAL A 92 -3.019 -4.053 5.466 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.358 -1.336 3.938 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.296 -1.806 4.937 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -1.693 -1.066 2.586 1.00 0.00 C ATOM 0 H VAL A 92 -4.592 -0.650 3.449 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.122 -3.159 3.035 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.822 -0.425 4.316 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.537 -1.033 5.052 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.765 -2.000 5.902 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.830 -2.720 4.569 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.925 -0.302 2.704 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.237 -1.984 2.215 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.443 -0.720 1.874 1.00 0.00 H new ATOM 1458 N ASP A 93 -4.764 -2.743 5.759 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.121 -3.409 7.041 1.00 0.00 C ATOM 1460 C ASP A 93 -5.911 -4.689 6.758 1.00 0.00 C ATOM 1461 O ASP A 93 -5.816 -5.658 7.485 1.00 0.00 O ATOM 1462 CB ASP A 93 -5.981 -2.391 7.792 1.00 0.00 C ATOM 1463 CG ASP A 93 -5.179 -1.810 8.959 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -4.394 -0.906 8.721 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -5.363 -2.279 10.069 1.00 0.00 O ATOM 0 H ASP A 93 -5.384 -1.983 5.479 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.245 -3.698 7.621 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.292 -1.593 7.117 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -6.889 -2.868 8.162 1.00 0.00 H new ATOM 1470 N MET A 94 -6.681 -4.713 5.701 1.00 0.00 N ATOM 1471 CA MET A 94 -7.451 -5.949 5.387 1.00 0.00 C ATOM 1472 C MET A 94 -6.514 -6.993 4.773 1.00 0.00 C ATOM 1473 O MET A 94 -6.647 -8.175 5.021 1.00 0.00 O ATOM 1474 CB MET A 94 -8.543 -5.530 4.399 1.00 0.00 C ATOM 1475 CG MET A 94 -7.923 -4.818 3.196 1.00 0.00 C ATOM 1476 SD MET A 94 -9.093 -4.851 1.814 1.00 0.00 S ATOM 1477 CE MET A 94 -10.438 -3.964 2.638 1.00 0.00 C ATOM 0 H MET A 94 -6.808 -3.939 5.049 1.00 0.00 H new ATOM 0 HA MET A 94 -7.893 -6.398 6.276 1.00 0.00 H new ATOM 0 HB2 MET A 94 -9.098 -6.407 4.065 1.00 0.00 H new ATOM 0 HB3 MET A 94 -9.257 -4.871 4.893 1.00 0.00 H new ATOM 0 HG2 MET A 94 -7.677 -3.788 3.455 1.00 0.00 H new ATOM 0 HG3 MET A 94 -6.991 -5.306 2.910 1.00 0.00 H new ATOM 0 HE1 MET A 94 -11.182 -3.665 1.900 1.00 0.00 H new ATOM 0 HE2 MET A 94 -10.903 -4.615 3.379 1.00 0.00 H new ATOM 0 HE3 MET A 94 -10.040 -3.078 3.132 1.00 0.00 H new ATOM 1487 N ILE A 95 -5.548 -6.573 3.996 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.603 -7.546 3.410 1.00 0.00 C ATOM 1489 C ILE A 95 -3.749 -8.129 4.531 1.00 0.00 C ATOM 1490 O ILE A 95 -3.403 -9.293 4.524 1.00 0.00 O ATOM 1491 CB ILE A 95 -3.766 -6.725 2.443 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -2.909 -5.724 3.217 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -4.692 -5.975 1.493 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -1.932 -5.040 2.260 1.00 0.00 C ATOM 0 H ILE A 95 -5.380 -5.598 3.748 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.085 -8.382 2.903 1.00 0.00 H new ATOM 0 HB ILE A 95 -3.113 -7.388 1.876 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.545 -4.980 3.697 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.361 -6.234 4.009 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -4.097 -5.384 0.796 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -5.299 -6.689 0.937 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -5.343 -5.314 2.066 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.321 -4.326 2.813 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -1.288 -5.790 1.800 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.490 -4.516 1.484 1.00 0.00 H new ATOM 1506 N THR A 96 -3.439 -7.331 5.518 1.00 0.00 N ATOM 1507 CA THR A 96 -2.647 -7.849 6.659 1.00 0.00 C ATOM 1508 C THR A 96 -3.492 -8.901 7.358 1.00 0.00 C ATOM 1509 O THR A 96 -3.013 -9.943 7.762 1.00 0.00 O ATOM 1510 CB THR A 96 -2.408 -6.643 7.570 1.00 0.00 C ATOM 1511 OG1 THR A 96 -1.489 -5.759 6.946 1.00 0.00 O ATOM 1512 CG2 THR A 96 -1.839 -7.117 8.907 1.00 0.00 C ATOM 0 H THR A 96 -3.701 -6.347 5.579 1.00 0.00 H new ATOM 0 HA THR A 96 -1.699 -8.301 6.369 1.00 0.00 H new ATOM 0 HB THR A 96 -3.350 -6.124 7.745 1.00 0.00 H new ATOM 0 HG1 THR A 96 -1.977 -5.125 6.380 1.00 0.00 H new ATOM 0 HG21 THR A 96 -1.669 -6.257 9.555 1.00 0.00 H new ATOM 0 HG22 THR A 96 -2.546 -7.796 9.383 1.00 0.00 H new ATOM 0 HG23 THR A 96 -0.895 -7.636 8.737 1.00 0.00 H new ATOM 1520 N ARG A 97 -4.767 -8.641 7.472 1.00 0.00 N ATOM 1521 CA ARG A 97 -5.671 -9.634 8.107 1.00 0.00 C ATOM 1522 C ARG A 97 -5.905 -10.782 7.126 1.00 0.00 C ATOM 1523 O ARG A 97 -6.038 -11.927 7.513 1.00 0.00 O ATOM 1524 CB ARG A 97 -6.972 -8.879 8.385 1.00 0.00 C ATOM 1525 CG ARG A 97 -6.826 -8.065 9.672 1.00 0.00 C ATOM 1526 CD ARG A 97 -7.716 -6.823 9.593 1.00 0.00 C ATOM 1527 NE ARG A 97 -9.044 -7.269 10.101 1.00 0.00 N ATOM 1528 CZ ARG A 97 -9.956 -7.687 9.266 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -10.367 -6.905 8.305 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -10.457 -8.885 9.391 1.00 0.00 N ATOM 0 H ARG A 97 -5.218 -7.784 7.152 1.00 0.00 H new ATOM 0 HA ARG A 97 -5.263 -10.058 9.024 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.207 -8.219 7.550 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -7.800 -9.582 8.479 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -7.106 -8.672 10.533 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -5.786 -7.772 9.814 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -7.314 -6.010 10.198 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -7.788 -6.453 8.570 1.00 0.00 H new ATOM 0 HE ARG A 97 -9.240 -7.248 11.102 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -9.975 -5.968 8.207 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -11.080 -7.231 7.652 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -10.136 -9.496 10.142 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.170 -9.210 8.738 1.00 0.00 H new ATOM 1544 N MET A 98 -5.925 -10.486 5.852 1.00 0.00 N ATOM 1545 CA MET A 98 -6.112 -11.562 4.843 1.00 0.00 C ATOM 1546 C MET A 98 -4.855 -12.421 4.832 1.00 0.00 C ATOM 1547 O MET A 98 -4.908 -13.628 4.734 1.00 0.00 O ATOM 1548 CB MET A 98 -6.270 -10.844 3.502 1.00 0.00 C ATOM 1549 CG MET A 98 -7.673 -10.252 3.392 1.00 0.00 C ATOM 1550 SD MET A 98 -7.595 -8.690 2.477 1.00 0.00 S ATOM 1551 CE MET A 98 -8.621 -9.195 1.074 1.00 0.00 C ATOM 0 H MET A 98 -5.820 -9.546 5.471 1.00 0.00 H new ATOM 0 HA MET A 98 -6.971 -12.199 5.051 1.00 0.00 H new ATOM 0 HB2 MET A 98 -5.524 -10.054 3.412 1.00 0.00 H new ATOM 0 HB3 MET A 98 -6.095 -11.542 2.683 1.00 0.00 H new ATOM 0 HG2 MET A 98 -8.336 -10.952 2.884 1.00 0.00 H new ATOM 0 HG3 MET A 98 -8.088 -10.084 4.386 1.00 0.00 H new ATOM 0 HE1 MET A 98 -8.455 -8.515 0.239 1.00 0.00 H new ATOM 0 HE2 MET A 98 -8.355 -10.209 0.775 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.672 -9.166 1.362 1.00 0.00 H new ATOM 1561 N VAL A 99 -3.720 -11.788 4.945 1.00 0.00 N ATOM 1562 CA VAL A 99 -2.437 -12.539 4.960 1.00 0.00 C ATOM 1563 C VAL A 99 -2.331 -13.346 6.256 1.00 0.00 C ATOM 1564 O VAL A 99 -1.794 -14.435 6.277 1.00 0.00 O ATOM 1565 CB VAL A 99 -1.360 -11.454 4.896 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.028 -12.011 5.404 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.198 -10.989 3.448 1.00 0.00 C ATOM 0 H VAL A 99 -3.628 -10.776 5.028 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.344 -13.249 4.138 1.00 0.00 H new ATOM 0 HB VAL A 99 -1.658 -10.613 5.523 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.734 -11.233 5.355 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.142 -12.343 6.436 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.274 -12.854 4.783 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.431 -10.216 3.398 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.903 -11.834 2.825 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.144 -10.586 3.087 1.00 0.00 H new ATOM 1577 N ASP A 100 -2.849 -12.826 7.338 1.00 0.00 N ATOM 1578 CA ASP A 100 -2.786 -13.578 8.621 1.00 0.00 C ATOM 1579 C ASP A 100 -3.710 -14.785 8.538 1.00 0.00 C ATOM 1580 O ASP A 100 -3.450 -15.825 9.111 1.00 0.00 O ATOM 1581 CB ASP A 100 -3.263 -12.595 9.692 1.00 0.00 C ATOM 1582 CG ASP A 100 -3.578 -13.354 10.982 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -2.758 -14.162 11.387 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -4.635 -13.117 11.543 1.00 0.00 O ATOM 0 H ASP A 100 -3.310 -11.918 7.387 1.00 0.00 H new ATOM 0 HA ASP A 100 -1.786 -13.947 8.846 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -2.495 -11.844 9.878 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.150 -12.065 9.344 1.00 0.00 H new ATOM 1589 N LYS A 101 -4.771 -14.666 7.798 1.00 0.00 N ATOM 1590 CA LYS A 101 -5.694 -15.808 7.638 1.00 0.00 C ATOM 1591 C LYS A 101 -5.232 -16.615 6.427 1.00 0.00 C ATOM 1592 O LYS A 101 -5.245 -17.824 6.427 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.077 -15.165 7.465 1.00 0.00 C ATOM 1594 CG LYS A 101 -7.691 -15.479 6.099 1.00 0.00 C ATOM 1595 CD LYS A 101 -8.374 -14.236 5.590 1.00 0.00 C ATOM 1596 CE LYS A 101 -9.809 -14.596 5.214 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.587 -14.497 6.483 1.00 0.00 N ATOM 0 H LYS A 101 -5.037 -13.819 7.295 1.00 0.00 H new ATOM 0 HA LYS A 101 -5.722 -16.505 8.476 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -7.743 -15.521 8.252 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -6.992 -14.085 7.584 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -6.919 -15.801 5.401 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -8.406 -16.298 6.183 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -8.366 -13.459 6.354 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -7.843 -13.839 4.725 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -10.200 -13.914 4.459 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.865 -15.601 4.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -10.856 -15.450 6.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -10.004 -14.041 7.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -11.444 -13.931 6.321 1.00 0.00 H new ATOM 1611 N ILE A 102 -4.789 -15.939 5.400 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.295 -16.661 4.205 1.00 0.00 C ATOM 1613 C ILE A 102 -3.134 -17.526 4.664 1.00 0.00 C ATOM 1614 O ILE A 102 -2.882 -18.601 4.160 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.832 -15.569 3.242 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -5.029 -15.068 2.436 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.773 -16.123 2.288 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.589 -13.910 1.545 1.00 0.00 C ATOM 0 H ILE A 102 -4.750 -14.921 5.343 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.035 -17.299 3.722 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.400 -14.748 3.814 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.436 -15.876 1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.824 -14.743 3.108 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -2.450 -15.336 1.606 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.917 -16.480 2.862 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -3.195 -16.949 1.715 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -5.441 -13.550 0.968 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.202 -13.101 2.165 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.809 -14.251 0.865 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.449 -17.057 5.660 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.321 -17.832 6.224 1.00 0.00 C ATOM 1632 C VAL A 103 -1.903 -18.881 7.167 1.00 0.00 C ATOM 1633 O VAL A 103 -1.354 -19.948 7.359 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.486 -16.799 6.984 1.00 0.00 C ATOM 1635 CG1 VAL A 103 0.358 -17.494 8.054 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.438 -16.072 6.004 1.00 0.00 C ATOM 0 H VAL A 103 -2.625 -16.160 6.112 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.715 -18.350 5.481 1.00 0.00 H new ATOM 0 HB VAL A 103 -1.154 -16.083 7.463 1.00 0.00 H new ATOM 0 HG11 VAL A 103 0.949 -16.752 8.590 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.297 -18.011 8.755 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.024 -18.215 7.580 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.034 -15.336 6.544 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.100 -16.793 5.525 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.161 -15.569 5.245 1.00 0.00 H new ATOM 1646 N SER A 104 -3.028 -18.569 7.751 1.00 0.00 N ATOM 1647 CA SER A 104 -3.690 -19.524 8.686 1.00 0.00 C ATOM 1648 C SER A 104 -4.540 -20.534 7.916 1.00 0.00 C ATOM 1649 O SER A 104 -4.839 -21.611 8.392 1.00 0.00 O ATOM 1650 CB SER A 104 -4.578 -18.645 9.561 1.00 0.00 C ATOM 1651 OG SER A 104 -5.039 -19.398 10.676 1.00 0.00 O ATOM 0 H SER A 104 -3.521 -17.686 7.619 1.00 0.00 H new ATOM 0 HA SER A 104 -2.969 -20.101 9.265 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.021 -17.773 9.903 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.425 -18.276 8.983 1.00 0.00 H new ATOM 0 HG SER A 104 -5.608 -18.833 11.239 1.00 0.00 H new ATOM 1657 N GLU A 105 -4.931 -20.182 6.735 1.00 0.00 N ATOM 1658 CA GLU A 105 -5.770 -21.099 5.907 1.00 0.00 C ATOM 1659 C GLU A 105 -5.485 -20.893 4.416 1.00 0.00 C ATOM 1660 O GLU A 105 -5.537 -21.823 3.636 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.227 -20.738 6.229 1.00 0.00 C ATOM 1662 CG GLU A 105 -7.367 -19.233 6.452 1.00 0.00 C ATOM 1663 CD GLU A 105 -8.835 -18.887 6.701 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -9.618 -19.004 5.772 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -9.154 -18.512 7.818 1.00 0.00 O ATOM 0 H GLU A 105 -4.707 -19.290 6.295 1.00 0.00 H new ATOM 0 HA GLU A 105 -5.556 -22.144 6.129 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.875 -21.053 5.411 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -7.553 -21.276 7.119 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -6.760 -18.923 7.303 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -6.997 -18.690 5.582 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.183 -19.688 4.008 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.901 -19.448 2.564 1.00 0.00 C ATOM 1674 C GLY A 106 -6.105 -18.772 1.910 1.00 0.00 C ATOM 1675 O GLY A 106 -6.298 -18.856 0.714 1.00 0.00 O ATOM 0 H GLY A 106 -5.120 -18.866 4.608 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -4.016 -18.821 2.456 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.686 -20.392 2.064 1.00 0.00 H new ATOM 1679 N SER A 107 -6.914 -18.095 2.680 1.00 0.00 N ATOM 1680 CA SER A 107 -8.099 -17.411 2.088 1.00 0.00 C ATOM 1681 C SER A 107 -8.030 -15.920 2.363 1.00 0.00 C ATOM 1682 O SER A 107 -7.861 -15.498 3.480 1.00 0.00 O ATOM 1683 CB SER A 107 -9.308 -18.019 2.788 1.00 0.00 C ATOM 1684 OG SER A 107 -9.214 -19.437 2.748 1.00 0.00 O ATOM 0 H SER A 107 -6.806 -17.986 3.688 1.00 0.00 H new ATOM 0 HA SER A 107 -8.148 -17.541 1.007 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.354 -17.676 3.822 1.00 0.00 H new ATOM 0 HB3 SER A 107 -10.227 -17.691 2.302 1.00 0.00 H new ATOM 0 HG SER A 107 -9.303 -19.796 3.655 1.00 0.00 H new ATOM 1690 N ASP A 108 -8.181 -15.120 1.350 1.00 0.00 N ATOM 1691 CA ASP A 108 -8.156 -13.649 1.560 1.00 0.00 C ATOM 1692 C ASP A 108 -9.596 -13.169 1.740 1.00 0.00 C ATOM 1693 O ASP A 108 -9.887 -11.991 1.677 1.00 0.00 O ATOM 1694 CB ASP A 108 -7.539 -13.069 0.283 1.00 0.00 C ATOM 1695 CG ASP A 108 -8.555 -13.136 -0.858 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -9.441 -12.296 -0.885 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -8.429 -14.023 -1.686 1.00 0.00 O ATOM 0 H ASP A 108 -8.321 -15.420 0.385 1.00 0.00 H new ATOM 0 HA ASP A 108 -7.586 -13.344 2.438 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -7.235 -12.036 0.452 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.641 -13.626 0.016 1.00 0.00 H new ATOM 1702 N ASP A 109 -10.500 -14.089 1.952 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.932 -13.701 2.123 1.00 0.00 C ATOM 1704 C ASP A 109 -12.208 -13.222 3.552 1.00 0.00 C ATOM 1705 O ASP A 109 -12.748 -13.944 4.364 1.00 0.00 O ATOM 1706 CB ASP A 109 -12.722 -14.977 1.828 1.00 0.00 C ATOM 1707 CG ASP A 109 -12.280 -15.553 0.481 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -11.222 -16.158 0.436 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -13.008 -15.379 -0.483 1.00 0.00 O ATOM 0 H ASP A 109 -10.310 -15.089 2.014 1.00 0.00 H new ATOM 0 HA ASP A 109 -12.208 -12.878 1.464 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -12.559 -15.709 2.619 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -13.790 -14.760 1.809 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.855 -12.003 3.862 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.115 -11.479 5.236 1.00 0.00 C ATOM 1716 C ILE A 110 -13.312 -10.524 5.211 1.00 0.00 C ATOM 1717 O ILE A 110 -13.362 -9.560 5.949 1.00 0.00 O ATOM 1718 CB ILE A 110 -10.848 -10.722 5.636 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -10.534 -9.672 4.570 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -9.673 -11.696 5.763 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -9.733 -8.531 5.200 1.00 0.00 C ATOM 0 H ILE A 110 -11.399 -11.349 3.226 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.345 -12.279 5.939 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.006 -10.234 6.598 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -9.967 -10.123 3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.459 -9.287 4.139 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -8.775 -11.148 6.048 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.900 -12.442 6.524 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.507 -12.192 4.807 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.508 -7.782 4.441 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.317 -8.074 5.999 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -8.802 -8.923 5.610 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.271 -10.777 4.363 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.452 -9.872 4.291 1.00 0.00 C ATOM 1735 C GLY A 111 -14.990 -8.490 3.830 1.00 0.00 C ATOM 1736 O GLY A 111 -15.690 -7.507 3.973 1.00 0.00 O ATOM 0 H GLY A 111 -14.288 -11.568 3.719 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -16.192 -10.273 3.598 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -15.933 -9.802 5.266 1.00 0.00 H new ATOM 1740 N GLU A 112 -13.809 -8.411 3.281 1.00 0.00 N ATOM 1741 CA GLU A 112 -13.282 -7.098 2.811 1.00 0.00 C ATOM 1742 C GLU A 112 -14.238 -6.459 1.796 1.00 0.00 C ATOM 1743 O GLU A 112 -15.400 -6.804 1.714 1.00 0.00 O ATOM 1744 CB GLU A 112 -11.946 -7.429 2.148 1.00 0.00 C ATOM 1745 CG GLU A 112 -12.154 -8.559 1.143 1.00 0.00 C ATOM 1746 CD GLU A 112 -11.971 -8.022 -0.278 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -12.871 -7.354 -0.758 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -10.934 -8.291 -0.862 1.00 0.00 O ATOM 0 H GLU A 112 -13.183 -9.203 3.137 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.175 -6.385 3.628 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.547 -6.548 1.646 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.216 -7.725 2.901 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -11.444 -9.364 1.333 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -13.152 -8.982 1.257 1.00 0.00 H new ATOM 1755 N ASN A 113 -13.749 -5.528 1.024 1.00 0.00 N ATOM 1756 CA ASN A 113 -14.609 -4.853 0.009 1.00 0.00 C ATOM 1757 C ASN A 113 -13.736 -4.033 -0.936 1.00 0.00 C ATOM 1758 O ASN A 113 -13.723 -2.828 -0.884 1.00 0.00 O ATOM 1759 CB ASN A 113 -15.536 -3.942 0.814 1.00 0.00 C ATOM 1760 CG ASN A 113 -16.983 -4.169 0.369 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -17.235 -4.927 -0.546 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -17.950 -3.540 0.980 1.00 0.00 N ATOM 0 H ASN A 113 -12.783 -5.203 1.053 1.00 0.00 H new ATOM 0 HA ASN A 113 -15.172 -5.560 -0.601 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.434 -4.151 1.879 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -15.258 -2.899 0.666 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -18.917 -3.685 0.689 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.739 -2.903 1.748 1.00 0.00 H new ATOM 1769 N ILE A 114 -12.998 -4.680 -1.794 1.00 0.00 N ATOM 1770 CA ILE A 114 -12.114 -3.929 -2.731 1.00 0.00 C ATOM 1771 C ILE A 114 -12.930 -3.019 -3.645 1.00 0.00 C ATOM 1772 O ILE A 114 -12.840 -1.809 -3.566 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.395 -4.999 -3.550 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.872 -6.110 -2.627 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -10.223 -4.360 -4.293 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -10.369 -5.508 -1.311 1.00 0.00 C ATOM 0 H ILE A 114 -12.968 -5.695 -1.888 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.418 -3.285 -2.194 1.00 0.00 H new ATOM 0 HB ILE A 114 -12.094 -5.433 -4.264 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -11.665 -6.830 -2.427 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -10.065 -6.653 -3.119 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.706 -5.120 -4.879 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -10.595 -3.580 -4.957 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.530 -3.924 -3.573 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -10.001 -6.304 -0.664 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -9.562 -4.805 -1.517 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.186 -4.986 -0.814 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.725 -3.580 -4.516 1.00 0.00 N ATOM 1789 CA ASP A 115 -14.536 -2.721 -5.424 1.00 0.00 C ATOM 1790 C ASP A 115 -15.162 -1.589 -4.621 1.00 0.00 C ATOM 1791 O ASP A 115 -15.470 -0.532 -5.134 1.00 0.00 O ATOM 1792 CB ASP A 115 -15.611 -3.641 -6.002 1.00 0.00 C ATOM 1793 CG ASP A 115 -16.375 -2.906 -7.106 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -15.845 -1.935 -7.620 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -17.477 -3.328 -7.419 1.00 0.00 O ATOM 0 H ASP A 115 -13.847 -4.585 -4.637 1.00 0.00 H new ATOM 0 HA ASP A 115 -13.941 -2.267 -6.216 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -15.153 -4.545 -6.403 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -16.298 -3.953 -5.216 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.342 -1.817 -3.360 1.00 0.00 N ATOM 1801 CA VAL A 116 -15.942 -0.781 -2.481 1.00 0.00 C ATOM 1802 C VAL A 116 -14.862 0.098 -1.864 1.00 0.00 C ATOM 1803 O VAL A 116 -14.891 1.306 -1.970 1.00 0.00 O ATOM 1804 CB VAL A 116 -16.680 -1.570 -1.399 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -16.998 -0.650 -0.217 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -17.984 -2.129 -1.975 1.00 0.00 C ATOM 0 H VAL A 116 -15.097 -2.689 -2.890 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.605 -0.112 -3.029 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.050 -2.392 -1.058 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -17.524 -1.215 0.553 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -16.070 -0.253 0.195 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -17.627 0.174 -0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.511 -2.692 -1.204 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.612 -1.307 -2.317 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.758 -2.787 -2.814 1.00 0.00 H new ATOM 1816 N PHE A 117 -13.919 -0.504 -1.218 1.00 0.00 N ATOM 1817 CA PHE A 117 -12.831 0.289 -0.575 1.00 0.00 C ATOM 1818 C PHE A 117 -12.054 1.058 -1.639 1.00 0.00 C ATOM 1819 O PHE A 117 -11.389 2.034 -1.353 1.00 0.00 O ATOM 1820 CB PHE A 117 -11.927 -0.732 0.118 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.262 -0.777 1.589 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -11.821 0.245 2.438 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -13.016 -1.838 2.104 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -12.133 0.206 3.802 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -13.329 -1.877 3.468 1.00 0.00 C ATOM 1826 CZ PHE A 117 -12.886 -0.856 4.318 1.00 0.00 C ATOM 0 H PHE A 117 -13.846 -1.515 -1.102 1.00 0.00 H new ATOM 0 HA PHE A 117 -13.221 1.019 0.134 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -12.063 -1.717 -0.328 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.880 -0.461 -0.020 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -11.240 1.064 2.040 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -13.356 -2.627 1.449 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -11.793 0.995 4.456 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -13.912 -2.695 3.865 1.00 0.00 H new ATOM 0 HZ PHE A 117 -13.125 -0.888 5.371 1.00 0.00 H new ATOM 1836 N SER A 118 -12.155 0.642 -2.867 1.00 0.00 N ATOM 1837 CA SER A 118 -11.456 1.354 -3.949 1.00 0.00 C ATOM 1838 C SER A 118 -12.393 2.401 -4.497 1.00 0.00 C ATOM 1839 O SER A 118 -12.011 3.515 -4.761 1.00 0.00 O ATOM 1840 CB SER A 118 -11.149 0.286 -4.997 1.00 0.00 C ATOM 1841 OG SER A 118 -11.080 0.890 -6.282 1.00 0.00 O ATOM 0 H SER A 118 -12.699 -0.169 -3.163 1.00 0.00 H new ATOM 0 HA SER A 118 -10.542 1.853 -3.628 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.205 -0.207 -4.764 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.922 -0.483 -4.986 1.00 0.00 H new ATOM 0 HG SER A 118 -10.773 0.230 -6.938 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.631 2.036 -4.623 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.655 2.992 -5.128 1.00 0.00 C ATOM 1849 C ASP A 119 -14.947 4.008 -4.040 1.00 0.00 C ATOM 1850 O ASP A 119 -15.247 5.156 -4.293 1.00 0.00 O ATOM 1851 CB ASP A 119 -15.891 2.146 -5.436 1.00 0.00 C ATOM 1852 CG ASP A 119 -17.120 3.050 -5.540 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -17.590 3.499 -4.507 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -17.572 3.279 -6.650 1.00 0.00 O ATOM 0 H ASP A 119 -13.985 1.107 -4.396 1.00 0.00 H new ATOM 0 HA ASP A 119 -14.330 3.537 -6.014 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.748 1.602 -6.369 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -16.039 1.403 -4.653 1.00 0.00 H new ATOM 1859 N THR A 120 -14.822 3.580 -2.829 1.00 0.00 N ATOM 1860 CA THR A 120 -15.045 4.494 -1.682 1.00 0.00 C ATOM 1861 C THR A 120 -13.926 5.522 -1.685 1.00 0.00 C ATOM 1862 O THR A 120 -14.125 6.701 -1.479 1.00 0.00 O ATOM 1863 CB THR A 120 -14.975 3.590 -0.445 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.267 3.068 -0.167 1.00 0.00 O ATOM 1865 CG2 THR A 120 -14.475 4.383 0.760 1.00 0.00 C ATOM 0 H THR A 120 -14.572 2.624 -2.576 1.00 0.00 H new ATOM 0 HA THR A 120 -15.993 5.032 -1.714 1.00 0.00 H new ATOM 0 HB THR A 120 -14.282 2.772 -0.642 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.392 2.228 -0.656 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.430 3.730 1.632 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.481 4.777 0.549 1.00 0.00 H new ATOM 0 HG23 THR A 120 -15.157 5.209 0.960 1.00 0.00 H new ATOM 1873 N ILE A 121 -12.752 5.052 -1.941 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.564 5.938 -1.998 1.00 0.00 C ATOM 1875 C ILE A 121 -11.532 6.662 -3.351 1.00 0.00 C ATOM 1876 O ILE A 121 -11.219 7.833 -3.431 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.386 4.968 -1.819 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -9.743 5.220 -0.457 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.342 5.147 -2.923 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -8.631 4.198 -0.212 1.00 0.00 C ATOM 0 H ILE A 121 -12.556 4.067 -2.118 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.550 6.724 -1.243 1.00 0.00 H new ATOM 0 HB ILE A 121 -10.762 3.947 -1.879 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -9.336 6.230 -0.418 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -10.495 5.149 0.329 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.523 4.446 -2.766 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -9.802 4.957 -3.893 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.957 6.166 -2.898 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.175 4.382 0.761 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -9.050 3.192 -0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -7.874 4.291 -0.990 1.00 0.00 H new ATOM 1892 N LYS A 122 -11.869 5.976 -4.412 1.00 0.00 N ATOM 1893 CA LYS A 122 -11.874 6.628 -5.742 1.00 0.00 C ATOM 1894 C LYS A 122 -12.917 7.733 -5.743 1.00 0.00 C ATOM 1895 O LYS A 122 -12.746 8.775 -6.344 1.00 0.00 O ATOM 1896 CB LYS A 122 -12.252 5.517 -6.719 1.00 0.00 C ATOM 1897 CG LYS A 122 -11.007 5.136 -7.514 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.663 3.665 -7.284 1.00 0.00 C ATOM 1899 CE LYS A 122 -9.362 3.572 -6.481 1.00 0.00 C ATOM 1900 NZ LYS A 122 -8.760 2.272 -6.882 1.00 0.00 N ATOM 0 H LYS A 122 -12.140 4.993 -4.409 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.918 7.080 -6.006 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.638 4.652 -6.180 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.043 5.853 -7.390 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -11.176 5.316 -8.576 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -10.168 5.764 -7.214 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.472 3.170 -6.747 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.553 3.151 -8.239 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.696 4.404 -6.710 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.556 3.604 -5.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.937 2.070 -6.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -9.464 1.515 -6.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -8.457 2.322 -7.876 1.00 0.00 H new ATOM 1914 N SER A 123 -13.991 7.514 -5.046 1.00 0.00 N ATOM 1915 CA SER A 123 -15.047 8.548 -4.968 1.00 0.00 C ATOM 1916 C SER A 123 -14.659 9.581 -3.920 1.00 0.00 C ATOM 1917 O SER A 123 -15.189 10.674 -3.870 1.00 0.00 O ATOM 1918 CB SER A 123 -16.294 7.794 -4.536 1.00 0.00 C ATOM 1919 OG SER A 123 -16.890 7.175 -5.669 1.00 0.00 O ATOM 0 H SER A 123 -14.182 6.658 -4.525 1.00 0.00 H new ATOM 0 HA SER A 123 -15.198 9.076 -5.910 1.00 0.00 H new ATOM 0 HB2 SER A 123 -16.037 7.042 -3.790 1.00 0.00 H new ATOM 0 HB3 SER A 123 -17.002 8.478 -4.068 1.00 0.00 H new ATOM 0 HG SER A 123 -16.584 6.246 -5.733 1.00 0.00 H new ATOM 1925 N PHE A 124 -13.720 9.237 -3.093 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.258 10.187 -2.042 1.00 0.00 C ATOM 1927 C PHE A 124 -12.324 11.223 -2.662 1.00 0.00 C ATOM 1928 O PHE A 124 -11.794 12.084 -1.989 1.00 0.00 O ATOM 1929 CB PHE A 124 -12.502 9.326 -1.037 1.00 0.00 C ATOM 1930 CG PHE A 124 -12.489 10.011 0.309 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -11.553 11.019 0.573 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -13.411 9.639 1.293 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -11.541 11.654 1.821 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -13.401 10.274 2.541 1.00 0.00 C ATOM 1935 CZ PHE A 124 -12.465 11.281 2.805 1.00 0.00 C ATOM 0 H PHE A 124 -13.247 8.333 -3.096 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.082 10.728 -1.575 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -12.974 8.347 -0.954 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.481 9.159 -1.381 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -10.841 11.306 -0.186 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -14.132 8.861 1.090 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -10.819 12.431 2.025 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -14.115 9.987 3.299 1.00 0.00 H new ATOM 0 HZ PHE A 124 -12.456 11.770 3.768 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.120 11.134 -3.942 1.00 0.00 N ATOM 1946 CA ALA A 125 -11.218 12.104 -4.628 1.00 0.00 C ATOM 1947 C ALA A 125 -11.794 12.482 -5.994 1.00 0.00 C ATOM 1948 O ALA A 125 -11.070 12.711 -6.943 1.00 0.00 O ATOM 1949 CB ALA A 125 -9.890 11.364 -4.792 1.00 0.00 C ATOM 0 H ALA A 125 -12.539 10.429 -4.549 1.00 0.00 H new ATOM 0 HA ALA A 125 -11.100 13.030 -4.064 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -9.171 12.014 -5.291 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -9.506 11.083 -3.811 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.045 10.467 -5.391 1.00 0.00 H new ATOM 1955 N SER A 126 -13.093 12.553 -6.100 1.00 0.00 N ATOM 1956 CA SER A 126 -13.718 12.919 -7.403 1.00 0.00 C ATOM 1957 C SER A 126 -13.686 14.438 -7.592 1.00 0.00 C ATOM 1958 O SER A 126 -14.262 14.970 -8.520 1.00 0.00 O ATOM 1959 CB SER A 126 -15.159 12.421 -7.306 1.00 0.00 C ATOM 1960 OG SER A 126 -15.495 12.212 -5.941 1.00 0.00 O ATOM 0 H SER A 126 -13.749 12.373 -5.340 1.00 0.00 H new ATOM 0 HA SER A 126 -13.193 12.480 -8.252 1.00 0.00 H new ATOM 0 HB2 SER A 126 -15.838 13.148 -7.752 1.00 0.00 H new ATOM 0 HB3 SER A 126 -15.273 11.493 -7.866 1.00 0.00 H new ATOM 0 HG SER A 126 -15.227 11.308 -5.673 1.00 0.00 H new ATOM 1966 N SER A 127 -13.018 15.138 -6.717 1.00 0.00 N ATOM 1967 CA SER A 127 -12.948 16.622 -6.843 1.00 0.00 C ATOM 1968 C SER A 127 -11.766 17.022 -7.729 1.00 0.00 C ATOM 1969 O SER A 127 -10.620 16.792 -7.395 1.00 0.00 O ATOM 1970 CB SER A 127 -12.743 17.127 -5.416 1.00 0.00 C ATOM 1971 OG SER A 127 -13.269 18.442 -5.303 1.00 0.00 O ATOM 0 H SER A 127 -12.517 14.747 -5.919 1.00 0.00 H new ATOM 0 HA SER A 127 -13.843 17.042 -7.301 1.00 0.00 H new ATOM 0 HB2 SER A 127 -13.239 16.463 -4.708 1.00 0.00 H new ATOM 0 HB3 SER A 127 -11.682 17.125 -5.166 1.00 0.00 H new ATOM 0 HG SER A 127 -13.141 18.768 -4.388 1.00 0.00 H new ATOM 1977 N GLY A 128 -12.034 17.623 -8.856 1.00 0.00 N ATOM 1978 CA GLY A 128 -10.926 18.039 -9.761 1.00 0.00 C ATOM 1979 C GLY A 128 -10.109 19.143 -9.089 1.00 0.00 C ATOM 1980 O GLY A 128 -9.749 19.046 -7.932 1.00 0.00 O ATOM 0 H GLY A 128 -12.973 17.844 -9.189 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -10.287 17.186 -9.988 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -11.330 18.396 -10.708 1.00 0.00 H new ATOM 1984 N LYS A 129 -9.812 20.194 -9.804 1.00 0.00 N ATOM 1985 CA LYS A 129 -9.019 21.304 -9.205 1.00 0.00 C ATOM 1986 C LYS A 129 -9.318 22.615 -9.934 1.00 0.00 C ATOM 1987 O LYS A 129 -10.076 22.650 -10.882 1.00 0.00 O ATOM 1988 CB LYS A 129 -7.558 20.899 -9.405 1.00 0.00 C ATOM 1989 CG LYS A 129 -7.317 20.568 -10.879 1.00 0.00 C ATOM 1990 CD LYS A 129 -7.229 19.050 -11.052 1.00 0.00 C ATOM 1991 CE LYS A 129 -7.001 18.713 -12.528 1.00 0.00 C ATOM 1992 NZ LYS A 129 -8.088 17.757 -12.875 1.00 0.00 N ATOM 0 H LYS A 129 -10.085 20.332 -10.777 1.00 0.00 H new ATOM 0 HA LYS A 129 -9.256 21.463 -8.153 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -6.899 21.708 -9.091 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -7.321 20.035 -8.784 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -8.126 20.968 -11.490 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -6.396 21.038 -11.223 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -6.414 18.652 -10.448 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -8.147 18.580 -10.699 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -7.048 19.607 -13.149 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -6.018 18.268 -12.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -8.000 17.478 -13.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -8.014 16.913 -12.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -9.011 18.211 -12.723 1.00 0.00 H new ATOM 2006 N GLU A 130 -8.727 23.694 -9.501 1.00 0.00 N ATOM 2007 CA GLU A 130 -8.981 25.001 -10.174 1.00 0.00 C ATOM 2008 C GLU A 130 -7.656 25.695 -10.503 1.00 0.00 C ATOM 2009 O GLU A 130 -6.590 25.188 -10.217 1.00 0.00 O ATOM 2010 CB GLU A 130 -9.782 25.820 -9.162 1.00 0.00 C ATOM 2011 CG GLU A 130 -11.098 26.272 -9.798 1.00 0.00 C ATOM 2012 CD GLU A 130 -11.746 27.347 -8.925 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -11.496 27.343 -7.731 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -12.482 28.158 -9.464 1.00 0.00 O ATOM 0 H GLU A 130 -8.081 23.729 -8.713 1.00 0.00 H new ATOM 0 HA GLU A 130 -9.517 24.883 -11.116 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -9.982 25.223 -8.272 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -9.204 26.687 -8.841 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -10.915 26.663 -10.799 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -11.772 25.422 -9.907 1.00 0.00 H new ATOM 2021 N LYS A 131 -7.718 26.850 -11.105 1.00 0.00 N ATOM 2022 CA LYS A 131 -6.465 27.577 -11.456 1.00 0.00 C ATOM 2023 C LYS A 131 -6.785 29.032 -11.807 1.00 0.00 C ATOM 2024 O LYS A 131 -7.907 29.373 -12.126 1.00 0.00 O ATOM 2025 CB LYS A 131 -5.903 26.840 -12.673 1.00 0.00 C ATOM 2026 CG LYS A 131 -4.406 26.584 -12.475 1.00 0.00 C ATOM 2027 CD LYS A 131 -3.790 26.115 -13.796 1.00 0.00 C ATOM 2028 CE LYS A 131 -2.320 26.540 -13.859 1.00 0.00 C ATOM 2029 NZ LYS A 131 -2.174 27.210 -15.181 1.00 0.00 N ATOM 0 H LYS A 131 -8.582 27.323 -11.369 1.00 0.00 H new ATOM 0 HA LYS A 131 -5.752 27.597 -10.631 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.428 25.895 -12.813 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -6.065 27.431 -13.575 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -3.912 27.494 -12.134 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -4.254 25.830 -11.702 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -3.869 25.031 -13.881 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -4.338 26.542 -14.636 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -2.069 27.217 -13.043 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -1.656 25.680 -13.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -1.325 26.850 -15.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -3.012 27.012 -15.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -2.084 28.237 -15.042 1.00 0.00 H new ATOM 2043 N LEU A 132 -5.808 29.894 -11.751 1.00 0.00 N ATOM 2044 CA LEU A 132 -6.056 31.326 -12.079 1.00 0.00 C ATOM 2045 C LEU A 132 -5.507 31.651 -13.471 1.00 0.00 C ATOM 2046 O LEU A 132 -5.104 32.764 -13.745 1.00 0.00 O ATOM 2047 CB LEU A 132 -5.303 32.113 -11.007 1.00 0.00 C ATOM 2048 CG LEU A 132 -6.275 32.530 -9.902 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -7.313 33.495 -10.477 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -6.983 31.290 -9.351 1.00 0.00 C ATOM 0 H LEU A 132 -4.848 29.668 -11.492 1.00 0.00 H new ATOM 0 HA LEU A 132 -7.118 31.570 -12.092 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -4.501 31.504 -10.590 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -4.837 32.994 -11.448 1.00 0.00 H new ATOM 0 HG LEU A 132 -5.725 33.021 -9.099 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -8.007 33.794 -9.691 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -6.810 34.378 -10.871 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -7.863 33.002 -11.279 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -7.676 31.586 -8.563 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -7.534 30.799 -10.153 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -6.244 30.600 -8.943 1.00 0.00 H new ATOM 2062 N GLU A 133 -5.488 30.689 -14.351 1.00 0.00 N ATOM 2063 CA GLU A 133 -4.965 30.943 -15.723 1.00 0.00 C ATOM 2064 C GLU A 133 -5.859 30.263 -16.763 1.00 0.00 C ATOM 2065 O GLU A 133 -6.652 29.422 -16.375 1.00 0.00 O ATOM 2066 CB GLU A 133 -3.565 30.329 -15.734 1.00 0.00 C ATOM 2067 CG GLU A 133 -2.584 31.301 -16.391 1.00 0.00 C ATOM 2068 CD GLU A 133 -1.772 32.016 -15.311 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -2.381 32.591 -14.423 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -0.555 31.975 -15.387 1.00 0.00 O ATOM 0 H GLU A 133 -5.812 29.737 -14.180 1.00 0.00 H new ATOM 0 HA GLU A 133 -4.945 32.005 -15.968 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -3.246 30.107 -14.716 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -3.575 29.384 -16.277 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.918 30.762 -17.064 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -3.126 32.029 -16.995 1.00 0.00 H new TER 2077 GLU A 133